data_2kw9_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 2kw9 _Structure_validation_residue.Date_analyzed 2016-10-07 loop_ _Residue_analysis_software.Software_ID _Residue_analysis_software.Software_label _Residue_analysis_software.Method_ID _Residue_analysis_software.Method_label _Residue_analysis_software.Entry_ID _Residue_analysis_software.Structure_validation_oneline_list_ID 1 MolProbity . . ? 1 2 CYRANGE . . ? 1 stop_ loop_ _Residue_analysis.ID _Residue_analysis.PDB_model_num _Residue_analysis.Hydrogen_positions _Residue_analysis.MolProbity_flips _Residue_analysis.Cyrange_core_flag _Residue_analysis.Two_letter_chain_ID _Residue_analysis.PDB_strand_ID _Residue_analysis.PDB_residue_no _Residue_analysis.PDB_ins_code _Residue_analysis.PDB_residue_name _Residue_analysis.Assembly_ID _Residue_analysis.Entity_assembly_ID _Residue_analysis.Entity_ID _Residue_analysis.Comp_ID _Residue_analysis.Comp_index_ID _Residue_analysis.Clash_value _Residue_analysis.Clash_source_PDB_atom_name _Residue_analysis.Clash_destination_PDB_atom_name _Residue_analysis.Clash_destination_PDB_strand_ID _Residue_analysis.Clash_destination_PDB_residue_no _Residue_analysis.Clash_destination_PDB_ins_code _Residue_analysis.Clash_destination_PDB_residue_name _Residue_analysis.Cbeta_deviation_value _Residue_analysis.Rotamer_score _Residue_analysis.Rotamer_name _Residue_analysis.Ramachandran_phi _Residue_analysis.Ramachandran_psi _Residue_analysis.Ramachandran_score _Residue_analysis.Ramachandran_evaluation _Residue_analysis.Ramachandran_type _Residue_analysis.Bond_outlier_count _Residue_analysis.Worst_bond _Residue_analysis.Worst_bond_value _Residue_analysis.Worst_bond_sigma _Residue_analysis.Angle_outlier_count _Residue_analysis.Worst_angle _Residue_analysis.Worst_angle_value _Residue_analysis.Worst_angle_sigma _Residue_analysis.RNA_phosphate_perpendicular_outlier _Residue_analysis.RNA_suitness_score _Residue_analysis.RNA_suite_conformer _Residue_analysis.RNA_suite_triage _Residue_analysis.Max_b_factor _Residue_analysis.Tau_angle _Residue_analysis.Omega_dihedral _Residue_analysis.Disulfide_chi1 _Residue_analysis.Disulfide_chi2 _Residue_analysis.Disulfide_chi3 _Residue_analysis.Disulfide_ss_angle _Residue_analysis.Disulfide_ss _Residue_analysis.Disulfide_ss_angle_prime _Residue_analysis.Disulfide_chi2prime _Residue_analysis.Disulfide_chi1prime _Residue_analysis.Outlier_count_separate_geometry _Residue_analysis.Outlier_count _Residue_analysis.Entry_ID _Residue_analysis.Structure_validation_residue_list_ID . 001 nuclear orig core ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 83.4 mt . . . . . 0 CA--C 1.543 0.692 0 CA-C-O 120.632 0.253 . . . . 74.120000000000005 111.559 . . . . . . . . . 0 0 . 1 . 001 nuclear orig core ' A' A ' 23' ' ' PRO . . . . . 0.486 ' O ' ' HG ' ' A' ' 26' ' ' LEU . 38.7 Cg_exo -61.26 125.3 16.62 Favored 'Trans proline' 0 CA--C 1.541 0.84 0 C-N-CA 122.353 2.035 . . . . 74.519999999999996 112.459 177.364 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -77.73 -2.52 36.61 Favored 'General case' 0 N--CA 1.472 0.629 0 N-CA-C 112.087 0.403 . . . . 72.510000000000005 112.087 -178.122 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 23.0 m120 -101.93 31.37 3.92 Favored 'General case' 0 CA--C 1.54 0.562 0 N-CA-C 112.108 0.411 . . . . 73.150000000000006 112.108 179.94 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 26' ' ' LEU . . . . . 0.486 ' HG ' ' O ' ' A' ' 23' ' ' PRO . 92.5 mt -56.94 -44.29 82.37 Favored 'General case' 0 N--CA 1.471 0.578 0 CA-C-O 120.98 0.419 . . . . 74.340000000000003 111.122 177.307 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 5.4 m-20 -63.14 -31.8 73.03 Favored 'General case' 0 CA--C 1.54 0.579 0 CA-C-N 116.078 -0.51 . . . . 73.299999999999997 111.728 178.046 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 22.3 m-20 -75.59 -23.15 56.46 Favored 'General case' 0 CA--C 1.536 0.431 0 CA-C-N 116.244 -0.435 . . . . 65.010000000000005 112.13 -177.966 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 29' ' ' MET . . . . . . . . . . . . . 65.8 mtm -85.86 179.36 7.04 Favored 'General case' 0 CA--C 1.538 0.482 0 CA-C-O 121.498 0.666 . . . . 72.549999999999997 112.325 -177.278 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 30' ' ' LYS . . . . . 0.561 ' HB2' ' HG2' ' A' ' 33' ' ' GLU . 45.7 mtpt -85.69 158.71 19.99 Favored 'General case' 0 CA--C 1.538 0.493 0 CA-C-N 115.647 -0.706 . . . . 54.109999999999999 111.246 -179.255 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 60.9 t -57.04 -40.98 76.52 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.506 0 CA-C-O 121.055 0.455 . . . . 63.409999999999997 110.76 177.669 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -56.94 -43.98 82.05 Favored 'General case' 0 CA--C 1.538 0.494 0 CA-C-N 115.871 -0.604 . . . . 72.0 111.875 177.759 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 33' ' ' GLU . . . . . 0.561 ' HG2' ' HB2' ' A' ' 30' ' ' LYS . 5.4 mm-40 -60.13 -41.58 92.97 Favored 'General case' 0 N--CA 1.47 0.562 0 CA-C-O 121.112 0.482 . . . . 75.329999999999998 110.649 179.928 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 70.6 mt -62.95 -45.63 91.56 Favored 'General case' 0 N--CA 1.468 0.446 0 CA-C-N 115.952 -0.567 . . . . 75.319999999999993 110.685 176.88 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 28.1 mtpp -60.52 -34.12 73.64 Favored 'General case' 0 CA--C 1.542 0.635 0 CA-C-N 115.974 -0.557 . . . . 73.540000000000006 110.979 176.449 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 56.9 tp60 -64.76 -50.31 67.34 Favored 'General case' 0 CA--C 1.541 0.6 0 CA-C-O 121.024 0.44 . . . . 73.109999999999999 111.057 175.711 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 37' ' ' GLU . . . . . 0.414 ' O ' ' HG3' ' A' ' 41' ' ' ARG . 23.2 mm-40 -58.64 -40.0 82.15 Favored 'General case' 0 CA--C 1.539 0.546 0 CA-C-N 116.293 -0.412 . . . . 75.510000000000005 111.832 177.199 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 38' ' ' LEU . . . . . 0.481 ' HB2' HG13 ' A' ' 45' ' ' VAL . 92.3 mt -64.36 -56.04 17.07 Favored 'General case' 0 CA--C 1.538 0.49 0 N-CA-C 112.089 0.403 . . . . 75.230000000000004 112.089 178.422 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 19.8 ptpt -55.51 -40.88 72.35 Favored 'General case' 0 N--CA 1.473 0.703 0 N-CA-C 112.02 0.378 . . . . 75.519999999999996 112.02 -175.367 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 93.4 mt -66.13 -22.72 66.39 Favored 'General case' 0 N--CA 1.471 0.596 0 CA-C-O 120.883 0.373 . . . . 72.340000000000003 111.85 -179.255 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 41' ' ' ARG . . . . . 0.414 ' HG3' ' O ' ' A' ' 37' ' ' GLU . 75.7 mtt-85 -104.22 18.24 22.49 Favored 'General case' 0 CA--C 1.541 0.61 0 CA-C-O 120.73 0.3 . . . . 75.120000000000005 111.441 -179.676 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 33.1 t 67.0 16.57 10.38 Favored 'General case' 0 N--CA 1.478 0.932 0 C-N-CA 122.949 0.5 . . . . 63.240000000000002 112.315 178.458 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 65.6 mt -90.52 143.38 29.12 Favored Pre-proline 0 CA--C 1.542 0.641 0 N-CA-C 111.947 0.351 . . . . 75.540000000000006 111.947 -178.851 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 44' ' ' PRO . . . . . . . . . . . . . 42.9 Cg_endo -67.89 132.41 26.47 Favored 'Trans proline' 0 CA--C 1.542 0.891 0 C-N-CA 122.622 2.215 . . . . 75.319999999999993 113.008 176.812 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 45' ' ' VAL . . . . . 0.481 HG13 ' HB2' ' A' ' 38' ' ' LEU . 33.6 m -96.49 36.47 0.13 Allowed 'Isoleucine or valine' 0 N--CA 1.471 0.622 0 CA-C-N 116.122 -0.49 . . . . 72.450000000000003 111.806 -177.375 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 17.4 m -80.65 -61.67 1.9 Allowed 'General case' 0 CA--C 1.542 0.657 0 N-CA-C 114.064 1.135 . . . . 74.219999999999999 114.064 -168.777 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . -66.91 -170.82 4.4 Favored Glycine 0 CA--C 1.53 0.976 0 N-CA-C 115.996 1.159 . . . . 64.329999999999998 115.996 -166.944 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 48' ' ' THR . . . . . 0.573 ' O ' ' HG ' ' A' ' 52' ' ' LEU . 62.4 p -74.38 175.5 7.62 Favored 'General case' 0 N--CA 1.471 0.584 0 CA-C-N 115.295 -0.453 . . . . 63.140000000000001 111.749 -178.337 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 49' ' ' LYS . . . . . 0.426 ' O ' HG13 ' A' ' 53' ' ' ILE . 87.8 tttt -49.96 -53.79 24.11 Favored 'General case' 0 CA--C 1.543 0.677 0 N-CA-C 111.847 0.314 . . . . 75.439999999999998 111.847 -178.868 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 50' ' ' THR . . . . . . . . . . . . . 47.8 m -59.24 -43.28 92.39 Favored 'General case' 0 N--CA 1.473 0.705 0 CA-C-O 120.799 0.333 . . . . 71.25 111.595 179.351 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 51' ' ' GLU . . . . . 0.403 ' CD ' HH21 ' A' ' 55' ' ' ARG . 0.7 OUTLIER -53.61 -54.5 36.72 Favored 'General case' 0 CA--C 1.539 0.542 0 CA-C-O 120.941 0.401 . . . . 73.430000000000007 110.512 176.632 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 52' ' ' LEU . . . . . 0.573 ' HG ' ' O ' ' A' ' 48' ' ' THR . 25.7 mt -57.2 -47.62 80.81 Favored 'General case' 0 CA--C 1.54 0.586 0 CA-C-N 116.024 -0.534 . . . . 73.329999999999998 111.199 -179.718 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 53' ' ' ILE . . . . . 0.426 HG13 ' O ' ' A' ' 49' ' ' LYS . 91.2 mt -54.52 -52.73 37.57 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.616 0 CA-C-O 121.304 0.573 . . . . 60.439999999999998 111.678 177.951 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 35.0 mt-10 -70.95 -24.86 62.51 Favored 'General case' 0 CA--C 1.536 0.432 0 N-CA-C 112.164 0.431 . . . . 74.340000000000003 112.164 -178.253 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 55' ' ' ARG . . . . . 0.403 HH21 ' CD ' ' A' ' 51' ' ' GLU . 46.6 ttm-85 -68.52 -36.45 78.88 Favored 'General case' 0 CA--C 1.538 0.502 0 CA-C-O 121.095 0.474 . . . . 73.409999999999997 110.257 175.639 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 89.9 mt -61.4 -44.73 96.65 Favored 'General case' 0 N--CA 1.469 0.495 0 CA-C-N 116.176 -0.466 . . . . 74.420000000000002 110.81 172.556 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 40.3 mtm180 -62.89 -42.42 99.77 Favored 'General case' 0 N--CA 1.471 0.582 0 CA-C-O 121.027 0.442 . . . . 73.519999999999996 111.061 176.751 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 58' ' ' ALA . . . . . 0.401 ' O ' ' HG3' ' A' ' 62' ' ' GLN . . . -61.65 -39.45 91.39 Favored 'General case' 0 N--CA 1.469 0.495 0 CA-C-O 121.113 0.483 . . . . 74.540000000000006 111.482 178.027 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 59' ' ' TYR . . . . . . . . . . . . . 63.2 t80 -62.78 -47.17 84.63 Favored 'General case' 0 CA--C 1.537 0.462 0 CA-C-O 121.094 0.474 . . . . 75.510000000000005 110.806 176.021 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 60' ' ' GLN . . . . . . . . . . . . . 7.5 tp-100 -58.44 -44.62 89.26 Favored 'General case' 0 N--CA 1.468 0.468 0 CA-C-N 116.027 -0.533 . . . . 74.239999999999995 110.941 176.163 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 61' ' ' ASP . . . . . . . . . . . . . 31.9 t70 -59.03 -23.0 61.59 Favored 'General case' 0 CA--C 1.545 0.774 0 CA-C-O 121.208 0.527 . . . . 71.140000000000001 111.699 -178.401 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 62' ' ' GLN . . . . . 0.401 ' HG3' ' O ' ' A' ' 58' ' ' ALA . 48.5 mt-30 . . . . . 0 CA--C 1.54 0.592 0 CA-C-N 116.299 -0.409 . . . . 75.129999999999995 111.683 178.675 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 22' ' ' LEU . . . . . 0.565 ' HG ' ' HG3' ' A' ' 60' ' ' GLN . 97.0 mt . . . . . 0 N--CA 1.473 0.72 0 N-CA-C 112.331 0.493 . . . . 72.200000000000003 112.331 . . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 23' ' ' PRO . . . . . . . . . . . . . 5.3 Cg_endo -85.97 149.14 9.51 Favored 'Trans proline' 0 CA--C 1.542 0.88 0 C-N-CA 123.133 2.555 . . . . 74.209999999999994 111.764 171.987 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -74.96 -10.33 59.38 Favored 'General case' 0 N--CA 1.471 0.59 0 N-CA-C 112.108 0.41 . . . . 73.099999999999994 112.108 -179.081 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 14.1 m120 -84.97 28.75 0.68 Allowed 'General case' 0 CA--C 1.546 0.81 0 N-CA-C 112.586 0.587 . . . . 64.319999999999993 112.586 -177.554 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 85.5 mt -57.75 -62.23 1.95 Allowed 'General case' 0 N--CA 1.473 0.711 0 N-CA-C 112.606 0.595 . . . . 74.239999999999995 112.606 -177.059 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 27' ' ' ASP . . . . . 0.501 ' HA ' ' HE2' ' A' ' 49' ' ' LYS . 29.9 t70 -71.61 -20.23 62.01 Favored 'General case' 0 N--CA 1.471 0.589 0 CA-C-O 121.012 0.434 . . . . 70.239999999999995 111.13 -179.127 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 5.6 m-20 -67.77 -29.02 68.12 Favored 'General case' 0 CA--C 1.538 0.504 0 CA-C-N 116.49 -0.323 . . . . 73.239999999999995 110.941 175.087 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 29' ' ' MET . . . . . 0.469 ' O ' ' HE3' ' A' ' 49' ' ' LYS . 59.8 mtm -83.25 164.32 20.19 Favored 'General case' 0 CA--C 1.539 0.521 0 CA-C-O 120.739 0.304 . . . . 73.25 110.57 172.04 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 59.2 mtpt -86.45 166.25 15.67 Favored 'General case' 0 CA--C 1.54 0.587 0 CA-C-O 121.441 0.639 . . . . 70.030000000000001 112.676 -177.08 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 31' ' ' VAL . . . . . 0.459 HG11 HD12 ' A' ' 52' ' ' LEU . 61.4 t -53.34 -47.94 57.02 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.798 0 CA-C-N 115.694 -0.685 . . . . 73.319999999999993 112.096 -177.812 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -61.33 -27.28 68.38 Favored 'General case' 0 CA--C 1.539 0.526 0 N-CA-C 112.221 0.452 . . . . 60.100000000000001 112.221 -179.598 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 33' ' ' GLU . . . . . 0.42 ' O ' ' HB3' ' A' ' 36' ' ' GLN . 40.9 mt-10 -78.79 -39.58 35.41 Favored 'General case' 0 N--CA 1.47 0.574 0 CA-C-O 121.035 0.445 . . . . 72.040000000000006 111.334 -179.925 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 92.9 mt -66.74 -40.87 88.5 Favored 'General case' 0 CA--C 1.538 0.513 0 CA-C-O 120.703 0.287 . . . . 71.129999999999995 111.385 177.478 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 35' ' ' LYS . . . . . 0.5 ' HA ' HD11 ' A' ' 38' ' ' LEU . 96.3 mttt -61.23 -30.28 70.35 Favored 'General case' 0 CA--C 1.538 0.518 0 CA-C-O 120.872 0.368 . . . . 73.409999999999997 111.218 176.194 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 36' ' ' GLN . . . . . 0.42 ' HB3' ' O ' ' A' ' 33' ' ' GLU . 2.5 tt0 -61.82 -54.15 46.2 Favored 'General case' 0 CA--C 1.538 0.514 0 CA-C-O 121.125 0.488 . . . . 75.109999999999999 110.115 171.694 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 36.6 mm-40 -57.57 -26.22 61.14 Favored 'General case' 0 CA--C 1.54 0.594 0 CA-C-N 115.916 -0.583 . . . . 62.329999999999998 112.133 177.575 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 38' ' ' LEU . . . . . 0.5 HD11 ' HA ' ' A' ' 35' ' ' LYS . 93.7 mt -72.5 -56.91 4.64 Favored 'General case' 0 CA--C 1.535 0.381 0 CA-C-O 120.931 0.396 . . . . 74.040000000000006 111.571 175.182 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 39' ' ' LYS . . . . . 0.404 ' HE2' ' HB3' ' A' ' 39' ' ' LYS . 16.9 ptpt -61.86 -30.13 70.65 Favored 'General case' 0 CA--C 1.539 0.557 0 N-CA-C 112.197 0.443 . . . . 75.049999999999997 112.197 -175.734 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 75.8 mt -58.05 -25.6 61.41 Favored 'General case' 0 N--CA 1.473 0.676 0 CA-C-O 120.891 0.377 . . . . 75.420000000000002 111.754 174.867 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 41' ' ' ARG . . . . . . . . . . . . . 13.7 mtm180 -121.71 24.55 9.69 Favored 'General case' 0 CA--C 1.539 0.539 0 CA-C-O 120.778 0.323 . . . . 75.109999999999999 111.761 -178.567 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 23.2 t 62.46 33.51 16.08 Favored 'General case' 0 N--CA 1.475 0.807 0 N-CA-C 112.336 0.495 . . . . 73.319999999999993 112.336 174.935 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 76.3 mt -97.01 147.56 33.09 Favored Pre-proline 0 CA--C 1.542 0.661 0 CA-C-O 120.72 0.295 . . . . 72.549999999999997 111.596 178.546 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 44' ' ' PRO . . . . . . . . . . . . . 35.6 Cg_endo -64.16 122.81 10.92 Favored 'Trans proline' 0 CA--C 1.541 0.844 0 C-N-CA 122.859 2.373 . . . . 75.120000000000005 113.445 -178.04 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 33.7 m -98.93 31.19 0.41 Allowed 'Isoleucine or valine' 0 CA--C 1.545 0.767 0 CA-C-N 116.184 -0.462 . . . . 74.329999999999998 112.027 -177.498 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 78.5 p -93.94 -41.08 9.79 Favored 'General case' 0 N--CA 1.473 0.716 0 N-CA-C 112.754 0.65 . . . . 75.430000000000007 112.754 -175.514 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . -66.69 -179.33 10.68 Favored Glycine 0 CA--C 1.534 1.254 0 N-CA-C 115.078 0.791 . . . . 73.409999999999997 115.078 -174.021 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 48' ' ' THR . . . . . 0.604 ' O ' ' HG ' ' A' ' 52' ' ' LEU . 50.8 p -85.39 179.56 7.14 Favored 'General case' 0 N--CA 1.475 0.791 0 C-N-CA 122.811 0.444 . . . . 72.200000000000003 112.164 -178.254 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 49' ' ' LYS . . . . . 0.501 ' HE2' ' HA ' ' A' ' 27' ' ' ASP . 24.1 tptm -41.82 -58.7 1.93 Allowed 'General case' 0 N--CA 1.476 0.831 0 C-N-CA 123.418 0.687 . . . . 73.420000000000002 112.561 179.506 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 50' ' ' THR . . . . . . . . . . . . . 24.1 m -60.96 -38.32 85.5 Favored 'General case' 0 CA--C 1.537 0.467 0 CA-C-O 120.866 0.365 . . . . 73.209999999999994 111.583 -178.315 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 51' ' ' GLU . . . . . 0.455 ' O ' ' HB2' ' A' ' 55' ' ' ARG . 57.4 mm-40 -60.95 -42.44 98.23 Favored 'General case' 0 N--CA 1.469 0.524 0 CA-C-N 116.445 -0.343 . . . . 71.030000000000001 111.08 178.542 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 52' ' ' LEU . . . . . 0.604 ' HG ' ' O ' ' A' ' 48' ' ' THR . 14.3 mt -61.68 -45.48 93.8 Favored 'General case' 0 N--CA 1.467 0.406 0 CA-C-O 121.085 0.469 . . . . 74.319999999999993 110.628 179.15 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 53' ' ' ILE . . . . . . . . . . . . . 68.3 mt -58.5 -53.85 41.06 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.49 0 CA-C-N 115.746 -0.661 . . . . 75.239999999999995 111.332 178.341 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 40.5 mt-10 -65.07 -32.64 74.45 Favored 'General case' 0 CA--C 1.536 0.419 0 CA-C-N 116.394 -0.367 . . . . 71.340000000000003 111.38 -179.76 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 55' ' ' ARG . . . . . 0.455 ' HB2' ' O ' ' A' ' 51' ' ' GLU . 0.0 OUTLIER -60.1 -53.23 60.25 Favored 'General case' 0 CA--C 1.537 0.45 0 CA-C-O 121.19 0.519 . . . . 74.140000000000001 110.588 177.573 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 98.3 mt -57.29 -50.93 71.36 Favored 'General case' 0 CA--C 1.537 0.444 0 CA-C-N 115.834 -0.621 . . . . 73.120000000000005 111.363 176.269 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 19.9 mtp180 -63.81 -30.49 71.58 Favored 'General case' 0 CA--C 1.541 0.602 0 N-CA-C 112.187 0.44 . . . . 75.530000000000001 112.187 -178.487 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -71.46 -48.08 51.6 Favored 'General case' 0 N--CA 1.469 0.516 0 CA-C-O 121.216 0.531 . . . . 72.310000000000002 110.921 175.896 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 59' ' ' TYR . . . . . . . . . . . . . 74.1 t80 -61.21 -42.66 98.98 Favored 'General case' 0 CA--C 1.539 0.527 0 CA-C-O 121.074 0.464 . . . . 73.329999999999998 111.234 177.841 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 60' ' ' GLN . . . . . 0.565 ' HG3' ' HG ' ' A' ' 22' ' ' LEU . 21.7 tm0? -71.82 -36.83 70.34 Favored 'General case' 0 CA--C 1.538 0.516 0 CA-C-N 116.255 -0.43 . . . . 75.040000000000006 111.145 -178.528 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 61' ' ' ASP . . . . . . . . . . . . . 20.7 t70 -56.33 -40.77 74.98 Favored 'General case' 0 N--CA 1.47 0.556 0 CA-C-O 121.306 0.574 . . . . 71.239999999999995 111.064 178.984 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 62' ' ' GLN . . . . . . . . . . . . . 48.1 mt-30 . . . . . 0 CA--C 1.542 0.644 0 CA-C-N 115.377 -0.829 . . . . 70.140000000000001 112.148 -179.331 . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' A' A ' 22' ' ' LEU . . . . . 0.592 ' HG ' ' HG3' ' A' ' 60' ' ' GLN . 91.6 mt . . . . . 0 N--CA 1.472 0.655 0 N-CA-C 111.916 0.339 . . . . 75.439999999999998 111.916 . . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 23' ' ' PRO . . . . . . . . . . . . . 32.9 Cg_exo -62.19 166.61 12.42 Favored 'Trans proline' 0 CA--C 1.541 0.844 0 C-N-CA 122.656 2.237 . . . . 73.519999999999996 111.845 169.233 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -76.36 -65.07 0.97 Allowed 'General case' 0 CA--C 1.54 0.577 0 CA-C-O 120.963 0.411 . . . . 62.450000000000003 112.053 -177.532 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 25' ' ' ASN . . . . . 0.573 ' HB3' ' HB2' ' A' ' 28' ' ' ASP . 1.8 m-20 -81.27 67.54 7.25 Favored 'General case' 0 CA--C 1.541 0.613 0 CA-C-O 121.086 0.47 . . . . 71.230000000000004 111.85 -175.578 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 26' ' ' LEU . . . . . 0.418 HD23 ' HB3' ' A' ' 22' ' ' LEU . 95.4 mt -58.87 -51.75 68.66 Favored 'General case' 0 CA--C 1.542 0.635 0 N-CA-C 112.834 0.679 . . . . 72.120000000000005 112.834 -176.284 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 35.4 t70 -71.81 -17.01 62.19 Favored 'General case' 0 CA--C 1.54 0.578 0 CA-C-O 121.03 0.443 . . . . 71.409999999999997 111.622 -177.975 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 28' ' ' ASP . . . . . 0.573 ' HB2' ' HB3' ' A' ' 25' ' ' ASN . 6.0 m-20 -80.5 -25.26 38.85 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-O 120.775 0.322 . . . . 73.150000000000006 110.986 174.802 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 29' ' ' MET . . . . . 0.431 ' HG3' ' O ' ' A' ' 25' ' ' ASN . 87.4 mtp -67.74 139.95 56.69 Favored 'General case' 0 CA--C 1.537 0.448 0 CA-C-O 121.129 0.49 . . . . 73.109999999999999 110.575 173.835 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 49.9 mtmt -66.41 151.96 46.07 Favored 'General case' 0 CA--C 1.538 0.484 0 CA-C-O 121.023 0.439 . . . . 73.5 111.769 -176.514 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 31' ' ' VAL . . . . . 0.482 HG11 ' HE3' ' A' ' 35' ' ' LYS . 39.8 t -49.67 -42.74 17.87 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.684 0 CA-C-N 116.085 -0.507 . . . . 74.540000000000006 112.288 -176.842 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -63.04 -37.54 87.6 Favored 'General case' 0 CA--C 1.539 0.556 0 N-CA-C 111.854 0.316 . . . . 53.149999999999999 111.854 178.041 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 38.2 mt-10 -64.29 -40.55 96.17 Favored 'General case' 0 N--CA 1.469 0.518 0 CA-C-O 120.987 0.423 . . . . 75.310000000000002 111.114 179.114 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 88.1 mt -61.96 -46.17 90.47 Favored 'General case' 0 N--CA 1.468 0.47 0 CA-C-N 116.111 -0.495 . . . . 72.120000000000005 110.911 176.487 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 35' ' ' LYS . . . . . 0.482 ' HE3' HG11 ' A' ' 31' ' ' VAL . 98.0 mttt -63.8 -32.74 74.34 Favored 'General case' 0 CA--C 1.539 0.538 0 CA-C-N 116.199 -0.455 . . . . 73.540000000000006 111.602 177.311 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 36' ' ' GLN . . . . . 0.465 ' O ' ' HG ' ' A' ' 40' ' ' LEU . 25.6 tm0? -62.92 -41.75 99.57 Favored 'General case' 0 CA--C 1.538 0.502 0 CA-C-O 120.844 0.354 . . . . 74.140000000000001 110.704 176.744 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 52.9 mm-40 -67.18 -46.69 73.2 Favored 'General case' 0 CA--C 1.542 0.641 0 CA-C-O 120.907 0.384 . . . . 73.319999999999993 111.513 174.219 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 38' ' ' LEU . . . . . . . . . . . . . 81.1 mt -53.57 -52.51 59.52 Favored 'General case' 0 N--CA 1.47 0.574 0 N-CA-C 112.472 0.545 . . . . 74.120000000000005 112.472 179.942 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 18.4 ptpt -58.59 -40.37 82.98 Favored 'General case' 0 N--CA 1.473 0.678 0 N-CA-C 111.751 0.278 . . . . 72.420000000000002 111.751 -177.7 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 40' ' ' LEU . . . . . 0.465 ' HG ' ' O ' ' A' ' 36' ' ' GLN . 94.9 mt -59.69 -30.09 68.54 Favored 'General case' 0 N--CA 1.472 0.642 0 CA-C-O 121.341 0.591 . . . . 63.219999999999999 110.993 176.963 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 41' ' ' ARG . . . . . 0.43 ' NH1' ' OE1' ' A' ' 60' ' ' GLN . 60.2 mtt-85 -99.67 14.07 31.37 Favored 'General case' 0 CA--C 1.537 0.466 0 CA-C-N 115.695 -0.684 . . . . 74.310000000000002 111.778 -175.804 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 47.7 m 64.16 19.51 11.8 Favored 'General case' 0 N--CA 1.479 0.986 0 CA-C-O 121.066 0.46 . . . . 72.430000000000007 111.985 179.045 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 74.3 mt -91.03 146.52 33.83 Favored Pre-proline 0 CA--C 1.541 0.599 0 CA-C-N 116.085 -0.507 . . . . 73.230000000000004 111.639 -178.88 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 44' ' ' PRO . . . . . 0.525 ' HD2' ' HD3' ' A' ' 55' ' ' ARG . 33.6 Cg_exo -57.99 134.06 59.83 Favored 'Trans proline' 0 CA--C 1.545 1.03 0 C-N-CA 122.305 2.003 . . . . 75.420000000000002 112.546 174.737 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 34.0 m -105.64 -12.91 9.54 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.772 0 N-CA-C 112.57 0.581 . . . . 72.140000000000001 112.57 -175.197 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 57.4 p -85.0 37.13 0.65 Allowed 'General case' 0 N--CA 1.478 0.948 0 N-CA-C 112.802 0.667 . . . . 65.430000000000007 112.802 -174.933 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . -108.54 174.11 18.41 Favored Glycine 0 CA--C 1.529 0.92 0 C-N-CA 121.277 -0.487 . . . . 61.310000000000002 112.946 177.638 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 48' ' ' THR . . . . . 0.483 ' O ' ' HG ' ' A' ' 52' ' ' LEU . 70.6 p -80.96 162.1 24.01 Favored 'General case' 0 N--CA 1.474 0.76 0 O-C-N 122.437 -0.449 . . . . 75.340000000000003 111.476 177.811 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 22.8 tptm -37.99 -60.44 0.75 Allowed 'General case' 0 N--CA 1.478 0.946 0 N-CA-C 113.106 0.78 . . . . 72.329999999999998 113.106 -177.561 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 50' ' ' THR . . . . . . . . . . . . . 60.3 m -58.99 -41.01 86.59 Favored 'General case' 0 N--CA 1.472 0.629 0 N-CA-C 112.146 0.424 . . . . 73.209999999999994 112.146 -178.072 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 47.3 mt-10 -62.54 -41.99 99.24 Favored 'General case' 0 N--CA 1.469 0.489 0 CA-C-O 120.803 0.335 . . . . 75.420000000000002 111.274 179.784 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 52' ' ' LEU . . . . . 0.483 ' HG ' ' O ' ' A' ' 48' ' ' THR . 42.4 mt -57.63 -46.94 83.49 Favored 'General case' 0 N--CA 1.47 0.527 0 CA-C-O 121.254 0.549 . . . . 70.019999999999996 110.803 179.783 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 53' ' ' ILE . . . . . . . . . . . . . 66.3 mt -63.81 -57.5 11.42 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.55 0 CA-C-N 115.578 -0.737 . . . . 73.109999999999999 111.934 -179.685 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 21.0 mm-40 -60.03 -33.14 71.61 Favored 'General case' 0 CA--C 1.538 0.485 0 CA-C-N 116.277 -0.419 . . . . 72.019999999999996 111.86 -177.918 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 55' ' ' ARG . . . . . 0.525 ' HD3' ' HD2' ' A' ' 44' ' ' PRO . 40.5 ttm180 -64.19 -44.93 90.5 Favored 'General case' 0 CA--C 1.542 0.666 0 CA-C-O 120.814 0.34 . . . . 75.299999999999997 111.161 175.576 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 81.1 mt -57.73 -45.87 85.23 Favored 'General case' 0 N--CA 1.471 0.619 0 CA-C-O 121.232 0.539 . . . . 73.329999999999998 111.184 174.561 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 81.2 mtp180 -65.26 -43.11 92.34 Favored 'General case' 0 CA--C 1.536 0.439 0 CA-C-N 115.88 -0.6 . . . . 71.140000000000001 111.442 -179.041 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 58' ' ' ALA . . . . . 0.404 ' O ' ' HG3' ' A' ' 62' ' ' GLN . . . -60.93 -40.43 93.17 Favored 'General case' 0 CA--C 1.535 0.392 0 CA-C-O 120.916 0.389 . . . . 55.109999999999999 111.269 178.775 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 59' ' ' TYR . . . . . . . . . . . . . 81.5 t80 -59.55 -49.92 75.91 Favored 'General case' 0 CA--C 1.54 0.571 0 CA-C-N 115.848 -0.615 . . . . 74.010000000000005 111.395 176.396 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 60' ' ' GLN . . . . . 0.592 ' HG3' ' HG ' ' A' ' 22' ' ' LEU . 14.3 mm100 -66.75 -30.19 70.35 Favored 'General case' 0 N--CA 1.471 0.614 0 N-CA-C 111.885 0.328 . . . . 73.420000000000002 111.885 178.969 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 61' ' ' ASP . . . . . . . . . . . . . 17.2 t70 -63.37 -40.87 98.43 Favored 'General case' 0 CA--C 1.539 0.545 0 CA-C-O 120.942 0.401 . . . . 65.439999999999998 111.437 177.799 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 62' ' ' GLN . . . . . 0.404 ' HG3' ' O ' ' A' ' 58' ' ' ALA . 51.1 mt-30 . . . . . 0 CA--C 1.537 0.469 0 CA-C-N 116.319 -0.4 . . . . 72.209999999999994 111.768 179.389 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 76.2 mt . . . . . 0 N--CA 1.472 0.644 0 CA-C-O 120.843 0.354 . . . . 75.230000000000004 111.783 . . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' A' A ' 23' ' ' PRO . . . . . . . . . . . . . 87.4 Cg_endo -83.54 171.14 11.2 Favored 'Trans proline' 0 CA--C 1.538 0.704 0 C-N-CA 122.797 2.331 . . . . 74.230000000000004 112.37 171.643 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -92.97 -2.7 55.53 Favored 'General case' 0 CA--C 1.541 0.631 0 CA-C-O 120.816 0.341 . . . . 73.120000000000005 111.481 176.31 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 1.5 m-20 -88.35 19.86 3.59 Favored 'General case' 0 N--CA 1.473 0.687 0 N-CA-C 112.203 0.446 . . . . 74.549999999999997 112.203 -177.138 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 99.1 mt -54.14 -51.83 63.0 Favored 'General case' 0 CA--C 1.545 0.767 0 N-CA-C 112.877 0.695 . . . . 74.439999999999998 112.877 -174.544 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 17.6 t70 -76.86 -16.47 59.4 Favored 'General case' 0 CA--C 1.543 0.709 0 CA-C-O 121.001 0.429 . . . . 62.310000000000002 111.571 -179.15 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 24.7 t70 -81.12 -29.14 34.87 Favored 'General case' 0 CA--C 1.543 0.694 0 CA-C-O 120.89 0.376 . . . . 74.129999999999995 111.474 179.985 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 29' ' ' MET . . . . . . . . . . . . . 58.2 mtm -81.55 172.66 13.21 Favored 'General case' 0 CA--C 1.541 0.623 0 CA-C-O 121.368 0.604 . . . . 74.510000000000005 111.989 -179.491 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 48.8 mtmt -77.95 156.04 30.47 Favored 'General case' 0 CA--C 1.539 0.544 0 CA-C-N 115.672 -0.694 . . . . 74.409999999999997 111.563 -179.402 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 59.7 t -57.79 -35.22 50.35 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.584 0 CA-C-O 120.934 0.397 . . . . 72.239999999999995 111.31 179.183 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -59.87 -37.17 78.56 Favored 'General case' 0 CA--C 1.54 0.559 0 CA-C-N 116.523 -0.308 . . . . 53.439999999999998 111.659 176.659 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 23.5 mm-40 -64.63 -45.86 85.03 Favored 'General case' 0 N--CA 1.469 0.476 0 CA-C-O 121.224 0.535 . . . . 61.100000000000001 110.824 178.046 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 63.1 mt -58.43 -51.29 70.47 Favored 'General case' 0 CA--C 1.537 0.444 0 CA-C-N 115.8 -0.636 . . . . 74.310000000000002 110.887 176.907 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 56.7 mtmt -60.82 -31.19 70.61 Favored 'General case' 0 CA--C 1.54 0.592 0 CA-C-N 116.085 -0.507 . . . . 71.230000000000004 111.374 177.183 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER -64.57 -45.62 86.29 Favored 'General case' 0 CA--C 1.54 0.571 0 CA-C-N 116.206 -0.452 . . . . 72.450000000000003 110.621 177.387 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 42.1 mm-40 -66.11 -40.91 91.08 Favored 'General case' 0 CA--C 1.538 0.488 0 CA-C-O 120.995 0.426 . . . . 60.210000000000001 111.505 176.446 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 38' ' ' LEU . . . . . 0.425 HD11 ' HB3' ' A' ' 52' ' ' LEU . 94.5 mt -58.28 -53.67 55.61 Favored 'General case' 0 CA--C 1.538 0.483 0 N-CA-C 112.07 0.396 . . . . 63.32 112.07 178.547 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 39' ' ' LYS . . . . . 0.76 ' HZ2' ' HB3' ' A' ' 39' ' ' LYS . 0.5 OUTLIER -59.59 -31.97 69.96 Favored 'General case' 0 N--CA 1.472 0.649 0 N-CA-C 112.11 0.411 . . . . 75.420000000000002 112.11 -176.224 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 78.2 mt -68.26 -28.1 66.91 Favored 'General case' 0 N--CA 1.469 0.503 0 CA-C-O 121.038 0.447 . . . . 75.310000000000002 111.364 176.584 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 41' ' ' ARG . . . . . . . . . . . . . 53.1 mtt-85 -103.23 16.18 27.26 Favored 'General case' 0 CA--C 1.539 0.537 0 CA-C-N 116.368 -0.378 . . . . 71.010000000000005 111.663 -175.91 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 51.1 m 62.45 24.69 14.71 Favored 'General case' 0 N--CA 1.48 1.028 0 CA-C-O 121.144 0.497 . . . . 75.430000000000007 111.888 -179.475 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 78.1 mt -95.2 135.8 23.12 Favored Pre-proline 0 CA--C 1.542 0.65 0 CA-C-N 116.135 -0.484 . . . . 75.239999999999995 111.592 -179.039 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 44' ' ' PRO . . . . . . . . . . . . . 58.6 Cg_endo -70.98 143.56 45.3 Favored 'Trans proline' 0 CA--C 1.545 1.027 0 C-N-CA 122.752 2.301 . . . . 72.200000000000003 113.57 179.392 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 27.5 m -100.26 34.92 0.26 Allowed 'Isoleucine or valine' 0 N--CA 1.475 0.776 0 CA-C-O 121.389 0.614 . . . . 73.439999999999998 111.254 -179.718 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 37.3 m -74.94 -26.33 59.53 Favored 'General case' 0 N--CA 1.473 0.712 0 N-CA-C 114.009 1.115 . . . . 74.409999999999997 114.009 -169.371 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . -94.95 -171.95 37.24 Favored Glycine 0 CA--C 1.529 0.919 0 C-N-CA 120.655 -0.783 . . . . 73.349999999999994 114.522 -175.281 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 48' ' ' THR . . . . . 0.509 ' O ' ' HG ' ' A' ' 52' ' ' LEU . 81.3 p -84.77 179.67 7.29 Favored 'General case' 0 N--CA 1.471 0.584 0 C-N-CA 122.581 0.353 . . . . 71.120000000000005 111.273 178.097 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 49' ' ' LYS . . . . . 0.428 ' O ' HG13 ' A' ' 53' ' ' ILE . 87.4 tttt -46.23 -59.92 2.62 Favored 'General case' 0 N--CA 1.475 0.812 0 N-CA-C 112.32 0.489 . . . . 74.209999999999994 112.32 -178.384 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 50' ' ' THR . . . . . . . . . . . . . 94.9 m -58.62 -39.86 81.66 Favored 'General case' 0 N--CA 1.472 0.627 0 N-CA-C 111.869 0.322 . . . . 64.530000000000001 111.869 -178.845 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -57.44 -54.08 50.91 Favored 'General case' 0 CA--C 1.536 0.433 0 CA-C-O 120.924 0.392 . . . . 71.349999999999994 110.819 176.989 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 52' ' ' LEU . . . . . 0.509 ' HG ' ' O ' ' A' ' 48' ' ' THR . 42.6 mt -54.64 -41.42 70.04 Favored 'General case' 0 CA--C 1.538 0.495 0 CA-C-O 121.229 0.538 . . . . 64.209999999999994 111.088 178.969 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 53' ' ' ILE . . . . . 0.448 HG23 ' HD3' ' A' ' 57' ' ' ARG . 77.6 mt -62.16 -47.78 91.53 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.636 0 CA-C-N 115.946 -0.57 . . . . 72.239999999999995 111.258 176.711 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 36.6 mm-40 -62.5 -35.56 79.77 Favored 'General case' 0 N--CA 1.468 0.472 0 CA-C-N 116.471 -0.332 . . . . 72.329999999999998 111.506 177.387 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 47.9 ttm-85 -65.08 -45.09 86.71 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-O 120.953 0.406 . . . . 72.329999999999998 110.995 178.009 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 81.9 mt -59.17 -48.49 81.4 Favored 'General case' 0 CA--C 1.537 0.479 0 CA-C-O 120.99 0.424 . . . . 73.230000000000004 110.918 174.76 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 57' ' ' ARG . . . . . 0.448 ' HD3' HG23 ' A' ' 53' ' ' ILE . 7.8 mtp85 -64.37 -41.16 96.87 Favored 'General case' 0 N--CA 1.471 0.597 0 CA-C-N 116.268 -0.424 . . . . 71.510000000000005 112.139 179.859 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -67.63 -30.64 70.26 Favored 'General case' 0 N--CA 1.469 0.479 0 CA-C-O 121.147 0.499 . . . . 64.239999999999995 111.514 177.92 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 59' ' ' TYR . . . . . . . . . . . . . 77.0 t80 -74.93 -44.47 48.43 Favored 'General case' 0 CA--C 1.539 0.527 0 CA-C-O 121.069 0.462 . . . . 74.340000000000003 110.986 175.956 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 60' ' ' GLN . . . . . . . . . . . . . 8.9 tp-100 -65.52 -36.39 83.7 Favored 'General case' 0 CA--C 1.537 0.449 0 CA-C-N 116.367 -0.379 . . . . 75.109999999999999 110.912 178.409 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 61' ' ' ASP . . . . . . . . . . . . . 14.9 t70 -49.27 -32.44 10.84 Favored 'General case' 0 CA--C 1.543 0.69 0 CA-C-O 121.35 0.595 . . . . 75.0 111.404 175.771 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 62' ' ' GLN . . . . . . . . . . . . . 60.8 mt-30 . . . . . 0 CA--C 1.543 0.696 0 CA-C-N 115.99 -0.55 . . . . 74.0 112.457 -176.923 . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 95.1 mt . . . . . 0 N--CA 1.468 0.431 0 CA-C-O 120.624 0.25 . . . . 71.120000000000005 111.503 . . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' A' A ' 23' ' ' PRO . . . . . 0.475 ' O ' ' HG ' ' A' ' 26' ' ' LEU . 72.3 Cg_endo -75.61 135.58 18.15 Favored 'Trans proline' 0 CA--C 1.539 0.763 0 C-N-CA 122.333 2.022 . . . . 74.109999999999999 112.478 177.31 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -59.41 -16.42 23.19 Favored 'General case' 0 CA--C 1.542 0.647 0 CA-C-O 121.151 0.5 . . . . 75.329999999999998 111.707 178.657 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 25' ' ' ASN . . . . . 0.407 ' O ' ' HG3' ' A' ' 29' ' ' MET . 17.5 m120 -71.94 -2.64 18.82 Favored 'General case' 0 CA--C 1.541 0.609 0 N-CA-C 113.171 0.804 . . . . 71.340000000000003 113.171 -179.565 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 26' ' ' LEU . . . . . 0.475 ' HG ' ' O ' ' A' ' 23' ' ' PRO . 89.4 mt -54.8 -31.64 59.25 Favored 'General case' 0 N--CA 1.474 0.744 0 CA-C-O 121.415 0.626 . . . . 74.120000000000005 110.531 174.392 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 13.3 t70 -62.09 -48.81 78.51 Favored 'General case' 0 CA--C 1.542 0.654 0 CA-C-N 115.697 -0.683 . . . . 74.430000000000007 110.901 173.09 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 20.7 m-20 -66.61 -35.37 80.03 Favored 'General case' 0 CA--C 1.543 0.698 0 CA-C-N 115.983 -0.553 . . . . 75.140000000000001 111.609 -179.877 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 29' ' ' MET . . . . . 0.433 ' SD ' HD23 ' A' ' 26' ' ' LEU . 83.6 mtp -62.01 146.87 48.9 Favored 'General case' 0 CA--C 1.537 0.463 0 CA-C-O 121.249 0.547 . . . . 71.420000000000002 111.935 -178.43 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 30' ' ' LYS . . . . . 0.566 ' HB2' ' HG2' ' A' ' 33' ' ' GLU . 22.1 mtpp -75.24 170.08 16.77 Favored 'General case' 0 CA--C 1.538 0.501 0 CA-C-N 115.76 -0.655 . . . . 73.040000000000006 111.682 -176.298 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 31' ' ' VAL . . . . . 0.488 HG13 ' HE3' ' A' ' 35' ' ' LYS . 45.7 t -60.48 -46.4 95.43 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.669 0 CA-C-N 116.017 -0.538 . . . . 72.439999999999998 111.796 -177.354 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -63.99 -36.66 84.71 Favored 'General case' 0 N--CA 1.47 0.532 0 N-CA-C 112.069 0.396 . . . . 74.030000000000001 112.069 -179.785 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 33' ' ' GLU . . . . . 0.566 ' HG2' ' HB2' ' A' ' 30' ' ' LYS . 3.3 mm-40 -64.21 -45.65 87.32 Favored 'General case' 0 N--CA 1.471 0.578 0 CA-C-O 121.076 0.465 . . . . 64.230000000000004 110.806 -179.032 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 87.6 mt -59.4 -44.57 92.79 Favored 'General case' 0 CA--C 1.539 0.543 0 CA-C-N 116.032 -0.531 . . . . 71.25 110.903 177.607 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 35' ' ' LYS . . . . . 0.488 ' HE3' HG13 ' A' ' 31' ' ' VAL . 99.2 mttt -59.35 -35.87 74.68 Favored 'General case' 0 N--CA 1.469 0.488 0 CA-C-N 116.267 -0.424 . . . . 75.010000000000005 111.36 176.101 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 36' ' ' GLN . . . . . 0.504 ' O ' ' HG ' ' A' ' 40' ' ' LEU . 54.4 tp60 -59.69 -43.93 93.85 Favored 'General case' 0 CA--C 1.535 0.392 0 CA-C-N 116.371 -0.377 . . . . 71.230000000000004 111.217 178.916 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 37' ' ' GLU . . . . . 0.485 ' O ' ' HG3' ' A' ' 41' ' ' ARG . 35.1 mt-10 -67.63 -42.76 81.8 Favored 'General case' 0 CA--C 1.537 0.464 0 C-N-CA 121.082 -0.247 . . . . 75.150000000000006 111.224 176.33 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 38' ' ' LEU . . . . . . . . . . . . . 78.7 mt -52.07 -58.84 5.35 Favored 'General case' 0 N--CA 1.472 0.673 0 N-CA-C 111.863 0.32 . . . . 73.340000000000003 111.863 177.295 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 16.1 ptpt -55.98 -36.63 68.07 Favored 'General case' 0 N--CA 1.473 0.692 0 N-CA-C 111.891 0.33 . . . . 75.430000000000007 111.891 -177.999 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 40' ' ' LEU . . . . . 0.504 ' HG ' ' O ' ' A' ' 36' ' ' GLN . 92.3 mt -68.72 -29.76 68.26 Favored 'General case' 0 CA--C 1.538 0.501 0 CA-C-O 121.015 0.436 . . . . 73.129999999999995 111.33 178.083 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 41' ' ' ARG . . . . . 0.485 ' HG3' ' O ' ' A' ' 37' ' ' GLU . 53.9 mtt-85 -96.01 16.04 18.98 Favored 'General case' 0 CA--C 1.541 0.617 0 CA-C-N 116.327 -0.397 . . . . 75.409999999999997 111.454 -179.921 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 50.5 m 65.66 27.52 11.35 Favored 'General case' 0 N--CA 1.48 1.067 0 CA-C-O 121.356 0.598 . . . . 61.530000000000001 112.154 178.268 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 49.1 mt -102.28 144.75 29.22 Favored Pre-proline 0 CA--C 1.544 0.734 0 CA-C-N 116.192 -0.458 . . . . 75.120000000000005 111.385 -179.916 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 44' ' ' PRO . . . . . . . . . . . . . 57.6 Cg_endo -70.13 123.84 10.36 Favored 'Trans proline' 0 CA--C 1.542 0.888 0 C-N-CA 122.479 2.12 . . . . 72.549999999999997 112.944 178.802 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 28.3 m -82.27 -15.04 12.11 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.596 0 N-CA-C 112.853 0.686 . . . . 71.150000000000006 112.853 -174.598 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 65.9 m -71.18 79.56 0.7 Allowed 'General case' 0 N--CA 1.472 0.658 0 N-CA-C 112.358 0.503 . . . . 71.010000000000005 112.358 -178.272 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . -158.05 173.41 35.27 Favored Glycine 0 CA--C 1.526 0.764 0 C-N-CA 121.239 -0.505 . . . . 74.5 113.193 177.404 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 48' ' ' THR . . . . . 0.525 ' O ' ' HG ' ' A' ' 52' ' ' LEU . 72.3 p -77.58 158.53 29.78 Favored 'General case' 0 N--CA 1.474 0.739 0 O-C-N 122.779 -0.248 . . . . 75.219999999999999 110.715 176.808 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 60.0 tttm -49.04 -40.95 33.31 Favored 'General case' 0 N--CA 1.476 0.846 0 CA-C-O 120.729 0.299 . . . . 72.129999999999995 111.596 -177.228 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 50' ' ' THR . . . . . 0.453 ' O ' ' HG2' ' A' ' 54' ' ' GLU . 89.2 m -60.63 -54.77 41.32 Favored 'General case' 0 N--CA 1.469 0.481 0 CA-C-O 120.818 0.342 . . . . 71.349999999999994 110.96 174.714 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 10.0 mm-40 -54.5 -35.15 62.81 Favored 'General case' 0 N--CA 1.47 0.541 0 CA-C-N 116.22 -0.445 . . . . 72.409999999999997 111.971 -179.564 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 52' ' ' LEU . . . . . 0.525 ' HG ' ' O ' ' A' ' 48' ' ' THR . 46.5 mt -62.36 -49.77 74.24 Favored 'General case' 0 CA--C 1.537 0.466 0 CA-C-O 120.977 0.418 . . . . 72.5 110.912 177.962 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 53' ' ' ILE . . . . . 0.502 ' O ' ' HG3' ' A' ' 57' ' ' ARG . 66.6 mt -60.71 -51.61 71.13 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.481 0 CA-C-N 116.149 -0.478 . . . . 74.120000000000005 110.847 177.757 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 54' ' ' GLU . . . . . 0.453 ' HG2' ' O ' ' A' ' 50' ' ' THR . 7.5 mm-40 -55.54 -40.75 72.26 Favored 'General case' 0 N--CA 1.47 0.548 0 CA-C-O 121.155 0.503 . . . . 74.510000000000005 111.205 178.778 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 23.7 ttm180 -67.37 -38.6 85.0 Favored 'General case' 0 CA--C 1.536 0.428 0 CA-C-N 116.048 -0.524 . . . . 75.040000000000006 111.333 -178.685 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 89.7 mt -60.63 -41.45 94.92 Favored 'General case' 0 CA--C 1.535 0.401 0 CA-C-O 120.916 0.388 . . . . 72.209999999999994 110.555 172.292 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 57' ' ' ARG . . . . . 0.502 ' HG3' ' O ' ' A' ' 53' ' ' ILE . 44.2 mtm180 -60.98 -53.99 50.42 Favored 'General case' 0 C--O 1.221 -0.41 0 CA-C-N 116.29 -0.413 . . . . 74.299999999999997 111.018 177.902 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 58' ' ' ALA . . . . . 0.425 ' O ' ' HG3' ' A' ' 62' ' ' GLN . . . -49.74 -48.82 49.85 Favored 'General case' 0 N--CA 1.471 0.582 0 N-CA-C 112.302 0.482 . . . . 71.239999999999995 112.302 -178.518 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 59' ' ' TYR . . . . . . . . . . . . . 70.1 t80 -57.63 -56.83 16.79 Favored 'General case' 0 CA--C 1.54 0.587 0 CA-C-O 120.94 0.4 . . . . 64.420000000000002 111.714 178.022 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 60' ' ' GLN . . . . . . . . . . . . . 25.7 tm0? -66.47 -31.99 73.08 Favored 'General case' 0 CA--C 1.545 0.774 0 CA-C-N 116.131 -0.486 . . . . 62.229999999999997 111.485 -176.825 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 61' ' ' ASP . . . . . . . . . . . . . 32.6 t70 -64.34 -30.29 71.34 Favored 'General case' 0 CA--C 1.541 0.616 0 C-N-CA 123.267 0.627 . . . . 75.329999999999998 112.032 -177.622 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 62' ' ' GLN . . . . . 0.425 ' HG3' ' O ' ' A' ' 58' ' ' ALA . 47.2 mt-30 . . . . . 0 N--CA 1.472 0.652 0 CA-C-O 120.93 0.395 . . . . 74.129999999999995 111.61 179.712 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 22' ' ' LEU . . . . . 0.447 ' HG ' ' HG3' ' A' ' 60' ' ' GLN . 95.9 mt . . . . . 0 N--CA 1.471 0.615 0 CA-C-O 120.619 0.247 . . . . 75.329999999999998 111.378 . . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 23' ' ' PRO . . . . . 0.421 ' HD2' HD21 ' A' ' 26' ' ' LEU . 39.3 Cg_exo -62.44 140.41 81.97 Favored 'Trans proline' 0 CA--C 1.543 0.97 0 C-N-CA 122.195 1.93 . . . . 73.430000000000007 112.249 171.562 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -60.66 -55.35 34.32 Favored 'General case' 0 CA--C 1.541 0.6 0 N-CA-C 112.235 0.458 . . . . 75.140000000000001 112.235 -178.907 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 61.7 m-20 -91.84 84.84 5.44 Favored 'General case' 0 CA--C 1.536 0.43 0 CA-C-O 120.914 0.388 . . . . 75.329999999999998 111.813 -177.021 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 26' ' ' LEU . . . . . 0.421 HD21 ' HD2' ' A' ' 23' ' ' PRO . 98.6 mt -84.12 -32.98 24.42 Favored 'General case' 0 CA--C 1.538 0.496 0 CA-C-O 120.881 0.372 . . . . 73.5 111.062 176.886 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 4.7 m-20 -66.29 -40.81 90.29 Favored 'General case' 0 CA--C 1.538 0.517 0 CA-C-N 116.308 -0.406 . . . . 71.299999999999997 111.562 -179.898 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 1.9 m-20 -60.39 -44.65 95.46 Favored 'General case' 0 CA--C 1.538 0.494 0 CA-C-N 116.21 -0.45 . . . . 65.329999999999998 112.05 179.506 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 29' ' ' MET . . . . . . . . . . . . . 59.0 mtm -66.46 157.48 31.94 Favored 'General case' 0 CA--C 1.54 0.573 0 CA-C-O 120.995 0.426 . . . . 63.240000000000002 111.429 179.874 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 30' ' ' LYS . . . . . 0.459 ' HB2' ' HG2' ' A' ' 33' ' ' GLU . 46.5 mtmt -78.71 160.88 27.25 Favored 'General case' 0 N--CA 1.47 0.551 0 CA-C-O 120.978 0.418 . . . . 74.510000000000005 111.902 -174.659 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 31' ' ' VAL . . . . . 0.412 HG13 ' HE3' ' A' ' 35' ' ' LYS . 47.9 t -54.8 -40.34 51.76 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.547 0 CA-C-O 121.19 0.519 . . . . 72.109999999999999 110.941 177.011 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -59.59 -39.44 84.18 Favored 'General case' 0 CA--C 1.54 0.565 0 CA-C-N 116.043 -0.526 . . . . 74.430000000000007 111.656 176.834 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 33' ' ' GLU . . . . . 0.459 ' HG2' ' HB2' ' A' ' 30' ' ' LYS . 45.8 mm-40 -64.27 -45.89 86.11 Favored 'General case' 0 CA--C 1.537 0.444 0 CA-C-O 121.195 0.522 . . . . 62.009999999999998 110.559 178.134 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 94.3 mt -59.5 -40.78 88.16 Favored 'General case' 0 N--CA 1.468 0.442 0 CA-C-N 115.963 -0.562 . . . . 73.519999999999996 111.484 178.597 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 35' ' ' LYS . . . . . 0.425 ' HA ' HD11 ' A' ' 38' ' ' LEU . 99.6 mttt -61.6 -36.93 82.11 Favored 'General case' 0 CA--C 1.538 0.517 0 CA-C-O 121.022 0.439 . . . . 71.109999999999999 111.428 177.082 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 36' ' ' GLN . . . . . 0.404 ' O ' ' HG2' ' A' ' 39' ' ' LYS . 8.4 tm0? -63.58 -42.38 98.3 Favored 'General case' 0 CA--C 1.539 0.555 0 CA-C-O 121.105 0.479 . . . . 74.430000000000007 110.748 174.357 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 37' ' ' GLU . . . . . 0.406 ' HA ' HH21 ' A' ' 41' ' ' ARG . 18.0 mm-40 -65.16 -40.52 94.44 Favored 'General case' 0 CA--C 1.541 0.6 0 CA-C-N 116.437 -0.347 . . . . 73.239999999999995 111.775 175.433 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 38' ' ' LEU . . . . . 0.494 HD12 HD22 ' A' ' 52' ' ' LEU . 86.0 mt -57.0 -52.74 64.06 Favored 'General case' 0 N--CA 1.468 0.464 0 N-CA-C 112.142 0.423 . . . . 73.099999999999994 112.142 179.377 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 39' ' ' LYS . . . . . 0.404 ' HG2' ' O ' ' A' ' 36' ' ' GLN . 17.6 ptpt -58.3 -33.92 69.98 Favored 'General case' 0 CA--C 1.542 0.64 0 CA-C-O 120.757 0.313 . . . . 75.540000000000006 111.737 -178.135 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 65.4 mt -69.06 -22.5 64.02 Favored 'General case' 0 N--CA 1.471 0.615 0 CA-C-O 121.016 0.436 . . . . 73.430000000000007 111.373 176.119 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 41' ' ' ARG . . . . . 0.412 HH11 ' HD2' ' A' ' 41' ' ' ARG . 0.6 OUTLIER -101.8 14.16 32.77 Favored 'General case' 0 CA--C 1.543 0.687 0 CA-C-N 116.12 -0.491 . . . . 73.140000000000001 111.415 178.354 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 62.5 m 63.01 18.84 11.24 Favored 'General case' 0 N--CA 1.48 1.058 0 CA-C-O 121.107 0.48 . . . . 72.230000000000004 112.237 -179.178 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 76.3 mt -93.14 146.64 32.32 Favored Pre-proline 0 CA--C 1.542 0.64 0 C-N-CA 122.714 0.406 . . . . 73.230000000000004 111.526 -179.131 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 44' ' ' PRO . . . . . . . . . . . . . 73.8 Cg_endo -73.26 145.51 38.88 Favored 'Trans proline' 0 CA--C 1.541 0.841 0 C-N-CA 122.58 2.187 . . . . 61.43 112.799 178.092 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 34.1 m -88.93 19.08 0.59 Allowed 'Isoleucine or valine' 0 CA--C 1.544 0.733 0 N-CA-C 112.583 0.586 . . . . 74.409999999999997 112.583 -175.439 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 46.7 t -100.49 104.15 15.52 Favored 'General case' 0 N--CA 1.475 0.787 0 CA-C-O 120.814 0.34 . . . . 61.399999999999999 111.724 -177.929 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 171.24 -175.22 44.9 Favored Glycine 0 CA--C 1.527 0.817 0 C-N-CA 121.052 -0.594 . . . . 54.310000000000002 113.417 178.844 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 48' ' ' THR . . . . . 0.534 ' O ' ' HG ' ' A' ' 52' ' ' LEU . 43.8 p -96.98 169.2 9.99 Favored 'General case' 0 N--CA 1.472 0.666 0 O-C-N 122.661 -0.317 . . . . 74.400000000000006 111.537 -179.957 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 21.4 tptm -50.16 -55.22 15.97 Favored 'General case' 0 N--CA 1.473 0.683 0 N-CA-C 111.924 0.342 . . . . 71.129999999999995 111.924 -179.686 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 50' ' ' THR . . . . . 0.427 ' O ' ' HG2' ' A' ' 54' ' ' GLU . 91.5 m -63.64 -43.77 95.82 Favored 'General case' 0 N--CA 1.471 0.583 0 CA-C-O 120.791 0.329 . . . . 75.349999999999994 111.536 178.049 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 51' ' ' GLU . . . . . 0.405 ' HB2' ' OG1' ' A' ' 48' ' ' THR . 2.6 tm-20 -55.19 -54.74 39.53 Favored 'General case' 0 CA--C 1.539 0.557 0 C-N-CA 122.896 0.478 . . . . 64.010000000000005 111.838 -177.656 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 52' ' ' LEU . . . . . 0.534 ' HG ' ' O ' ' A' ' 48' ' ' THR . 40.8 mt -55.12 -39.39 69.34 Favored 'General case' 0 N--CA 1.471 0.583 0 CA-C-O 120.902 0.382 . . . . 75.430000000000007 111.851 -177.15 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 53' ' ' ILE . . . . . . . . . . . . . 77.9 mt -61.41 -45.01 99.5 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.442 0 CA-C-O 121.31 0.576 . . . . 73.209999999999994 110.821 175.364 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 54' ' ' GLU . . . . . 0.456 ' CD ' HH21 ' A' ' 57' ' ' ARG . 8.9 mm-40 -64.93 -35.45 81.2 Favored 'General case' 0 N--CA 1.468 0.426 0 CA-C-N 115.772 -0.649 . . . . 63.350000000000001 111.207 179.064 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 55' ' ' ARG . . . . . 0.437 HH11 ' HD3' ' A' ' 55' ' ' ARG . 13.2 ttm180 -68.61 -39.76 80.69 Favored 'General case' 0 CA--C 1.541 0.599 0 CA-C-N 116.16 -0.473 . . . . 74.25 110.647 178.165 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 59.1 mt -59.75 -53.23 60.34 Favored 'General case' 0 N--CA 1.47 0.559 0 CA-C-N 116.293 -0.412 . . . . 72.140000000000001 111.228 174.138 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 57' ' ' ARG . . . . . 0.456 HH21 ' CD ' ' A' ' 54' ' ' GLU . 40.5 mtm105 -57.38 -45.89 83.97 Favored 'General case' 0 CA--C 1.537 0.47 0 CA-C-O 120.687 0.279 . . . . 75.040000000000006 111.442 179.594 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 58' ' ' ALA . . . . . 0.421 ' O ' ' HG3' ' A' ' 62' ' ' GLN . . . -60.33 -34.39 73.75 Favored 'General case' 0 N--CA 1.47 0.531 0 N-CA-C 112.115 0.413 . . . . 64.340000000000003 112.115 -179.624 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 59' ' ' TYR . . . . . . . . . . . . . 71.2 t80 -75.27 -54.17 7.53 Favored 'General case' 0 CA--C 1.539 0.549 0 CA-C-O 120.962 0.411 . . . . 74.219999999999999 111.555 179.176 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 60' ' ' GLN . . . . . 0.447 ' HG3' ' HG ' ' A' ' 22' ' ' LEU . 24.4 tm0? -60.26 -32.57 71.29 Favored 'General case' 0 CA--C 1.542 0.66 0 CA-C-O 120.923 0.392 . . . . 73.310000000000002 111.072 -177.865 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 61' ' ' ASP . . . . . . . . . . . . . 15.8 t70 -57.53 -29.96 64.79 Favored 'General case' 0 CA--C 1.545 0.756 0 C-N-CA 122.977 0.511 . . . . 70.530000000000001 111.909 175.169 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 62' ' ' GLN . . . . . 0.421 ' HG3' ' O ' ' A' ' 58' ' ' ALA . 68.9 mt-30 . . . . . 0 N--CA 1.473 0.68 0 CA-C-O 120.889 0.376 . . . . 64.329999999999998 112.002 -177.487 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 22' ' ' LEU . . . . . 0.54 ' HG ' ' HG3' ' A' ' 60' ' ' GLN . 97.2 mt . . . . . 0 CA--C 1.539 0.527 0 N-CA-C 111.83 0.308 . . . . 73.329999999999998 111.83 . . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 23' ' ' PRO . . . . . 0.442 ' O ' ' HG ' ' A' ' 26' ' ' LEU . 39.8 Cg_endo -67.82 120.7 7.71 Favored 'Trans proline' 0 CA--C 1.539 0.735 0 C-N-CA 122.186 1.924 . . . . 71.420000000000002 111.715 174.409 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -57.06 -11.95 1.84 Allowed 'General case' 0 N--CA 1.475 0.798 0 N-CA-C 112.861 0.689 . . . . 65.540000000000006 112.861 -177.201 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 25' ' ' ASN . . . . . 0.53 ' HB3' ' HB2' ' A' ' 28' ' ' ASP . 18.8 m120 -92.38 33.76 1.08 Allowed 'General case' 0 CA--C 1.542 0.651 0 N-CA-C 112.265 0.468 . . . . 72.430000000000007 112.265 179.408 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 26' ' ' LEU . . . . . 0.442 ' HG ' ' O ' ' A' ' 23' ' ' PRO . 95.6 mt -54.23 -33.16 57.73 Favored 'General case' 0 N--CA 1.474 0.762 0 CA-C-O 120.785 0.326 . . . . 74.040000000000006 111.859 -179.671 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 11.3 m-20 -69.15 -38.94 79.04 Favored 'General case' 0 N--CA 1.47 0.548 0 CA-C-O 120.826 0.346 . . . . 73.530000000000001 111.554 175.159 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 28' ' ' ASP . . . . . 0.53 ' HB2' ' HB3' ' A' ' 25' ' ' ASN . 6.3 m-20 -69.64 -32.61 71.38 Favored 'General case' 0 CA--C 1.539 0.549 0 CA-C-N 116.285 -0.416 . . . . 71.439999999999998 111.319 179.057 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 29' ' ' MET . . . . . . . . . . . . . 84.2 mtp -66.32 140.33 58.1 Favored 'General case' 0 N--CA 1.468 0.426 0 CA-C-O 121.001 0.429 . . . . 74.530000000000001 111.307 178.82 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 55.1 mtmt -79.1 158.94 27.7 Favored 'General case' 0 CA--C 1.541 0.605 0 CA-C-O 120.945 0.403 . . . . 72.329999999999998 111.899 -177.892 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 94.9 t -49.58 -49.26 19.45 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.7 0 N-CA-C 112.842 0.682 . . . . 61.310000000000002 112.842 -176.097 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -57.92 -37.69 74.53 Favored 'General case' 0 N--CA 1.469 0.524 0 CA-C-O 120.855 0.359 . . . . 70.239999999999995 111.591 179.657 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 40.6 mt-10 -65.84 -48.55 71.26 Favored 'General case' 0 N--CA 1.466 0.338 0 CA-C-N 116.214 -0.448 . . . . 73.540000000000006 111.172 178.347 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 91.5 mt -58.55 -45.37 89.07 Favored 'General case' 0 N--CA 1.469 0.477 0 CA-C-O 120.965 0.412 . . . . 74.420000000000002 111.293 178.25 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 35' ' ' LYS . . . . . 0.475 ' HA ' HD13 ' A' ' 38' ' ' LEU . 98.0 mttt -62.83 -31.28 72.25 Favored 'General case' 0 CA--C 1.54 0.592 0 CA-C-O 121.003 0.43 . . . . 74.340000000000003 111.565 177.159 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 23.7 tm0? -70.05 -43.91 70.24 Favored 'General case' 0 CA--C 1.542 0.656 0 CA-C-O 121.06 0.457 . . . . 75.25 109.85 175.192 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 37' ' ' GLU . . . . . 0.473 ' HB3' ' NH2' ' A' ' 41' ' ' ARG . 52.8 mm-40 -58.15 -32.66 68.39 Favored 'General case' 0 N--CA 1.473 0.682 0 CA-C-N 115.945 -0.571 . . . . 72.230000000000004 111.86 174.436 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 38' ' ' LEU . . . . . 0.475 HD13 ' HA ' ' A' ' 35' ' ' LYS . 99.1 mt -69.45 -58.23 4.25 Favored 'General case' 0 CA--C 1.539 0.547 0 CA-C-N 116.289 -0.414 . . . . 65.120000000000005 111.913 178.116 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 39' ' ' LYS . . . . . 0.74 ' HZ3' ' HB3' ' A' ' 39' ' ' LYS . 0.3 OUTLIER -57.83 -31.62 66.82 Favored 'General case' 0 N--CA 1.474 0.741 0 N-CA-C 112.373 0.508 . . . . 75.409999999999997 112.373 -174.059 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 95.9 mt -58.96 -35.2 72.76 Favored 'General case' 0 N--CA 1.474 0.74 0 CA-C-O 121.18 0.514 . . . . 75.310000000000002 111.764 176.908 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 41' ' ' ARG . . . . . 0.5 ' HB3' ' CE2' ' A' ' 59' ' ' TYR . 16.5 mtm180 -114.21 34.25 4.79 Favored 'General case' 0 CA--C 1.54 0.573 0 CA-C-N 116.034 -0.53 . . . . 74.319999999999993 112.366 -173.505 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 32.4 t 69.05 10.17 7.77 Favored 'General case' 0 N--CA 1.479 0.99 0 N-CA-C 113.048 0.759 . . . . 74.0 113.048 172.482 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 43' ' ' LEU . . . . . 0.41 HD23 ' HG2' ' A' ' 55' ' ' ARG . 83.4 mt -88.8 142.0 30.28 Favored Pre-proline 0 CA--C 1.543 0.676 0 N-CA-C 112.126 0.417 . . . . 72.349999999999994 112.126 -177.562 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 44' ' ' PRO . . . . . 0.444 ' HG2' HH11 ' A' ' 55' ' ' ARG . 75.6 Cg_endo -76.05 143.38 25.81 Favored 'Trans proline' 0 CA--C 1.544 0.988 0 C-N-CA 123.036 2.491 . . . . 65.329999999999998 113.362 178.754 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 25.8 m -97.57 -0.05 10.47 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.711 0 N-CA-C 112.716 0.636 . . . . 64.040000000000006 112.716 -176.006 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 19.7 p -79.83 45.89 0.74 Allowed 'General case' 0 N--CA 1.475 0.806 0 N-CA-C 112.866 0.691 . . . . 64.409999999999997 112.866 -176.258 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . -131.54 173.77 20.35 Favored Glycine 0 CA--C 1.531 1.032 0 C-N-CA 121.079 -0.582 . . . . 73.099999999999994 113.6 179.607 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 48' ' ' THR . . . . . 0.578 ' O ' ' HG ' ' A' ' 52' ' ' LEU . 68.7 p -81.43 173.45 12.42 Favored 'General case' 0 N--CA 1.473 0.7 0 C-N-CA 122.487 0.315 . . . . 74.030000000000001 111.287 177.548 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 24.3 tptm -50.17 -50.38 49.35 Favored 'General case' 0 N--CA 1.473 0.709 0 CA-C-O 120.829 0.347 . . . . 75.5 111.599 -179.871 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 50' ' ' THR . . . . . . . . . . . . . 86.5 m -62.84 -39.93 95.88 Favored 'General case' 0 N--CA 1.47 0.542 0 CA-C-N 116.351 -0.386 . . . . 74.219999999999999 111.368 177.365 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 61.4 mm-40 -61.06 -42.2 98.05 Favored 'General case' 0 N--CA 1.469 0.501 0 N-CA-C 111.892 0.33 . . . . 71.340000000000003 111.892 178.423 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 52' ' ' LEU . . . . . 0.578 ' HG ' ' O ' ' A' ' 48' ' ' THR . 31.4 mt -58.16 -49.84 75.62 Favored 'General case' 0 CA--C 1.538 0.519 0 CA-C-O 121.323 0.582 . . . . 72.329999999999998 110.294 177.999 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 53' ' ' ILE . . . . . 0.452 ' O ' ' HG3' ' A' ' 57' ' ' ARG . 72.5 mt -63.4 -55.71 21.42 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.666 0 CA-C-N 115.623 -0.717 . . . . 64.340000000000003 111.944 179.704 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 15.3 mm-40 -59.39 -42.36 91.55 Favored 'General case' 0 N--CA 1.472 0.663 0 N-CA-C 112.233 0.457 . . . . 72.219999999999999 112.233 -177.96 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 55' ' ' ARG . . . . . 0.444 HH11 ' HG2' ' A' ' 44' ' ' PRO . 10.5 ttm180 -66.11 -35.23 79.95 Favored 'General case' 0 CA--C 1.539 0.553 0 CA-C-O 120.892 0.377 . . . . 65.120000000000005 110.792 -178.743 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 45.8 mt -63.04 -51.48 66.57 Favored 'General case' 0 N--CA 1.469 0.507 0 CA-C-N 116.355 -0.384 . . . . 75.420000000000002 111.254 172.696 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 57' ' ' ARG . . . . . 0.452 ' HG3' ' O ' ' A' ' 53' ' ' ILE . 29.3 mtp-105 -58.53 -51.66 68.96 Favored 'General case' 0 N--CA 1.47 0.549 0 CA-C-N 116.424 -0.353 . . . . 74.239999999999995 111.647 -177.041 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -57.8 -53.21 60.78 Favored 'General case' 0 CA--C 1.539 0.553 0 CA-C-N 116.297 -0.411 . . . . 71.340000000000003 111.893 -179.702 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 59' ' ' TYR . . . . . 0.5 ' CE2' ' HB3' ' A' ' 41' ' ' ARG . 72.1 t80 -57.59 -58.68 7.26 Favored 'General case' 0 N--CA 1.471 0.58 0 CA-C-O 121.041 0.448 . . . . 73.219999999999999 111.778 179.772 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 60' ' ' GLN . . . . . 0.54 ' HG3' ' HG ' ' A' ' 22' ' ' LEU . 0.6 OUTLIER -56.69 -31.38 64.41 Favored 'General case' 0 CA--C 1.546 0.819 0 CA-C-N 116.147 -0.478 . . . . 74.340000000000003 111.349 -175.278 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 61' ' ' ASP . . . . . . . . . . . . . 17.8 t70 -79.35 -45.77 18.95 Favored 'General case' 0 CA--C 1.542 0.657 0 CA-C-O 120.862 0.363 . . . . 55.399999999999999 111.884 -179.865 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 62' ' ' GLN . . . . . . . . . . . . . 3.4 pt20 . . . . . 0 CA--C 1.542 0.655 0 N-CA-C 112.455 0.539 . . . . 71.510000000000005 112.455 -174.654 . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 92.9 mt . . . . . 0 CA--C 1.544 0.75 0 N-CA-C 110.441 -0.207 . . . . 75.109999999999999 110.441 . . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' A' A ' 23' ' ' PRO . . . . . . . . . . . . . 35.9 Cg_endo -65.99 131.87 28.42 Favored 'Trans proline' 0 CA--C 1.544 0.978 0 C-N-CA 122.042 1.828 . . . . 71.099999999999994 112.283 174.859 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -68.08 -27.94 66.93 Favored 'General case' 0 N--CA 1.472 0.643 0 N-CA-C 112.266 0.469 . . . . 73.299999999999997 112.266 -177.02 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 19.6 m120 -87.18 52.41 2.5 Favored 'General case' 0 CA--C 1.539 0.543 0 CA-C-O 121.058 0.456 . . . . 63.420000000000002 112.056 -179.799 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 26' ' ' LEU . . . . . 0.433 ' HB2' HG21 ' A' ' 53' ' ' ILE . 87.5 mt -60.75 -27.71 68.15 Favored 'General case' 0 N--CA 1.469 0.518 0 CA-C-O 121.251 0.548 . . . . 71.150000000000006 110.662 173.835 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 7.6 p-10 -67.82 -28.91 67.98 Favored 'General case' 0 CA--C 1.54 0.579 0 CA-C-N 115.836 -0.62 . . . . 74.209999999999994 111.63 176.69 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 26.0 t70 -76.7 -39.71 51.12 Favored 'General case' 0 CA--C 1.54 0.578 0 CA-C-N 116.463 -0.335 . . . . 74.430000000000007 111.776 -178.963 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 29' ' ' MET . . . . . . . . . . . . . 58.6 mtm -68.56 157.62 35.65 Favored 'General case' 0 N--CA 1.471 0.614 0 CA-C-O 121.549 0.69 . . . . 65.549999999999997 112.366 -177.398 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 30' ' ' LYS . . . . . 0.42 ' HB2' ' HG2' ' A' ' 33' ' ' GLU . 50.5 mtmt -69.92 156.58 38.88 Favored 'General case' 0 CA--C 1.539 0.524 0 CA-C-N 115.535 -0.757 . . . . 75.510000000000005 112.138 -179.289 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 42.2 t -54.51 -42.71 60.79 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.561 0 CA-C-N 116.12 -0.491 . . . . 74.409999999999997 111.273 178.039 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -60.87 -33.74 73.54 Favored 'General case' 0 CA--C 1.54 0.57 0 CA-C-N 116.061 -0.518 . . . . 75.400000000000006 111.778 177.913 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 33' ' ' GLU . . . . . 0.42 ' HG2' ' HB2' ' A' ' 30' ' ' LYS . 36.9 mm-40 -67.37 -45.01 77.54 Favored 'General case' 0 N--CA 1.468 0.441 0 CA-C-O 121.122 0.487 . . . . 73.340000000000003 110.662 177.185 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 63.4 mt -58.75 -48.3 81.66 Favored 'General case' 0 CA--C 1.537 0.459 0 CA-C-N 115.954 -0.566 . . . . 75.329999999999998 110.973 177.481 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 35' ' ' LYS . . . . . 0.41 ' HA ' HD12 ' A' ' 38' ' ' LEU . 98.7 mttt -63.1 -29.6 70.94 Favored 'General case' 0 CA--C 1.54 0.564 0 CA-C-N 116.182 -0.463 . . . . 65.209999999999994 111.603 176.964 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 36' ' ' GLN . . . . . 0.554 ' HA ' ' HE3' ' A' ' 39' ' ' LYS . 56.8 tp60 -65.5 -49.72 67.95 Favored 'General case' 0 CA--C 1.537 0.474 0 CA-C-O 121.011 0.434 . . . . 73.340000000000003 110.654 174.701 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 7.8 mm-40 -63.45 -21.84 66.53 Favored 'General case' 0 CA--C 1.545 0.759 0 CA-C-O 121.128 0.49 . . . . 75.430000000000007 111.621 178.794 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 38' ' ' LEU . . . . . 0.426 ' CD1' HD23 ' A' ' 52' ' ' LEU . 94.8 mt -75.65 -56.24 4.88 Favored 'General case' 0 CA--C 1.539 0.531 0 CA-C-N 116.445 -0.343 . . . . 75.340000000000003 111.583 174.736 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 39' ' ' LYS . . . . . 0.554 ' HE3' ' HA ' ' A' ' 36' ' ' GLN . 17.0 ptpt -57.64 -35.96 71.21 Favored 'General case' 0 CA--C 1.543 0.682 0 CA-C-O 120.7 0.286 . . . . 74.319999999999993 111.682 -176.727 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 40' ' ' LEU . . . . . 0.458 ' HG ' ' O ' ' A' ' 36' ' ' GLN . 88.3 mt -66.32 -23.56 66.39 Favored 'General case' 0 N--CA 1.472 0.673 0 N-CA-C 111.855 0.317 . . . . 75.400000000000006 111.855 -179.793 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 41' ' ' ARG . . . . . 0.763 HH22 ' HA ' ' A' ' 56' ' ' LEU . 52.5 mtm180 -114.07 15.41 18.35 Favored 'General case' 0 CA--C 1.541 0.629 0 N-CA-C 111.987 0.366 . . . . 73.129999999999995 111.987 -176.612 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 33.3 t 63.23 73.68 0.45 Allowed 'General case' 0 N--CA 1.477 0.892 0 CA-C-O 121.146 0.498 . . . . 74.120000000000005 111.896 -179.056 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 43' ' ' LEU . . . . . 0.414 HD21 ' CD2' ' A' ' 59' ' ' TYR . 68.3 mt -144.3 143.74 23.21 Favored Pre-proline 0 N--CA 1.47 0.557 0 CA-C-N 116.183 -0.462 . . . . 72.450000000000003 111.616 -177.773 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 44' ' ' PRO . . . . . . . . . . . . . 56.7 Cg_endo -69.54 127.62 15.03 Favored 'Trans proline' 0 CA--C 1.543 0.933 0 C-N-CA 122.704 2.269 . . . . 74.030000000000001 113.09 178.868 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 33.6 m -96.91 23.05 0.94 Allowed 'Isoleucine or valine' 0 CA--C 1.544 0.736 0 CA-C-O 120.978 0.418 . . . . 65.340000000000003 112.068 -177.226 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 54.0 m -84.73 -8.33 58.88 Favored 'General case' 0 N--CA 1.477 0.917 0 N-CA-C 113.206 0.817 . . . . 62.210000000000001 113.206 -175.023 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . -87.3 170.74 41.3 Favored Glycine 0 CA--C 1.531 1.046 0 C-N-CA 120.928 -0.653 . . . . 74.239999999999995 113.824 -176.485 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 48' ' ' THR . . . . . 0.594 ' O ' ' HG ' ' A' ' 52' ' ' LEU . 63.1 p -77.31 167.69 21.29 Favored 'General case' 0 N--CA 1.477 0.91 0 O-C-N 122.637 -0.331 . . . . 64.230000000000004 111.359 177.511 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 65.0 tttm -48.37 -48.34 36.75 Favored 'General case' 0 N--CA 1.476 0.825 0 N-CA-C 112.357 0.503 . . . . 72.530000000000001 112.357 -176.364 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 50' ' ' THR . . . . . . . . . . . . . 87.3 m -64.55 -39.75 94.32 Favored 'General case' 0 N--CA 1.474 0.743 0 CA-C-O 120.949 0.404 . . . . 64.239999999999995 111.904 178.748 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 43.5 mt-10 -64.88 -40.71 95.54 Favored 'General case' 0 N--CA 1.472 0.634 0 CA-C-O 120.86 0.362 . . . . 71.120000000000005 111.331 177.933 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 52' ' ' LEU . . . . . 0.594 ' HG ' ' O ' ' A' ' 48' ' ' THR . 47.7 mt -58.34 -50.99 71.67 Favored 'General case' 0 CA--C 1.535 0.398 0 CA-C-O 121.082 0.468 . . . . 75.0 110.024 176.754 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 53' ' ' ILE . . . . . 0.433 HG21 ' HB2' ' A' ' 26' ' ' LEU . 85.2 mt -53.26 -54.73 16.19 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.577 0 CA-C-N 115.742 -0.663 . . . . 74.25 111.732 177.036 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -58.57 -38.43 77.87 Favored 'General case' 0 CA--C 1.537 0.443 0 CA-C-N 116.386 -0.37 . . . . 64.439999999999998 111.859 -178.974 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 55' ' ' ARG . . . . . 0.412 HH11 ' HD2' ' A' ' 55' ' ' ARG . 15.9 ttt180 -76.89 -25.1 52.64 Favored 'General case' 0 CA--C 1.541 0.613 0 O-C-N 122.112 -0.367 . . . . 60.200000000000003 111.257 -179.792 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 56' ' ' LEU . . . . . 0.763 ' HA ' HH22 ' A' ' 41' ' ' ARG . 85.2 mt -62.82 -49.34 75.31 Favored 'General case' 0 C--O 1.236 0.362 0 CA-C-O 121.126 0.489 . . . . 75.099999999999994 109.843 170.48 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 58.6 mtp180 -62.91 -47.83 81.59 Favored 'General case' 0 CA--C 1.538 0.518 0 CA-C-N 115.316 -0.856 . . . . 75.209999999999994 110.828 177.078 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 58' ' ' ALA . . . . . 0.502 ' O ' ' HG3' ' A' ' 62' ' ' GLN . . . -55.67 -57.43 12.0 Favored 'General case' 0 N--CA 1.469 0.495 0 CA-C-N 116.032 -0.531 . . . . 74.400000000000006 112.17 179.821 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 59' ' ' TYR . . . . . 0.414 ' CD2' HD21 ' A' ' 43' ' ' LEU . 54.1 t80 -54.46 -38.87 66.86 Favored 'General case' 0 N--CA 1.473 0.692 0 CA-C-O 120.993 0.425 . . . . 74.010000000000005 111.363 179.635 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 60' ' ' GLN . . . . . . . . . . . . . 23.9 tm0? -69.68 -34.75 74.38 Favored 'General case' 0 CA--C 1.538 0.492 0 CA-C-O 121.094 0.473 . . . . 73.299999999999997 110.461 177.614 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 61' ' ' ASP . . . . . . . . . . . . . 34.3 t70 -70.5 -33.63 71.44 Favored 'General case' 0 CA--C 1.543 0.692 0 CA-C-N 116.175 -0.466 . . . . 74.019999999999996 111.408 178.338 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 62' ' ' GLN . . . . . 0.502 ' HG3' ' O ' ' A' ' 58' ' ' ALA . 84.7 mt-30 . . . . . 0 N--CA 1.473 0.724 0 CA-C-O 121.147 0.498 . . . . 74.400000000000006 111.345 178.43 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 22' ' ' LEU . . . . . 0.438 HD11 ' HB3' ' A' ' 56' ' ' LEU . 79.4 mt . . . . . 0 CA--C 1.54 0.576 0 CA-C-O 120.437 0.161 . . . . 71.519999999999996 111.086 . . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 23' ' ' PRO . . . . . 0.522 ' O ' ' HG ' ' A' ' 26' ' ' LEU . 74.5 Cg_exo -50.92 136.84 44.04 Favored 'Trans proline' 0 CA--C 1.539 0.764 0 C-N-CA 122.925 2.416 . . . . 74.030000000000001 113.644 -177.243 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -80.15 -15.12 57.76 Favored 'General case' 0 N--CA 1.467 0.421 0 CA-C-O 120.965 0.412 . . . . 72.140000000000001 111.309 177.167 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 25' ' ' ASN . . . . . 0.414 ' HB3' ' HB3' ' A' ' 28' ' ' ASP . 14.9 m120 -92.77 27.07 2.47 Favored 'General case' 0 CA--C 1.542 0.67 0 N-CA-C 112.161 0.43 . . . . 64.019999999999996 112.161 -177.807 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 26' ' ' LEU . . . . . 0.522 ' HG ' ' O ' ' A' ' 23' ' ' PRO . 82.8 mt -51.07 -38.26 50.59 Favored 'General case' 0 N--CA 1.476 0.839 0 N-CA-C 112.949 0.722 . . . . 75.450000000000003 112.949 -176.873 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 35.2 t70 -75.53 -31.25 60.04 Favored 'General case' 0 CA--C 1.541 0.62 0 O-C-N 122.091 -0.38 . . . . 72.450000000000003 111.332 179.077 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 28' ' ' ASP . . . . . 0.414 ' HB3' ' HB3' ' A' ' 25' ' ' ASN . 22.1 t70 -73.14 -23.3 60.45 Favored 'General case' 0 CA--C 1.541 0.627 0 CA-C-O 121.124 0.488 . . . . 72.049999999999997 110.254 175.791 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 29' ' ' MET . . . . . . . . . . . . . 76.3 mtp -70.83 160.67 32.33 Favored 'General case' 0 CA--C 1.537 0.479 0 CA-C-O 121.295 0.569 . . . . 73.439999999999998 111.559 176.038 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 46.3 mtpt -92.9 157.68 16.23 Favored 'General case' 0 CA--C 1.539 0.531 0 CA-C-N 115.898 -0.592 . . . . 72.219999999999999 112.003 -177.926 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 57.3 t -52.13 -47.86 43.17 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.693 0 CA-C-N 115.909 -0.587 . . . . 74.310000000000002 112.27 -176.418 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -61.73 -35.96 79.6 Favored 'General case' 0 N--CA 1.471 0.575 0 CA-C-O 120.919 0.39 . . . . 73.409999999999997 111.874 179.853 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 41.7 mt-10 -72.01 -35.47 69.43 Favored 'General case' 0 N--CA 1.47 0.546 0 CA-C-N 116.297 -0.41 . . . . 65.140000000000001 111.126 -178.895 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 90.6 mt -65.79 -50.45 64.66 Favored 'General case' 0 CA--C 1.537 0.473 0 CA-C-N 116.145 -0.48 . . . . 74.549999999999997 110.887 174.501 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 35' ' ' LYS . . . . . 0.401 ' HG2' ' HB ' ' A' ' 45' ' ' VAL . 60.3 mttm -54.99 -41.82 71.7 Favored 'General case' 0 N--CA 1.47 0.544 0 CA-C-O 121.043 0.449 . . . . 74.430000000000007 111.299 175.667 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 36' ' ' GLN . . . . . 0.478 ' O ' ' HG ' ' A' ' 40' ' ' LEU . 26.0 tm0? -56.15 -47.81 77.5 Favored 'General case' 0 CA--C 1.539 0.539 0 CA-C-N 115.8 -0.636 . . . . 70.219999999999999 111.32 -179.489 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 37' ' ' GLU . . . . . 0.717 ' HB3' ' NH2' ' A' ' 41' ' ' ARG . 42.5 mt-10 -70.79 -39.18 73.29 Favored 'General case' 0 CA--C 1.538 0.518 0 N-CA-C 112.095 0.405 . . . . 73.519999999999996 112.095 178.151 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 38' ' ' LEU . . . . . . . . . . . . . 77.5 mt -55.84 -54.3 46.21 Favored 'General case' 0 N--CA 1.467 0.424 0 CA-C-O 120.822 0.344 . . . . 73.030000000000001 111.573 176.913 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 18.7 ptmt -63.48 -25.68 68.37 Favored 'General case' 0 CA--C 1.541 0.628 0 N-CA-C 112.225 0.454 . . . . 74.409999999999997 112.225 -175.006 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 40' ' ' LEU . . . . . 0.478 ' HG ' ' O ' ' A' ' 36' ' ' GLN . 66.1 mt -72.08 -30.03 64.7 Favored 'General case' 0 N--CA 1.471 0.576 0 CA-C-O 120.805 0.336 . . . . 74.299999999999997 111.174 175.388 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 41' ' ' ARG . . . . . 0.717 ' NH2' ' HB3' ' A' ' 37' ' ' GLU . 0.0 OUTLIER -97.52 17.07 18.49 Favored 'General case' 0 N--CA 1.472 0.64 0 CA-C-N 116.412 -0.358 . . . . 64.420000000000002 111.258 173.951 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 30.0 t 63.32 16.48 9.52 Favored 'General case' 0 N--CA 1.48 1.057 0 N-CA-C 112.706 0.632 . . . . 73.200000000000003 112.706 176.989 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 58.4 mt -79.65 136.2 55.69 Favored Pre-proline 0 CA--C 1.543 0.674 0 N-CA-C 111.914 0.339 . . . . 74.430000000000007 111.914 -178.652 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 44' ' ' PRO . . . . . . . . . . . . . 51.6 Cg_exo -56.24 120.81 8.9 Favored 'Trans proline' 0 CA--C 1.542 0.905 0 C-N-CA 122.93 2.42 . . . . 72.239999999999995 113.227 178.588 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 45' ' ' VAL . . . . . 0.401 ' HB ' ' HG2' ' A' ' 35' ' ' LYS . 34.0 m -94.87 10.17 4.89 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.733 0 N-CA-C 112.719 0.637 . . . . 62.240000000000002 112.719 -176.419 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 37.1 t -73.99 -22.17 59.71 Favored 'General case' 0 N--CA 1.478 0.931 0 N-CA-C 113.063 0.764 . . . . 74.329999999999998 113.063 -176.226 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . -68.31 169.04 40.91 Favored Glycine 0 CA--C 1.534 1.25 0 C-N-CA 120.968 -0.634 . . . . 53.149999999999999 114.055 -176.944 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 48' ' ' THR . . . . . 0.577 ' O ' ' HG ' ' A' ' 52' ' ' LEU . 64.1 p -74.26 170.32 15.81 Favored 'General case' 0 N--CA 1.475 0.799 0 O-C-N 122.558 -0.378 . . . . 74.120000000000005 111.115 177.097 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 49' ' ' LYS . . . . . 0.411 ' O ' HG13 ' A' ' 53' ' ' ILE . 64.0 tttm -48.1 -44.98 32.32 Favored 'General case' 0 N--CA 1.471 0.611 0 N-CA-C 112.056 0.391 . . . . 73.510000000000005 112.056 -178.875 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 50' ' ' THR . . . . . . . . . . . . . 94.4 m -64.51 -43.86 92.75 Favored 'General case' 0 N--CA 1.472 0.634 0 CA-C-O 120.877 0.37 . . . . 74.140000000000001 111.313 177.565 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 44.8 mt-10 -64.6 -34.72 78.92 Favored 'General case' 0 N--CA 1.469 0.518 0 CA-C-N 116.45 -0.341 . . . . 74.430000000000007 111.533 -179.878 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 52' ' ' LEU . . . . . 0.577 ' HG ' ' O ' ' A' ' 48' ' ' THR . 44.5 mt -62.03 -44.51 96.55 Favored 'General case' 0 N--CA 1.471 0.6 0 CA-C-O 121.409 0.624 . . . . 72.25 110.318 176.381 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 53' ' ' ILE . . . . . 0.487 HG21 ' HD3' ' A' ' 57' ' ' ARG . 79.7 mt -60.91 -52.38 62.36 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.576 0 CA-C-N 115.525 -0.762 . . . . 74.230000000000004 111.301 176.172 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 11.8 mm-40 -61.45 -30.15 70.41 Favored 'General case' 0 N--CA 1.47 0.54 0 CA-C-N 116.204 -0.453 . . . . 54.409999999999997 111.757 178.68 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 55' ' ' ARG . . . . . 0.493 ' HA ' ' NE ' ' A' ' 55' ' ' ARG . 0.8 OUTLIER -67.33 -50.03 61.68 Favored 'General case' 0 CA--C 1.54 0.562 0 CA-C-O 120.865 0.364 . . . . 73.030000000000001 110.93 179.5 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 56' ' ' LEU . . . . . 0.585 HD22 HH21 ' A' ' 41' ' ' ARG . 60.7 mt -59.77 -51.34 70.16 Favored 'General case' 0 N--CA 1.472 0.667 0 CA-C-O 121.193 0.52 . . . . 64.340000000000003 111.126 175.376 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 57' ' ' ARG . . . . . 0.487 ' HD3' HG21 ' A' ' 53' ' ' ILE . 16.7 mtp85 -56.97 -39.11 74.0 Favored 'General case' 0 CA--C 1.539 0.538 0 CA-C-N 116.022 -0.536 . . . . 74.030000000000001 112.132 179.806 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -66.75 -40.03 88.14 Favored 'General case' 0 CA--C 1.54 0.575 0 CA-C-O 120.984 0.421 . . . . 74.329999999999998 111.5 176.797 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 59' ' ' TYR . . . . . . . . . . . . . 73.5 t80 -63.43 -38.09 89.8 Favored 'General case' 0 CA--C 1.542 0.657 0 CA-C-N 116.237 -0.438 . . . . 74.239999999999995 111.348 178.907 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 60' ' ' GLN . . . . . 0.413 ' HB2' HD12 ' A' ' 22' ' ' LEU . 0.0 OUTLIER -76.61 -45.7 29.12 Favored 'General case' 0 CA--C 1.542 0.669 0 CA-C-O 121.282 0.563 . . . . 75.319999999999993 110.536 178.618 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 61' ' ' ASP . . . . . . . . . . . . . 27.3 t70 -53.08 -28.77 26.68 Favored 'General case' 0 CA--C 1.545 0.787 0 N-CA-C 112.833 0.679 . . . . 74.120000000000005 112.833 -176.988 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 62' ' ' GLN . . . . . . . . . . . . . 10.1 pt20 . . . . . 0 N--CA 1.473 0.699 0 N-CA-C 112.735 0.642 . . . . 50.020000000000003 112.735 -178.956 . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' A' A ' 22' ' ' LEU . . . . . 0.462 ' HG ' ' HG3' ' A' ' 60' ' ' GLN . 91.3 mt . . . . . 0 N--CA 1.475 0.786 0 CA-C-O 120.577 0.227 . . . . 74.340000000000003 111.269 . . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 23' ' ' PRO . . . . . 0.438 ' HG2' HD22 ' A' ' 26' ' ' LEU . 46.9 Cg_endo -70.32 150.34 64.65 Favored 'Trans proline' 0 CA--C 1.541 0.838 0 C-N-CA 122.191 1.927 . . . . 75.230000000000004 111.751 170.714 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -67.17 -39.63 86.5 Favored 'General case' 0 N--CA 1.47 0.556 0 CA-C-O 121.023 0.44 . . . . 74.019999999999996 112.02 -177.855 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 25' ' ' ASN . . . . . 0.42 ' HB3' ' HB2' ' A' ' 28' ' ' ASP . 1.9 m-20 -92.57 72.44 5.08 Favored 'General case' 0 CA--C 1.537 0.456 0 CA-C-O 121.107 0.479 . . . . 75.340000000000003 111.812 -178.613 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 26' ' ' LEU . . . . . 0.438 HD22 ' HG2' ' A' ' 23' ' ' PRO . 92.9 mt -72.28 -33.49 67.48 Favored 'General case' 0 CA--C 1.536 0.412 0 CA-C-N 116.332 -0.395 . . . . 72.299999999999997 111.685 179.029 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 36.3 t70 -72.83 -25.17 61.03 Favored 'General case' 0 CA--C 1.538 0.516 0 O-C-N 122.17 -0.331 . . . . 73.340000000000003 111.42 178.611 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 28' ' ' ASP . . . . . 0.42 ' HB2' ' HB3' ' A' ' 25' ' ' ASN . 16.3 m-20 -74.91 -15.36 60.7 Favored 'General case' 0 N--CA 1.469 0.508 0 CA-C-O 120.89 0.376 . . . . 74.019999999999996 111.296 175.155 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 29' ' ' MET . . . . . . . . . . . . . 86.1 mtp -81.65 137.8 35.4 Favored 'General case' 0 CA--C 1.536 0.419 0 CA-C-O 121.01 0.433 . . . . 65.209999999999994 110.947 175.76 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 30' ' ' LYS . . . . . 0.439 ' HB2' ' HG2' ' A' ' 33' ' ' GLU . 51.3 mtmt -66.85 155.41 38.4 Favored 'General case' 0 CA--C 1.541 0.624 0 CA-C-N 116.302 -0.408 . . . . 74.409999999999997 111.357 -179.989 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 90.2 t -54.06 -42.4 54.82 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.713 0 N-CA-C 111.963 0.357 . . . . 73.239999999999995 111.963 -177.673 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -63.27 -33.08 74.72 Favored 'General case' 0 CA--C 1.539 0.528 0 CA-C-O 120.791 0.329 . . . . 74.510000000000005 111.643 177.68 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 33' ' ' GLU . . . . . 0.439 ' HG2' ' HB2' ' A' ' 30' ' ' LYS . 57.9 mm-40 -70.22 -47.61 60.68 Favored 'General case' 0 N--CA 1.468 0.426 0 CA-C-O 120.919 0.39 . . . . 71.530000000000001 110.636 177.462 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 97.7 mt -57.35 -46.08 83.68 Favored 'General case' 0 CA--C 1.539 0.535 0 CA-C-N 116.234 -0.439 . . . . 70.040000000000006 111.144 176.228 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 55.2 mtmt -63.98 -32.47 74.01 Favored 'General case' 0 CA--C 1.539 0.538 0 CA-C-N 116.426 -0.352 . . . . 74.230000000000004 111.568 177.5 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 51.5 tp60 -65.81 -49.6 67.69 Favored 'General case' 0 CA--C 1.539 0.533 0 CA-C-O 121.008 0.433 . . . . 71.510000000000005 110.067 175.495 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 37' ' ' GLU . . . . . 0.622 ' HB3' HH21 ' A' ' 41' ' ' ARG . 42.2 mm-40 -54.75 -31.77 59.0 Favored 'General case' 0 N--CA 1.472 0.637 0 CA-C-N 115.921 -0.581 . . . . 70.120000000000005 111.591 175.562 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 38' ' ' LEU . . . . . 0.423 ' CD1' HD23 ' A' ' 52' ' ' LEU . 91.5 mt -72.02 -62.2 1.51 Allowed 'General case' 0 CA--C 1.538 0.488 0 CA-C-N 116.284 -0.416 . . . . 73.409999999999997 111.92 176.694 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 20.6 ptmt -58.92 -34.28 71.53 Favored 'General case' 0 CA--C 1.541 0.599 0 N-CA-C 112.622 0.601 . . . . 72.209999999999994 112.622 -172.929 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 93.0 mt -64.87 -22.46 67.0 Favored 'General case' 0 N--CA 1.475 0.793 0 CA-C-O 121.193 0.521 . . . . 63.130000000000003 111.568 177.743 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 41' ' ' ARG . . . . . 0.622 HH21 ' HB3' ' A' ' 37' ' ' GLU . 15.5 mtm180 -109.72 27.12 9.89 Favored 'General case' 0 CA--C 1.541 0.603 0 CA-C-N 116.136 -0.484 . . . . 75.219999999999999 111.604 177.77 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 28.0 t 70.23 5.34 5.27 Favored 'General case' 0 N--CA 1.478 0.97 0 N-CA-C 112.809 0.67 . . . . 74.049999999999997 112.809 174.818 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 61.4 mt -82.8 142.38 45.26 Favored Pre-proline 0 CA--C 1.542 0.639 0 CA-C-O 120.723 0.297 . . . . 75.019999999999996 111.468 -179.569 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 44' ' ' PRO . . . . . 0.409 ' HG2' ' NH1' ' A' ' 55' ' ' ARG . 59.2 Cg_endo -70.13 143.79 50.14 Favored 'Trans proline' 0 C--N 1.352 0.723 0 C-N-CA 122.476 2.117 . . . . 73.310000000000002 112.567 178.411 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 30.2 m -95.09 16.45 1.99 Allowed 'Isoleucine or valine' 0 CA--C 1.54 0.59 0 CA-C-O 121.22 0.533 . . . . 71.310000000000002 111.93 -177.063 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 33.0 t -90.53 89.42 7.55 Favored 'General case' 0 N--CA 1.47 0.528 0 CA-C-N 116.247 -0.433 . . . . 74.450000000000003 111.455 179.713 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . -172.82 174.88 45.88 Favored Glycine 0 CA--C 1.528 0.867 0 C-N-CA 120.711 -0.757 . . . . 62.119999999999997 113.851 178.68 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 48' ' ' THR . . . . . 0.588 ' O ' ' HG ' ' A' ' 52' ' ' LEU . 68.3 p -93.12 170.03 9.95 Favored 'General case' 0 N--CA 1.469 0.516 0 C-N-CA 122.58 0.352 . . . . 72.400000000000006 111.019 178.748 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 22.8 tptm -44.47 -54.57 5.84 Favored 'General case' 0 N--CA 1.472 0.656 0 N-CA-C 112.135 0.42 . . . . 72.319999999999993 112.135 -179.02 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 50' ' ' THR . . . . . . . . . . . . . 51.4 m -69.96 -40.9 75.14 Favored 'General case' 0 CA--C 1.538 0.482 0 CA-C-N 116.405 -0.361 . . . . 75.219999999999999 111.781 -179.59 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 2.9 tm-20 -55.17 -48.82 73.24 Favored 'General case' 0 CA--C 1.542 0.647 0 CA-C-N 116.354 -0.384 . . . . 72.230000000000004 111.246 179.298 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 52' ' ' LEU . . . . . 0.588 ' HG ' ' O ' ' A' ' 48' ' ' THR . 54.2 mt -56.47 -46.38 80.44 Favored 'General case' 0 N--CA 1.47 0.556 0 CA-C-O 121.137 0.494 . . . . 73.239999999999995 111.059 179.169 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 53' ' ' ILE . . . . . . . . . . . . . 78.9 mt -56.23 -53.12 43.28 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.534 0 CA-C-N 115.948 -0.569 . . . . 75.150000000000006 111.634 178.162 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 38.9 mt-10 -68.31 -28.14 66.91 Favored 'General case' 0 CA--C 1.536 0.438 0 CA-C-N 116.243 -0.435 . . . . 72.450000000000003 111.816 -178.897 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 55' ' ' ARG . . . . . 0.409 ' NH1' ' HG2' ' A' ' 44' ' ' PRO . 41.9 ttm-85 -68.69 -38.71 80.54 Favored 'General case' 0 CA--C 1.537 0.481 0 CA-C-O 121.122 0.486 . . . . 74.230000000000004 110.596 176.752 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 62.4 mt -56.73 -48.39 77.88 Favored 'General case' 0 CA--C 1.538 0.494 0 CA-C-N 116.088 -0.506 . . . . 72.310000000000002 111.137 173.482 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 54.1 mtm180 -61.48 -41.96 98.05 Favored 'General case' 0 N--CA 1.469 0.497 0 CA-C-N 116.577 -0.283 . . . . 75.450000000000003 111.186 177.78 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -55.25 -41.21 71.85 Favored 'General case' 0 N--CA 1.471 0.584 0 CA-C-O 120.943 0.402 . . . . 61.119999999999997 111.682 179.703 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 59' ' ' TYR . . . . . . . . . . . . . 87.0 t80 -69.73 -51.57 33.07 Favored 'General case' 0 CA--C 1.536 0.44 0 CA-C-O 121.092 0.472 . . . . 74.319999999999993 110.833 176.207 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 60' ' ' GLN . . . . . 0.462 ' HG3' ' HG ' ' A' ' 22' ' ' LEU . 17.6 mm100 -58.42 -29.29 65.99 Favored 'General case' 0 CA--C 1.539 0.547 0 CA-C-N 116.101 -0.499 . . . . 71.129999999999995 112.264 179.484 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 61' ' ' ASP . . . . . . . . . . . . . 19.5 t70 -71.91 -45.27 61.8 Favored 'General case' 0 C--N 1.321 -0.65 0 CA-C-N 116.178 -0.465 . . . . 74.25 111.633 179.094 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 62' ' ' GLN . . . . . . . . . . . . . 11.0 pt20 . . . . . 0 CA--C 1.54 0.589 0 N-CA-C 112.706 0.632 . . . . 75.430000000000007 112.706 -175.348 . . . . . . . . 0 0 . 1 . 011 nuclear orig core ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 98.8 mt . . . . . 0 CA--C 1.541 0.632 0 CA-C-O 120.327 0.108 . . . . 72.230000000000004 111.051 . . . . . . . . . 0 0 . 1 . 011 nuclear orig core ' A' A ' 23' ' ' PRO . . . . . . . . . . . . . 74.5 Cg_exo -50.81 130.39 30.63 Favored 'Trans proline' 0 CA--C 1.541 0.87 0 C-N-CA 122.538 2.159 . . . . 74.299999999999997 112.898 177.266 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -55.33 -43.83 75.32 Favored 'General case' 0 CA--C 1.539 0.523 0 CA-C-O 121.106 0.479 . . . . 71.310000000000002 112.132 -178.022 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 14.7 m120 -97.77 67.97 2.03 Favored 'General case' 0 CA--C 1.537 0.455 0 N-CA-C 112.122 0.416 . . . . 62.119999999999997 112.122 179.219 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 96.5 mt -63.63 -28.58 70.01 Favored 'General case' 0 N--CA 1.47 0.539 0 CA-C-O 121.614 0.721 . . . . 73.340000000000003 110.086 170.444 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 8.8 p-10 -64.74 -25.17 67.81 Favored 'General case' 0 CA--C 1.539 0.54 0 CA-C-N 115.346 -0.843 . . . . 72.040000000000006 111.835 177.788 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 34.7 t70 -84.23 -6.77 59.44 Favored 'General case' 0 CA--C 1.543 0.698 0 CA-C-O 120.945 0.402 . . . . 73.319999999999993 111.65 -179.857 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 29' ' ' MET . . . . . 0.449 ' O ' ' HE3' ' A' ' 49' ' ' LYS . 83.6 mtp -87.66 166.78 14.43 Favored 'General case' 0 CA--C 1.541 0.613 0 CA-C-O 121.062 0.458 . . . . 70.420000000000002 111.752 179.875 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 30' ' ' LYS . . . . . 0.536 ' HB2' ' HG2' ' A' ' 33' ' ' GLU . 29.0 mtpp -84.17 153.1 23.87 Favored 'General case' 0 CA--C 1.54 0.585 0 CA-C-N 116.487 -0.324 . . . . 74.099999999999994 111.458 179.731 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 65.6 t -53.47 -57.1 5.77 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.772 0 N-CA-C 112.164 0.431 . . . . 74.409999999999997 112.164 -178.261 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 32' ' ' ALA . . . . . 0.524 ' HA ' ' HD3' ' A' ' 35' ' ' LYS . . . -58.38 -29.3 65.92 Favored 'General case' 0 N--CA 1.472 0.641 0 N-CA-C 112.214 0.449 . . . . 70.150000000000006 112.214 -178.85 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 33' ' ' GLU . . . . . 0.536 ' HG2' ' HB2' ' A' ' 30' ' ' LYS . 13.9 mm-40 -74.41 -38.95 62.94 Favored 'General case' 0 CA--C 1.538 0.519 0 CA-C-O 120.75 0.309 . . . . 74.319999999999993 110.938 179.413 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 92.9 mt -63.61 -44.14 94.82 Favored 'General case' 0 N--CA 1.47 0.531 0 CA-C-O 121.271 0.558 . . . . 72.230000000000004 110.308 172.925 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 35' ' ' LYS . . . . . 0.524 ' HD3' ' HA ' ' A' ' 32' ' ' ALA . 58.2 mtpt -55.84 -41.26 74.02 Favored 'General case' 0 N--CA 1.468 0.469 0 CA-C-N 115.775 -0.648 . . . . 74.120000000000005 111.447 176.658 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 36' ' ' GLN . . . . . 0.403 ' O ' ' HG ' ' A' ' 40' ' ' LEU . 58.3 tp60 -56.69 -52.85 63.34 Favored 'General case' 0 CA--C 1.539 0.531 0 CA-C-O 120.876 0.37 . . . . 74.010000000000005 110.775 175.855 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 37' ' ' GLU . . . . . 0.628 ' HB3' ' NH2' ' A' ' 41' ' ' ARG . 25.9 mm-40 -57.91 -36.43 72.43 Favored 'General case' 0 CA--C 1.54 0.594 0 N-CA-C 112.253 0.464 . . . . 71.439999999999998 112.253 177.784 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 38' ' ' LEU . . . . . 0.403 ' CD1' HD21 ' A' ' 52' ' ' LEU . 88.0 mt -66.26 -58.33 5.59 Favored 'General case' 0 CA--C 1.539 0.54 0 CA-C-O 120.887 0.375 . . . . 71.409999999999997 111.549 177.14 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 20.7 ptmt -61.25 -30.24 70.33 Favored 'General case' 0 CA--C 1.54 0.585 0 N-CA-C 111.99 0.367 . . . . 73.230000000000004 111.99 -175.433 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 40' ' ' LEU . . . . . 0.403 ' HG ' ' O ' ' A' ' 36' ' ' GLN . 87.1 mt -68.21 -25.9 65.45 Favored 'General case' 0 CA--C 1.541 0.611 0 O-C-N 122.249 -0.282 . . . . 74.549999999999997 111.722 176.851 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 41' ' ' ARG . . . . . 0.643 HH21 HD22 ' A' ' 56' ' ' LEU . 80.8 mtm-85 -110.77 25.5 11.71 Favored 'General case' 0 N--CA 1.472 0.656 0 N-CA-C 112.051 0.389 . . . . 75.450000000000003 112.051 179.953 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 31.9 t 63.1 34.15 13.94 Favored 'General case' 0 N--CA 1.479 1.008 0 N-CA-C 112.415 0.524 . . . . 72.239999999999995 112.415 174.832 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 64.3 mt -105.16 138.55 19.56 Favored Pre-proline 0 CA--C 1.541 0.625 0 CA-C-N 116.554 -0.293 . . . . 74.209999999999994 111.499 179.367 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 44' ' ' PRO . . . . . 0.412 ' HG2' ' NH1' ' A' ' 55' ' ' ARG . 37.2 Cg_endo -66.84 131.64 26.24 Favored 'Trans proline' 0 CA--C 1.544 1.007 0 C-N-CA 122.524 2.149 . . . . 63.43 112.801 178.066 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 34.2 m -102.47 17.22 4.51 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.748 0 N-CA-C 112.356 0.502 . . . . 75.150000000000006 112.356 -174.948 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 69.3 m -81.36 13.33 3.0 Favored 'General case' 0 N--CA 1.478 0.942 0 N-CA-C 113.329 0.863 . . . . 61.030000000000001 113.329 -175.552 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . -104.45 172.28 20.18 Favored Glycine 0 CA--C 1.529 0.912 0 C-N-CA 120.908 -0.663 . . . . 38.350000000000001 113.973 -175.983 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 48' ' ' THR . . . . . 0.563 ' O ' ' HG ' ' A' ' 52' ' ' LEU . 43.4 p -77.0 169.23 18.71 Favored 'General case' 0 N--CA 1.473 0.707 0 O-C-N 122.504 -0.41 . . . . 75.099999999999994 110.87 176.785 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 49' ' ' LYS . . . . . 0.504 ' HE2' HD12 ' A' ' 53' ' ' ILE . 23.7 tptm -42.22 -51.15 4.81 Favored 'General case' 0 N--CA 1.475 0.776 0 CA-C-O 120.942 0.401 . . . . 74.439999999999998 111.598 176.818 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 50' ' ' THR . . . . . . . . . . . . . 31.1 m -60.88 -47.07 88.08 Favored 'General case' 0 CA--C 1.539 0.548 0 CA-C-N 116.01 -0.541 . . . . 74.140000000000001 111.769 -179.919 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 42.4 mt-10 -64.44 -38.13 89.96 Favored 'General case' 0 N--CA 1.472 0.637 0 CA-C-O 120.798 0.332 . . . . 74.400000000000006 111.789 -177.018 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 52' ' ' LEU . . . . . 0.563 ' HG ' ' O ' ' A' ' 48' ' ' THR . 43.8 mt -61.24 -44.23 97.59 Favored 'General case' 0 N--CA 1.47 0.542 0 CA-C-O 121.309 0.576 . . . . 72.439999999999998 110.458 177.175 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 53' ' ' ILE . . . . . 0.504 HD12 ' HE2' ' A' ' 49' ' ' LYS . 70.0 mt -60.77 -55.82 22.01 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.51 0 CA-C-N 115.643 -0.708 . . . . 75.349999999999994 111.149 176.645 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 53.9 mm-40 -54.99 -41.11 70.82 Favored 'General case' 0 CA--C 1.538 0.493 0 CA-C-N 116.161 -0.472 . . . . 73.340000000000003 111.74 -179.493 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 55' ' ' ARG . . . . . 0.412 ' NH1' ' HG2' ' A' ' 44' ' ' PRO . 30.9 ttm180 -63.36 -38.12 89.9 Favored 'General case' 0 CA--C 1.541 0.625 0 CA-C-N 116.237 -0.438 . . . . 74.340000000000003 111.361 179.643 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 56' ' ' LEU . . . . . 0.643 HD22 HH21 ' A' ' 41' ' ' ARG . 68.6 mt -68.72 -46.81 67.98 Favored 'General case' 0 N--CA 1.472 0.631 0 CA-C-O 120.757 0.313 . . . . 73.409999999999997 111.452 174.563 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 57' ' ' ARG . . . . . 0.442 ' HG3' ' O ' ' A' ' 53' ' ' ILE . 69.0 mtp180 -55.79 -46.17 78.03 Favored 'General case' 0 N--CA 1.471 0.593 0 CA-C-O 121.246 0.546 . . . . 74.140000000000001 111.073 178.713 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -69.13 -40.97 77.94 Favored 'General case' 0 CA--C 1.536 0.434 0 CA-C-N 116.021 -0.536 . . . . 74.5 112.132 -179.954 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 59' ' ' TYR . . . . . . . . . . . . . 49.6 t80 -63.84 -28.47 69.88 Favored 'General case' 0 N--CA 1.469 0.508 0 CA-C-O 121.051 0.453 . . . . 75.200000000000003 110.894 177.695 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 60' ' ' GLN . . . . . . . . . . . . . 17.4 tm0? -78.36 -44.8 24.1 Favored 'General case' 0 CA--C 1.542 0.663 0 CA-C-N 116.196 -0.456 . . . . 75.310000000000002 110.355 176.381 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 61' ' ' ASP . . . . . . . . . . . . . 17.1 t70 -55.17 -45.97 75.78 Favored 'General case' 0 CA--C 1.542 0.642 0 N-CA-C 112.36 0.504 . . . . 64.230000000000004 112.36 179.359 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 62' ' ' GLN . . . . . . . . . . . . . 9.3 pt20 . . . . . 0 CA--C 1.542 0.671 0 N-CA-C 112.588 0.588 . . . . 74.019999999999996 112.588 -177.36 . . . . . . . . 0 0 . 1 . 012 nuclear orig core ' A' A ' 22' ' ' LEU . . . . . 0.5 HD13 ' HB2' ' A' ' 60' ' ' GLN . 88.8 mt . . . . . 0 CA--C 1.542 0.655 0 CA-C-O 120.605 0.241 . . . . 74.299999999999997 110.984 . . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 23' ' ' PRO . . . . . 0.462 ' HD3' ' HA ' ' A' ' 22' ' ' LEU . 23.3 Cg_exo -62.86 163.1 23.06 Favored 'Trans proline' 0 CA--C 1.539 0.762 0 C-N-CA 123.013 2.475 . . . . 73.310000000000002 113.942 -174.554 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -87.27 14.07 8.52 Favored 'General case' 0 N--CA 1.47 0.567 0 CA-C-O 121.269 0.557 . . . . 43.350000000000001 111.289 176.293 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 12.0 m120 -104.13 9.27 36.36 Favored 'General case' 0 CA--C 1.536 0.432 0 CA-C-N 116.0 -0.545 . . . . 74.439999999999998 111.739 -177.639 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 26' ' ' LEU . . . . . 0.452 HD22 ' SD ' ' A' ' 29' ' ' MET . 63.3 mt -56.39 -27.04 55.1 Favored 'General case' 0 N--CA 1.475 0.812 0 CA-C-O 121.052 0.453 . . . . 53.530000000000001 111.849 -174.811 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 5.1 m-20 -61.73 -53.21 59.06 Favored 'General case' 0 CA--C 1.543 0.681 0 CA-C-N 116.07 -0.514 . . . . 60.530000000000001 111.158 174.825 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 12.2 m-20 -73.48 -32.55 64.38 Favored 'General case' 0 N--CA 1.471 0.586 0 CA-C-N 116.188 -0.46 . . . . 72.439999999999998 111.696 179.484 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 29' ' ' MET . . . . . 0.452 ' SD ' HD22 ' A' ' 26' ' ' LEU . 87.7 mtp -57.13 123.01 13.77 Favored 'General case' 0 N--CA 1.468 0.426 0 CA-C-O 121.049 0.452 . . . . 63.32 110.67 178.461 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 30' ' ' LYS . . . . . 0.435 ' HB2' ' OE1' ' A' ' 33' ' ' GLU . 59.8 mtpt -70.22 167.1 18.62 Favored 'General case' 0 CA--C 1.541 0.624 0 N-CA-C 113.098 0.777 . . . . 75.030000000000001 113.098 -170.722 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 46.5 t -50.66 -55.47 6.55 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.681 0 N-CA-C 112.726 0.639 . . . . 72.420000000000002 112.726 -174.46 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -60.47 -40.15 90.21 Favored 'General case' 0 N--CA 1.471 0.587 0 CA-C-O 120.979 0.419 . . . . 72.310000000000002 111.717 -179.378 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 33' ' ' GLU . . . . . 0.435 ' OE1' ' HB2' ' A' ' 30' ' ' LYS . 0.9 OUTLIER -58.49 -46.19 87.17 Favored 'General case' 0 CA--C 1.541 0.62 0 CA-C-N 115.838 -0.619 . . . . 71.340000000000003 111.412 177.113 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 34' ' ' LEU . . . . . 0.68 HD11 ' HZ1' ' A' ' 49' ' ' LYS . 91.6 mt -64.77 -46.43 82.17 Favored 'General case' 0 N--CA 1.471 0.594 0 CA-C-O 121.305 0.574 . . . . 74.430000000000007 111.019 176.756 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 35' ' ' LYS . . . . . 0.411 ' HZ3' ' HB3' ' A' ' 35' ' ' LYS . 9.0 mtpm? -60.94 -29.36 69.57 Favored 'General case' 0 CA--C 1.538 0.519 0 CA-C-N 115.882 -0.599 . . . . 71.450000000000003 111.929 179.112 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 54.2 tp60 -62.48 -47.63 83.17 Favored 'General case' 0 CA--C 1.538 0.496 0 CA-C-O 120.838 0.352 . . . . 74.099999999999994 110.849 176.95 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 29.9 mm-40 -61.92 -45.22 94.67 Favored 'General case' 0 N--CA 1.47 0.555 0 CA-C-O 121.104 0.478 . . . . 75.0 111.129 175.446 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 38' ' ' LEU . . . . . 0.449 ' CD1' HD23 ' A' ' 52' ' ' LEU . 97.3 mt -57.63 -53.95 52.33 Favored 'General case' 0 CA--C 1.541 0.626 0 CA-C-N 116.092 -0.503 . . . . 73.230000000000004 112.342 -178.781 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 19.3 ptpt -57.25 -38.25 73.57 Favored 'General case' 0 N--CA 1.474 0.743 0 CA-C-O 120.823 0.344 . . . . 72.349999999999994 111.745 -176.975 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 95.8 mt -65.78 -24.34 66.91 Favored 'General case' 0 CA--C 1.538 0.514 0 CA-C-O 121.187 0.518 . . . . 71.219999999999999 111.493 178.279 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 41' ' ' ARG . . . . . . . . . . . . . 80.4 mtt-85 -107.13 13.84 26.93 Favored 'General case' 0 CA--C 1.539 0.549 0 CA-C-N 116.143 -0.48 . . . . 74.019999999999996 111.754 -177.454 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 69.0 m 62.78 21.75 12.97 Favored 'General case' 0 N--CA 1.478 0.926 0 CA-C-O 121.022 0.439 . . . . 71.140000000000001 112.176 178.937 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 57.1 mt -88.57 147.81 40.5 Favored Pre-proline 0 CA--C 1.54 0.575 0 CA-C-N 116.224 -0.443 . . . . 74.030000000000001 111.516 -179.563 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 44' ' ' PRO . . . . . 0.532 ' HD2' ' HD3' ' A' ' 55' ' ' ARG . 51.8 Cg_exo -55.47 117.48 4.09 Favored 'Trans proline' 0 C--N 1.353 0.799 0 C-N-CA 122.888 2.392 . . . . 71.010000000000005 113.607 177.176 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 33.4 m -92.21 -18.38 7.25 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.579 0 CA-C-N 116.251 -0.431 . . . . 75.430000000000007 112.007 -179.944 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 57.2 m -84.51 50.44 1.89 Allowed 'General case' 0 N--CA 1.473 0.705 0 CA-C-O 120.993 0.425 . . . . 71.5 112.025 -177.634 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . -125.16 165.71 18.19 Favored Glycine 0 CA--C 1.526 0.722 0 C-N-CA 121.406 -0.426 . . . . 51.43 112.58 175.486 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 48' ' ' THR . . . . . 0.505 ' O ' ' HG ' ' A' ' 52' ' ' LEU . 68.7 p -76.09 165.05 25.5 Favored 'General case' 0 N--CA 1.472 0.64 0 O-C-N 122.517 -0.402 . . . . 64.0 111.801 178.808 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 49' ' ' LYS . . . . . 0.68 ' HZ1' HD11 ' A' ' 34' ' ' LEU . 26.7 tptp -44.97 -53.77 7.31 Favored 'General case' 0 N--CA 1.474 0.728 0 C-N-CA 123.234 0.614 . . . . 65.340000000000003 112.549 -174.994 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 50' ' ' THR . . . . . . . . . . . . . 60.1 m -62.0 -42.97 99.73 Favored 'General case' 0 N--CA 1.47 0.575 0 CA-C-N 116.617 -0.265 . . . . 72.019999999999996 111.703 -179.841 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 44.2 mt-10 -57.4 -41.87 81.13 Favored 'General case' 0 N--CA 1.471 0.622 0 CA-C-O 120.927 0.394 . . . . 72.0 110.933 177.88 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 52' ' ' LEU . . . . . 0.505 ' HG ' ' O ' ' A' ' 48' ' ' THR . 39.1 mt -63.7 -43.21 97.27 Favored 'General case' 0 CA--C 1.539 0.549 0 CA-C-N 116.194 -0.457 . . . . 71.439999999999998 111.152 179.376 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 53' ' ' ILE . . . . . 0.433 HG13 ' O ' ' A' ' 49' ' ' LYS . 68.2 mt -65.2 -51.72 61.87 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.524 0 CA-C-N 116.281 -0.418 . . . . 74.540000000000006 111.529 -179.917 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 43.7 mt-10 -57.69 -44.47 85.85 Favored 'General case' 0 N--CA 1.47 0.553 0 CA-C-O 120.968 0.413 . . . . 65.319999999999993 110.997 177.663 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 55' ' ' ARG . . . . . 0.532 ' HD3' ' HD2' ' A' ' 44' ' ' PRO . 37.2 ttm180 -57.42 -46.49 83.48 Favored 'General case' 0 CA--C 1.539 0.53 0 CA-C-N 115.847 -0.615 . . . . 72.140000000000001 111.955 179.496 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 56' ' ' LEU . . . . . 0.442 ' HB3' HD12 ' A' ' 22' ' ' LEU . 77.8 mt -63.78 -49.1 74.28 Favored 'General case' 0 CA--C 1.538 0.485 0 CA-C-O 120.773 0.32 . . . . 65.140000000000001 111.725 177.647 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 57' ' ' ARG . . . . . 0.401 ' O ' ' HB2' ' A' ' 61' ' ' ASP . 32.8 mtm180 -64.54 -37.58 88.05 Favored 'General case' 0 CA--C 1.539 0.529 0 N-CA-C 111.83 0.307 . . . . 75.540000000000006 111.83 -178.698 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -73.71 -34.57 64.87 Favored 'General case' 0 N--CA 1.47 0.542 0 CA-C-O 121.165 0.507 . . . . 71.140000000000001 111.393 178.933 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 59' ' ' TYR . . . . . . . . . . . . . 85.3 t80 -64.43 -55.83 18.31 Favored 'General case' 0 CA--C 1.537 0.453 0 CA-C-O 121.034 0.445 . . . . 75.200000000000003 110.701 175.983 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 60' ' ' GLN . . . . . 0.5 ' HB2' HD13 ' A' ' 22' ' ' LEU . 57.0 tp60 -59.99 -38.53 82.84 Favored 'General case' 0 CA--C 1.539 0.544 0 CA-C-N 116.087 -0.506 . . . . 63.340000000000003 111.426 178.049 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 61' ' ' ASP . . . . . 0.401 ' HB2' ' O ' ' A' ' 57' ' ' ARG . 15.8 t70 -54.54 -56.71 16.07 Favored 'General case' 0 CA--C 1.541 0.626 0 CA-C-N 116.107 -0.497 . . . . 64.329999999999998 112.086 179.107 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 62' ' ' GLN . . . . . . . . . . . . . 11.3 pt20 . . . . . 0 CA--C 1.541 0.619 0 N-CA-C 112.941 0.719 . . . . 74.109999999999999 112.941 -173.473 . . . . . . . . 0 0 . 1 . 013 nuclear orig core ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 88.5 mt . . . . . 0 CA--C 1.542 0.648 0 N-CA-C 111.675 0.25 . . . . 72.310000000000002 111.675 . . . . . . . . . 0 0 . 1 . 013 nuclear orig core ' A' A ' 23' ' ' PRO . . . . . 0.463 ' O ' ' HG ' ' A' ' 26' ' ' LEU . 15.6 Cg_exo -68.74 114.21 3.46 Favored 'Trans proline' 0 CA--C 1.541 0.84 0 C-N-CA 122.418 2.079 . . . . 73.209999999999994 111.767 172.612 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -47.02 -30.68 2.77 Favored 'General case' 0 N--CA 1.474 0.771 0 N-CA-C 113.122 0.786 . . . . 71.129999999999995 113.122 -176.781 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 25' ' ' ASN . . . . . 0.463 ' HB3' ' HB3' ' A' ' 28' ' ' ASP . 14.4 m120 -82.34 33.84 0.41 Allowed 'General case' 0 CA--C 1.545 0.786 0 N-CA-C 112.465 0.542 . . . . 74.439999999999998 112.465 -178.719 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 26' ' ' LEU . . . . . 0.463 ' HG ' ' O ' ' A' ' 23' ' ' PRO . 85.6 mt -50.75 -56.84 10.17 Favored 'General case' 0 N--CA 1.476 0.829 0 N-CA-C 112.221 0.452 . . . . 75.319999999999993 112.221 179.128 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 15.5 t70 -64.59 -22.54 67.0 Favored 'General case' 0 CA--C 1.544 0.741 0 CA-C-O 120.893 0.378 . . . . 75.230000000000004 111.753 -177.768 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 28' ' ' ASP . . . . . 0.463 ' HB3' ' HB3' ' A' ' 25' ' ' ASN . 26.0 t70 -74.56 -34.18 62.86 Favored 'General case' 0 CA--C 1.54 0.591 0 CA-C-N 116.385 -0.371 . . . . 73.420000000000002 111.431 178.885 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 29' ' ' MET . . . . . . . . . . . . . 49.4 mtm -73.92 150.97 40.53 Favored 'General case' 0 CA--C 1.537 0.448 0 CA-C-O 121.048 0.451 . . . . 74.310000000000002 111.486 -179.694 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 52.0 mtmt -69.12 153.77 43.17 Favored 'General case' 0 CA--C 1.537 0.479 0 CA-C-N 116.162 -0.472 . . . . 74.239999999999995 111.822 -178.049 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 31' ' ' VAL . . . . . 0.427 HG13 HD12 ' A' ' 52' ' ' LEU . 91.7 t -49.09 -43.37 15.53 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.679 0 N-CA-C 112.316 0.488 . . . . 72.129999999999995 112.316 -177.75 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -58.96 -44.03 91.39 Favored 'General case' 0 N--CA 1.47 0.574 0 CA-C-O 120.814 0.34 . . . . 75.519999999999996 111.756 176.687 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 47.3 mt-10 -63.61 -36.36 83.57 Favored 'General case' 0 N--CA 1.47 0.56 0 CA-C-O 120.928 0.394 . . . . 71.420000000000002 111.079 178.73 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 34' ' ' LEU . . . . . 0.445 HD23 ' O ' ' A' ' 26' ' ' LEU . 89.4 mt -69.06 -40.83 78.28 Favored 'General case' 0 CA--C 1.539 0.537 0 CA-C-O 120.923 0.392 . . . . 74.319999999999993 111.339 176.372 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 94.6 mttt -67.56 -28.15 67.55 Favored 'General case' 0 CA--C 1.536 0.433 0 CA-C-O 120.873 0.368 . . . . 74.349999999999994 110.82 174.844 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 53.2 tp60 -64.68 -44.12 91.36 Favored 'General case' 0 N--CA 1.469 0.512 0 N-CA-C 109.89 -0.411 . . . . 70.120000000000005 109.89 172.912 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 37' ' ' GLU . . . . . 0.452 ' HB3' ' NH2' ' A' ' 41' ' ' ARG . 55.9 mm-40 -53.23 -40.9 64.89 Favored 'General case' 0 N--CA 1.471 0.607 0 CA-C-N 115.971 -0.559 . . . . 75.120000000000005 111.473 174.636 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 38' ' ' LEU . . . . . 0.512 HD11 ' O ' ' A' ' 44' ' ' PRO . 96.6 mt -70.53 -57.48 4.72 Favored 'General case' 0 CA--C 1.538 0.499 0 CA-C-N 115.958 -0.564 . . . . 74.109999999999999 112.129 -179.874 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 17.8 ptpt -59.54 -39.13 82.96 Favored 'General case' 0 N--CA 1.472 0.648 0 N-CA-C 112.265 0.469 . . . . 74.129999999999995 112.265 -173.99 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 86.0 mt -64.62 -13.6 54.32 Favored 'General case' 0 N--CA 1.473 0.691 0 N-CA-C 112.1 0.408 . . . . 73.519999999999996 112.1 179.826 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 41' ' ' ARG . . . . . 0.452 ' NH2' ' HB3' ' A' ' 37' ' ' GLU . 39.0 mtm-85 -124.83 25.59 7.35 Favored 'General case' 0 CA--C 1.543 0.679 0 CA-C-O 120.838 0.351 . . . . 72.510000000000005 111.526 179.506 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 73.3 m 63.58 32.44 14.05 Favored 'General case' 0 N--CA 1.48 1.035 0 N-CA-C 113.118 0.785 . . . . 61.310000000000002 113.118 174.175 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 71.6 mt -104.02 145.41 30.6 Favored Pre-proline 0 CA--C 1.544 0.741 0 CA-C-O 120.712 0.292 . . . . 73.420000000000002 111.731 178.226 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 44' ' ' PRO . . . . . 0.512 ' O ' HD11 ' A' ' 38' ' ' LEU . 32.1 Cg_exo -62.44 135.59 54.36 Favored 'Trans proline' 0 C--N 1.354 0.849 0 C-N-CA 122.724 2.283 . . . . 54.399999999999999 112.898 178.662 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 45' ' ' VAL . . . . . 0.452 HG11 ' HB2' ' A' ' 38' ' ' LEU . 33.1 m -109.39 12.1 8.8 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.853 0 N-CA-C 112.55 0.574 . . . . 72.540000000000006 112.55 -176.524 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 46.8 m -79.7 9.17 5.4 Favored 'General case' 0 N--CA 1.476 0.841 0 N-CA-C 113.22 0.822 . . . . 75.519999999999996 113.22 -173.869 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . -106.21 170.82 17.0 Favored Glycine 0 CA--C 1.529 0.909 0 C-N-CA 120.797 -0.716 . . . . 43.409999999999997 113.911 -178.966 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 48' ' ' THR . . . . . 0.603 ' O ' ' HG ' ' A' ' 52' ' ' LEU . 74.9 p -83.21 178.04 8.27 Favored 'General case' 0 N--CA 1.472 0.645 0 C-N-CA 122.494 0.318 . . . . 73.230000000000004 111.446 176.627 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 88.5 tttt -46.42 -47.02 19.05 Favored 'General case' 0 CA--C 1.545 0.782 0 N-CA-C 112.755 0.65 . . . . 71.030000000000001 112.755 -175.903 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 50' ' ' THR . . . . . . . . . . . . . 56.7 m -64.43 -44.53 90.87 Favored 'General case' 0 N--CA 1.474 0.775 0 CA-C-O 120.714 0.292 . . . . 75.209999999999994 111.243 178.752 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 23.4 mm-40 -55.75 -44.64 77.78 Favored 'General case' 0 N--CA 1.473 0.717 0 CA-C-O 121.167 0.508 . . . . 74.109999999999999 111.28 177.101 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 52' ' ' LEU . . . . . 0.603 ' HG ' ' O ' ' A' ' 48' ' ' THR . 28.9 mt -57.63 -51.83 67.89 Favored 'General case' 0 N--CA 1.469 0.491 0 CA-C-N 115.773 -0.649 . . . . 70.329999999999998 111.607 -177.771 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 53' ' ' ILE . . . . . 0.402 ' O ' ' HG3' ' A' ' 57' ' ' ARG . 68.2 mt -60.47 -52.54 60.29 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.457 0 CA-C-N 116.352 -0.385 . . . . 75.150000000000006 111.772 179.887 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 33.7 mt-10 -60.73 -34.01 73.77 Favored 'General case' 0 N--CA 1.471 0.586 0 CA-C-O 120.931 0.396 . . . . 63.140000000000001 111.595 -178.949 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -64.82 -42.87 94.62 Favored 'General case' 0 CA--C 1.54 0.573 0 CA-C-O 121.221 0.534 . . . . 75.140000000000001 110.408 177.87 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 56' ' ' LEU . . . . . 0.417 HD23 HH21 ' A' ' 41' ' ' ARG . 97.3 mt -61.45 -46.13 91.37 Favored 'General case' 0 N--CA 1.47 0.53 0 CA-C-N 115.988 -0.551 . . . . 74.310000000000002 111.001 174.214 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 57' ' ' ARG . . . . . 0.402 ' HG3' ' O ' ' A' ' 53' ' ' ILE . 66.8 mtp180 -60.67 -36.04 77.73 Favored 'General case' 0 CA--C 1.544 0.73 0 CA-C-N 116.382 -0.372 . . . . 75.430000000000007 111.707 179.563 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -67.76 -39.02 84.19 Favored 'General case' 0 N--CA 1.472 0.654 0 CA-C-O 121.1 0.476 . . . . 65.299999999999997 111.12 175.797 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 59' ' ' TYR . . . . . . . . . . . . . 75.2 t80 -62.74 -44.82 95.22 Favored 'General case' 0 CA--C 1.542 0.661 0 CA-C-N 116.215 -0.448 . . . . 74.129999999999995 111.154 175.772 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 60' ' ' GLN . . . . . . . . . . . . . 15.5 mm100 -65.18 -45.78 83.45 Favored 'General case' 0 N--CA 1.471 0.584 0 CA-C-O 121.12 0.486 . . . . 74.25 111.501 177.494 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 61' ' ' ASP . . . . . . . . . . . . . 27.1 t70 -47.13 -38.83 12.26 Favored 'General case' 0 CA--C 1.543 0.704 0 CA-C-N 115.565 -0.743 . . . . 74.439999999999998 112.892 -178.231 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 62' ' ' GLN . . . . . . . . . . . . . 9.6 pt20 . . . . . 0 CA--C 1.544 0.725 0 N-CA-C 112.954 0.724 . . . . 74.129999999999995 112.954 -175.612 . . . . . . . . 0 0 . 1 . 014 nuclear orig core ' A' A ' 22' ' ' LEU . . . . . 0.538 ' HG ' ' HG3' ' A' ' 60' ' ' GLN . 94.3 mt . . . . . 0 N--CA 1.47 0.568 0 N-CA-C 111.955 0.354 . . . . 72.420000000000002 111.955 . . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 23' ' ' PRO . . . . . 0.608 ' O ' ' HG ' ' A' ' 26' ' ' LEU . 22.9 Cg_exo -64.85 125.51 14.9 Favored 'Trans proline' 0 CA--C 1.538 0.701 0 C-N-CA 122.626 2.217 . . . . 71.530000000000001 111.773 173.269 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -56.27 -23.96 39.82 Favored 'General case' 0 CA--C 1.542 0.656 0 N-CA-C 112.934 0.716 . . . . 74.430000000000007 112.934 -176.339 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 3.7 m-20 -82.23 19.21 1.23 Allowed 'General case' 0 CA--C 1.545 0.772 0 N-CA-C 113.314 0.857 . . . . 72.239999999999995 113.314 -177.063 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 26' ' ' LEU . . . . . 0.608 ' HG ' ' O ' ' A' ' 23' ' ' PRO . 77.8 mt -50.32 -47.77 55.61 Favored 'General case' 0 N--CA 1.479 0.996 0 O-C-N 121.946 -0.471 . . . . 74.239999999999995 111.771 176.86 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 27' ' ' ASP . . . . . 0.419 ' HB3' HD13 ' A' ' 53' ' ' ILE . 1.0 OUTLIER -71.59 -28.7 64.0 Favored 'General case' 0 CA--C 1.539 0.551 0 N-CA-C 112.246 0.461 . . . . 70.299999999999997 112.246 179.055 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 34.6 t70 -77.31 -24.15 50.94 Favored 'General case' 0 CA--C 1.544 0.745 0 N-CA-C 111.725 0.268 . . . . 63.25 111.725 -179.784 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 29' ' ' MET . . . . . . . . . . . . . 68.8 mtm -79.07 -178.26 6.04 Favored 'General case' 0 CA--C 1.539 0.55 0 CA-C-O 121.296 0.569 . . . . 70.430000000000007 111.95 178.484 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 28.2 mtpp -87.37 165.23 15.75 Favored 'General case' 0 CA--C 1.539 0.523 0 CA-C-O 121.225 0.536 . . . . 71.140000000000001 112.094 -177.206 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 42.3 t -62.16 -42.63 95.88 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.556 0 CA-C-N 116.215 -0.448 . . . . 71.230000000000004 111.218 179.574 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -54.98 -39.03 68.55 Favored 'General case' 0 CA--C 1.539 0.542 0 CA-C-N 116.163 -0.471 . . . . 73.0 112.193 179.004 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 22.5 mm-40 -60.34 -48.43 81.76 Favored 'General case' 0 N--CA 1.469 0.507 0 CA-C-O 120.933 0.397 . . . . 72.030000000000001 111.177 177.954 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 34' ' ' LEU . . . . . 0.42 ' O ' ' HG ' ' A' ' 38' ' ' LEU . 67.8 mt -58.89 -47.04 86.36 Favored 'General case' 0 N--CA 1.468 0.438 0 CA-C-O 121.174 0.511 . . . . 73.519999999999996 111.169 178.289 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 35' ' ' LYS . . . . . 0.643 ' HB3' ' HZ1' ' A' ' 35' ' ' LYS . 7.4 mtpm? -58.02 -37.75 74.91 Favored 'General case' 0 CA--C 1.541 0.619 0 CA-C-N 115.969 -0.559 . . . . 72.519999999999996 111.258 177.745 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 19.6 tm0? -68.88 -42.73 76.58 Favored 'General case' 0 CA--C 1.544 0.731 0 CA-C-O 120.957 0.408 . . . . 73.239999999999995 110.209 177.053 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 37' ' ' GLU . . . . . 0.46 ' HB3' HH21 ' A' ' 41' ' ' ARG . 36.9 mm-40 -58.57 -29.88 66.73 Favored 'General case' 0 N--CA 1.474 0.738 0 CA-C-N 116.287 -0.415 . . . . 64.140000000000001 111.937 176.166 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 38' ' ' LEU . . . . . 0.528 HD12 HD22 ' A' ' 52' ' ' LEU . 78.7 mt -73.95 -54.85 7.02 Favored 'General case' 0 CA--C 1.541 0.62 0 CA-C-N 116.137 -0.483 . . . . 74.329999999999998 112.126 -179.051 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 39' ' ' LYS . . . . . 0.484 ' HZ3' ' HB3' ' A' ' 39' ' ' LYS . 0.6 OUTLIER -57.04 -31.16 64.87 Favored 'General case' 0 N--CA 1.476 0.854 0 N-CA-C 112.423 0.527 . . . . 74.510000000000005 112.423 -176.57 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 98.6 mt -61.34 -36.16 79.4 Favored 'General case' 0 N--CA 1.471 0.608 0 CA-C-O 121.235 0.54 . . . . 74.140000000000001 111.427 177.366 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 41' ' ' ARG . . . . . 0.46 HH21 ' HB3' ' A' ' 37' ' ' GLU . 13.9 mtm180 -109.03 27.24 9.71 Favored 'General case' 0 CA--C 1.542 0.649 0 CA-C-N 116.002 -0.545 . . . . 73.019999999999996 112.307 -175.949 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 38.3 t 68.98 12.63 8.67 Favored 'General case' 0 N--CA 1.48 1.059 0 N-CA-C 112.578 0.585 . . . . 72.099999999999994 112.578 173.566 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 71.9 mt -87.47 148.11 43.53 Favored Pre-proline 0 CA--C 1.542 0.661 0 O-C-N 122.333 -0.23 . . . . 72.420000000000002 111.137 -179.971 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 44' ' ' PRO . . . . . 0.426 ' O ' HD13 ' A' ' 38' ' ' LEU . 67.9 Cg_endo -70.73 125.35 11.55 Favored 'Trans proline' 0 C--N 1.352 0.752 0 C-N-CA 122.284 1.989 . . . . 74.319999999999993 112.637 -177.895 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 45' ' ' VAL . . . . . 0.451 ' O ' ' HE2' ' A' ' 35' ' ' LYS . 30.5 m -76.72 27.42 0.04 OUTLIER 'Isoleucine or valine' 0 CA--C 1.546 0.808 0 N-CA-C 112.936 0.717 . . . . 75.439999999999998 112.936 -176.108 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 68.7 m -123.65 130.51 52.77 Favored 'General case' 0 N--CA 1.471 0.595 0 CA-C-O 121.231 0.539 . . . . 75.239999999999995 111.777 -178.428 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 152.29 164.12 12.1 Favored Glycine 0 CA--C 1.528 0.906 0 CA-C-N 115.363 -0.835 . . . . 73.540000000000006 112.045 -179.182 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 48' ' ' THR . . . . . 0.413 ' O ' ' HG ' ' A' ' 52' ' ' LEU . 44.1 p -77.09 162.16 27.7 Favored 'General case' 0 N--CA 1.475 0.806 0 CA-C-N 117.629 0.714 . . . . 73.0 111.786 -179.8 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 49' ' ' LYS . . . . . 0.507 ' O ' HG13 ' A' ' 53' ' ' ILE . 24.2 tptm -44.26 -61.57 1.46 Allowed 'General case' 0 N--CA 1.472 0.651 0 CA-C-N 116.032 -0.531 . . . . 74.319999999999993 112.154 -178.883 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 50' ' ' THR . . . . . 0.444 ' HA ' HD11 ' A' ' 53' ' ' ILE . 34.6 m -56.59 -45.48 81.37 Favored 'General case' 0 N--CA 1.472 0.643 0 N-CA-C 112.129 0.418 . . . . 73.209999999999994 112.129 -176.718 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 48.0 mt-10 -66.09 -41.0 91.24 Favored 'General case' 0 CA--C 1.536 0.433 0 N-CA-C 112.248 0.462 . . . . 75.310000000000002 112.248 -176.441 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 52' ' ' LEU . . . . . 0.528 HD22 HD12 ' A' ' 38' ' ' LEU . 62.6 mt -62.8 -42.02 99.54 Favored 'General case' 0 N--CA 1.469 0.517 0 CA-C-O 121.046 0.45 . . . . 70.239999999999995 111.24 179.024 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 53' ' ' ILE . . . . . 0.507 HG13 ' O ' ' A' ' 49' ' ' LYS . 35.1 mt -58.02 -54.64 29.38 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.435 0 CA-C-O 121.365 0.603 . . . . 72.109999999999999 110.914 176.68 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 54.1 mm-40 -67.23 -24.64 65.84 Favored 'General case' 0 CA--C 1.535 0.39 0 CA-C-N 115.935 -0.575 . . . . 73.319999999999993 111.876 179.363 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 37.1 ttm180 -67.06 -45.83 76.2 Favored 'General case' 0 N--CA 1.467 0.419 0 CA-C-O 120.991 0.424 . . . . 73.439999999999998 110.408 175.637 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 83.0 mt -60.72 -48.65 80.85 Favored 'General case' 0 CA--C 1.539 0.522 0 CA-C-O 121.125 0.488 . . . . 74.439999999999998 111.079 174.925 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 65.7 mtt180 -62.03 -38.25 87.99 Favored 'General case' 0 N--CA 1.469 0.5 0 CA-C-N 116.194 -0.457 . . . . 75.219999999999999 111.555 178.246 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -66.08 -40.56 90.94 Favored 'General case' 0 CA--C 1.534 0.328 0 CA-C-O 120.884 0.373 . . . . 74.549999999999997 111.068 177.352 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 59' ' ' TYR . . . . . 0.413 ' O ' ' HG2' ' A' ' 62' ' ' GLN . 71.1 t80 -58.91 -48.42 81.53 Favored 'General case' 0 CA--C 1.538 0.494 0 CA-C-N 116.144 -0.48 . . . . 75.430000000000007 110.987 177.457 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 60' ' ' GLN . . . . . 0.538 ' HG3' ' HG ' ' A' ' 22' ' ' LEU . 14.3 mm100 -63.35 -42.54 98.93 Favored 'General case' 0 CA--C 1.539 0.537 0 CA-C-O 120.747 0.308 . . . . 71.25 111.275 175.861 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 61' ' ' ASP . . . . . . . . . . . . . 27.0 t70 -56.81 -47.69 79.68 Favored 'General case' 0 CA--C 1.541 0.6 0 N-CA-C 112.022 0.379 . . . . 74.530000000000001 112.022 179.498 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 62' ' ' GLN . . . . . 0.413 ' HG2' ' O ' ' A' ' 59' ' ' TYR . 3.4 pt20 . . . . . 0 CA--C 1.539 0.544 0 N-CA-C 112.026 0.38 . . . . 75.219999999999999 112.026 -177.343 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 22' ' ' LEU . . . . . 0.419 ' HA ' ' HD3' ' A' ' 23' ' ' PRO . 99.4 mt . . . . . 0 CA--C 1.536 0.436 0 N-CA-C 111.943 0.349 . . . . 73.230000000000004 111.943 . . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 23' ' ' PRO . . . . . 0.532 ' O ' ' HG ' ' A' ' 26' ' ' LEU . 11.4 Cg_exo -73.69 152.34 47.69 Favored 'Trans proline' 0 CA--C 1.543 0.937 0 C-N-CA 122.985 2.456 . . . . 72.209999999999994 112.681 173.685 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -73.81 -19.44 60.75 Favored 'General case' 0 N--CA 1.471 0.619 0 CA-C-O 121.279 0.562 . . . . 72.540000000000006 111.088 175.567 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 15.3 m120 -84.41 24.12 1.02 Allowed 'General case' 0 CA--C 1.541 0.625 0 N-CA-C 112.986 0.736 . . . . 72.150000000000006 112.986 -179.486 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 26' ' ' LEU . . . . . 0.532 ' HG ' ' O ' ' A' ' 23' ' ' PRO . 67.2 mt -52.88 -37.4 60.44 Favored 'General case' 0 N--CA 1.479 1.018 0 CA-C-N 118.327 0.512 . . . . 72.420000000000002 111.615 179.221 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 4.3 m-20 -68.55 -36.31 78.62 Favored 'General case' 0 CA--C 1.544 0.722 0 CA-C-O 121.278 0.561 . . . . 74.439999999999998 111.544 177.707 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 9.1 m-20 -76.32 -37.47 57.35 Favored 'General case' 0 CA--C 1.538 0.509 0 CA-C-N 116.165 -0.471 . . . . 75.230000000000004 111.681 179.202 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 29' ' ' MET . . . . . . . . . . . . . 81.4 mtp -59.68 141.78 54.38 Favored 'General case' 0 N--CA 1.466 0.373 0 CA-C-N 115.871 -0.604 . . . . 74.219999999999999 112.546 -175.07 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 30' ' ' LYS . . . . . 0.541 ' HB2' ' HG2' ' A' ' 33' ' ' GLU . 48.3 mtmt -68.94 149.38 48.91 Favored 'General case' 0 CA--C 1.539 0.52 0 CA-C-N 115.545 -0.752 . . . . 71.329999999999998 111.992 -179.725 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 90.0 t -48.24 -44.47 12.67 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.724 0 CA-C-N 115.868 -0.606 . . . . 72.340000000000003 112.194 -179.797 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -61.25 -39.67 91.21 Favored 'General case' 0 N--CA 1.469 0.523 0 N-CA-C 112.12 0.415 . . . . 74.099999999999994 112.12 179.252 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 33' ' ' GLU . . . . . 0.541 ' HG2' ' HB2' ' A' ' 30' ' ' LYS . 16.3 mm-40 -68.23 -37.32 80.7 Favored 'General case' 0 N--CA 1.467 0.424 0 CA-C-O 120.971 0.415 . . . . 74.430000000000007 111.23 -178.779 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 83.2 mt -61.49 -45.99 91.88 Favored 'General case' 0 CA--C 1.538 0.481 0 CA-C-O 121.23 0.538 . . . . 75.430000000000007 110.5 175.56 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 35' ' ' LYS . . . . . 0.456 ' HA ' HD12 ' A' ' 38' ' ' LEU . 96.6 mttt -64.82 -29.13 70.08 Favored 'General case' 0 CA--C 1.539 0.532 0 CA-C-N 116.293 -0.412 . . . . 71.299999999999997 111.398 176.684 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 36' ' ' GLN . . . . . 0.515 ' HA ' ' HE3' ' A' ' 39' ' ' LYS . 55.9 tp60 -61.95 -37.39 84.55 Favored 'General case' 0 CA--C 1.539 0.552 0 CA-C-N 116.334 -0.394 . . . . 71.099999999999994 111.297 178.256 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 36.6 mt-10 -81.49 -30.2 33.38 Favored 'General case' 0 CA--C 1.539 0.531 0 O-C-N 122.166 -0.334 . . . . 72.129999999999995 111.698 176.06 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 38' ' ' LEU . . . . . 0.456 HD12 ' HA ' ' A' ' 35' ' ' LYS . 89.2 mt -58.71 -54.35 48.05 Favored 'General case' 0 N--CA 1.472 0.655 0 CA-C-O 120.741 0.305 . . . . 74.530000000000001 111.377 174.94 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 39' ' ' LYS . . . . . 0.515 ' HE3' ' HA ' ' A' ' 36' ' ' GLN . 17.5 ptpt -55.36 -37.13 67.12 Favored 'General case' 0 CA--C 1.543 0.687 0 CA-C-N 116.463 -0.335 . . . . 70.409999999999997 111.553 -179.781 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 40' ' ' LEU . . . . . 0.42 ' HG ' ' O ' ' A' ' 36' ' ' GLN . 94.2 mt -69.03 -29.39 67.54 Favored 'General case' 0 CA--C 1.538 0.49 0 N-CA-C 112.002 0.371 . . . . 75.299999999999997 112.002 -179.086 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 41' ' ' ARG . . . . . 0.587 HH21 HD22 ' A' ' 56' ' ' LEU . 61.5 mtm180 -105.92 22.82 14.98 Favored 'General case' 0 CA--C 1.542 0.659 0 N-CA-C 112.118 0.414 . . . . 71.439999999999998 112.118 -177.78 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 31.1 t 62.69 28.96 16.79 Favored 'General case' 0 N--CA 1.482 1.156 0 CA-C-O 121.33 0.586 . . . . 71.219999999999999 112.046 176.133 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 65.3 mt -100.6 148.63 35.24 Favored Pre-proline 0 CA--C 1.543 0.692 0 CA-C-N 116.056 -0.52 . . . . 74.400000000000006 111.182 179.125 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 44' ' ' PRO . . . . . . . . . . . . . 56.8 Cg_endo -69.36 130.27 19.53 Favored 'Trans proline' 0 CA--C 1.541 0.852 0 C-N-CA 122.364 2.043 . . . . 55.329999999999998 113.094 179.644 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 34.8 m -76.06 -21.77 15.63 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.533 0 CA-C-N 116.153 -0.476 . . . . 62.32 111.618 179.339 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 31.5 t -62.22 101.57 0.23 Allowed 'General case' 0 N--CA 1.473 0.721 0 CA-C-N 116.36 -0.382 . . . . 72.099999999999994 111.902 178.501 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 176.89 154.03 11.47 Favored Glycine 0 CA--C 1.532 1.119 0 C-N-CA 120.854 -0.689 . . . . 55.43 114.063 177.516 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 48' ' ' THR . . . . . 0.563 ' O ' ' HG ' ' A' ' 52' ' ' LEU . 44.0 p -76.82 174.06 10.96 Favored 'General case' 0 N--CA 1.476 0.871 0 O-C-N 122.633 -0.333 . . . . 72.129999999999995 110.87 174.133 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 24.5 tptm -49.85 -49.59 48.64 Favored 'General case' 0 N--CA 1.474 0.745 0 CA-C-O 120.84 0.353 . . . . 75.349999999999994 111.357 -179.566 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 50' ' ' THR . . . . . . . . . . . . . 82.7 m -58.27 -50.33 73.98 Favored 'General case' 0 N--CA 1.475 0.783 0 CA-C-O 120.954 0.407 . . . . 70.409999999999997 111.317 176.832 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 15.6 mm-40 -54.1 -46.76 72.19 Favored 'General case' 0 N--CA 1.469 0.484 0 CA-C-N 115.846 -0.615 . . . . 71.219999999999999 111.803 -179.71 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 52' ' ' LEU . . . . . 0.563 ' HG ' ' O ' ' A' ' 48' ' ' THR . 50.9 mt -63.03 -48.63 77.93 Favored 'General case' 0 CA--C 1.537 0.476 0 CA-C-N 116.304 -0.407 . . . . 73.319999999999993 111.309 -178.167 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 53' ' ' ILE . . . . . . . . . . . . . 74.3 mt -59.13 -48.07 88.03 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.568 0 N-CA-C 111.998 0.37 . . . . 72.010000000000005 111.998 -179.609 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 54' ' ' GLU . . . . . 0.724 ' HG2' HH21 ' A' ' 57' ' ' ARG . 27.2 mt-10 -68.87 -38.4 79.67 Favored 'General case' 0 CA--C 1.537 0.455 0 O-C-N 122.243 -0.286 . . . . 75.439999999999998 111.341 179.49 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 39.7 ttm180 -62.41 -43.83 97.89 Favored 'General case' 0 CA--C 1.539 0.554 0 CA-C-O 120.98 0.419 . . . . 73.329999999999998 111.14 177.591 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 56' ' ' LEU . . . . . 0.587 HD22 HH21 ' A' ' 41' ' ' ARG . 48.7 mt -58.76 -51.55 69.51 Favored 'General case' 0 C--O 1.237 0.415 0 CA-C-N 116.206 -0.452 . . . . 75.409999999999997 111.057 174.029 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 57' ' ' ARG . . . . . 0.724 HH21 ' HG2' ' A' ' 54' ' ' GLU . 79.0 mtm180 -60.62 -47.59 85.56 Favored 'General case' 0 CA--C 1.538 0.513 0 N-CA-C 112.205 0.446 . . . . 75.310000000000002 112.205 -178.761 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -55.12 -51.3 66.88 Favored 'General case' 0 N--CA 1.472 0.646 0 CA-C-O 120.863 0.363 . . . . 71.439999999999998 111.936 -178.348 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 59' ' ' TYR . . . . . . . . . . . . . 76.9 t80 -57.56 -41.34 80.84 Favored 'General case' 0 CA--C 1.54 0.596 0 CA-C-O 121.183 0.516 . . . . 62.439999999999998 111.59 179.222 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 60' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -74.61 -30.57 61.72 Favored 'General case' 0 N--CA 1.472 0.635 0 CA-C-O 121.381 0.61 . . . . 64.510000000000005 110.573 178.857 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 61' ' ' ASP . . . . . . . . . . . . . 8.0 t70 -64.62 -37.16 86.61 Favored 'General case' 0 CA--C 1.541 0.625 0 CA-C-N 115.891 -0.595 . . . . 75.040000000000006 111.491 -176.338 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 62' ' ' GLN . . . . . . . . . . . . . 51.5 mt-30 . . . . . 0 CA--C 1.541 0.604 0 N-CA-C 112.129 0.418 . . . . 55.229999999999997 112.129 178.872 . . . . . . . . 0 0 . 1 . 016 nuclear orig core ' A' A ' 22' ' ' LEU . . . . . 0.438 HD12 ' HB3' ' A' ' 56' ' ' LEU . 94.3 mt . . . . . 0 CA--C 1.538 0.501 0 CA-C-O 120.434 0.159 . . . . 71.439999999999998 110.61 . . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 23' ' ' PRO . . . . . 0.469 ' O ' ' HG ' ' A' ' 26' ' ' LEU . 37.8 Cg_endo -64.92 139.22 60.96 Favored 'Trans proline' 0 CA--C 1.54 0.805 0 C-N-CA 122.605 2.204 . . . . 65.140000000000001 113.134 -178.386 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -72.15 -2.83 20.12 Favored 'General case' 0 CA--C 1.543 0.694 0 CA-C-O 121.04 0.448 . . . . 71.510000000000005 111.874 179.124 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 11.2 m120 -82.54 18.73 1.42 Allowed 'General case' 0 CA--C 1.542 0.658 0 N-CA-C 112.183 0.438 . . . . 73.129999999999995 112.183 -178.768 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 26' ' ' LEU . . . . . 0.469 ' HG ' ' O ' ' A' ' 23' ' ' PRO . 90.7 mt -58.18 -40.12 80.67 Favored 'General case' 0 N--CA 1.471 0.612 0 CA-C-O 120.842 0.353 . . . . 73.349999999999994 111.84 -178.632 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 7.3 m-20 -63.28 -34.81 78.49 Favored 'General case' 0 CA--C 1.539 0.534 0 CA-C-O 120.978 0.418 . . . . 71.150000000000006 111.206 175.283 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 36.6 t70 -72.45 -42.55 64.89 Favored 'General case' 0 CA--C 1.542 0.66 0 CA-C-N 116.255 -0.43 . . . . 74.519999999999996 111.533 -178.649 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 29' ' ' MET . . . . . . . . . . . . . 50.2 mtm -68.92 159.81 31.95 Favored 'General case' 0 N--CA 1.471 0.606 0 CA-C-O 121.092 0.472 . . . . 71.230000000000004 111.608 179.279 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 54.5 mtpt -88.9 171.43 9.91 Favored 'General case' 0 CA--C 1.54 0.583 0 N-CA-C 112.689 0.626 . . . . 73.25 112.689 -173.623 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 31' ' ' VAL . . . . . 0.45 HG23 ' HD3' ' A' ' 49' ' ' LYS . 86.5 t -56.66 -47.89 81.59 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.615 0 CA-C-N 115.798 -0.637 . . . . 75.310000000000002 112.372 -176.74 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -58.67 -38.52 78.37 Favored 'General case' 0 CA--C 1.536 0.426 0 CA-C-N 116.448 -0.342 . . . . 53.25 111.871 -179.353 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 37.4 mt-10 -69.73 -41.86 74.73 Favored 'General case' 0 CA--C 1.537 0.469 0 CA-C-O 121.114 0.483 . . . . 73.439999999999998 111.192 179.42 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 34' ' ' LEU . . . . . 0.495 HD11 ' HZ3' ' A' ' 49' ' ' LYS . 95.4 mt -63.34 -47.21 83.11 Favored 'General case' 0 CA--C 1.54 0.559 0 CA-C-N 116.346 -0.388 . . . . 73.019999999999996 111.305 178.171 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 35' ' ' LYS . . . . . 0.468 ' HE2' ' O ' ' A' ' 45' ' ' VAL . 98.5 mttt -61.31 -35.66 77.98 Favored 'General case' 0 CA--C 1.537 0.464 0 CA-C-N 116.577 -0.283 . . . . 73.040000000000006 111.513 177.598 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 36' ' ' GLN . . . . . 0.515 ' NE2' HD11 ' A' ' 40' ' ' LEU . 22.4 tm0? -60.59 -44.52 96.16 Favored 'General case' 0 CA--C 1.539 0.536 0 CA-C-O 120.868 0.366 . . . . 73.319999999999993 110.771 177.38 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 37' ' ' GLU . . . . . 0.594 ' HB3' ' NH2' ' A' ' 41' ' ' ARG . 24.8 mm-40 -64.31 -41.03 97.03 Favored 'General case' 0 CA--C 1.543 0.698 0 CA-C-N 116.329 -0.396 . . . . 74.230000000000004 111.884 175.04 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 38' ' ' LEU . . . . . 0.461 ' HB2' HG11 ' A' ' 45' ' ' VAL . 88.5 mt -62.24 -56.01 22.81 Favored 'General case' 0 N--CA 1.472 0.628 0 N-CA-C 112.164 0.431 . . . . 72.120000000000005 112.164 179.552 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 18.6 ptpt -57.03 -34.75 68.52 Favored 'General case' 0 N--CA 1.473 0.683 0 N-CA-C 112.582 0.586 . . . . 75.109999999999999 112.582 -174.475 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 40' ' ' LEU . . . . . 0.515 HD11 ' NE2' ' A' ' 36' ' ' GLN . 92.7 mt -63.55 -33.5 75.72 Favored 'General case' 0 N--CA 1.473 0.679 0 CA-C-O 120.904 0.383 . . . . 70.530000000000001 111.694 177.91 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 41' ' ' ARG . . . . . 0.735 HH21 HD22 ' A' ' 56' ' ' LEU . 70.0 mtm-85 -105.69 23.11 14.4 Favored 'General case' 0 CA--C 1.54 0.565 0 CA-C-N 116.44 -0.346 . . . . 71.420000000000002 111.923 -178.013 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 23.2 t 64.48 22.81 12.79 Favored 'General case' 0 N--CA 1.478 0.959 0 N-CA-C 112.317 0.488 . . . . 64.219999999999999 112.317 173.134 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 72.5 mt -92.12 134.39 28.65 Favored Pre-proline 0 CA--C 1.546 0.805 0 CA-C-N 116.626 -0.261 . . . . 74.450000000000003 111.611 -178.482 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 44' ' ' PRO . . . . . 0.525 ' HD2' ' HD3' ' A' ' 55' ' ' ARG . 77.8 Cg_exo -52.06 115.37 2.12 Favored 'Trans proline' 0 C--N 1.356 0.949 0 C-N-CA 122.994 2.463 . . . . 74.310000000000002 113.71 178.638 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 45' ' ' VAL . . . . . 0.468 ' O ' ' HE2' ' A' ' 35' ' ' LYS . 33.0 m -85.5 -10.77 11.4 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.608 0 N-CA-C 112.523 0.564 . . . . 74.219999999999999 112.523 -178.955 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 33.2 t -80.9 32.3 0.32 Allowed 'General case' 0 N--CA 1.481 1.1 0 N-CA-C 113.064 0.764 . . . . 72.319999999999993 113.064 -173.424 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . -107.8 176.45 20.67 Favored Glycine 0 CA--C 1.527 0.833 0 C-N-CA 121.028 -0.606 . . . . 72.239999999999995 113.471 179.459 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 48' ' ' THR . . . . . 0.544 ' O ' ' HG ' ' A' ' 52' ' ' LEU . 72.3 p -76.31 163.14 27.3 Favored 'General case' 0 N--CA 1.475 0.812 0 O-C-N 122.668 -0.313 . . . . 72.439999999999998 111.372 176.829 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 49' ' ' LYS . . . . . 0.495 ' HZ3' HD11 ' A' ' 34' ' ' LEU . 29.6 tptp -44.37 -44.24 8.14 Favored 'General case' 0 N--CA 1.473 0.721 0 CA-C-O 120.962 0.41 . . . . 72.120000000000005 111.795 178.169 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 50' ' ' THR . . . . . . . . . . . . . 30.5 m -68.2 -44.79 75.06 Favored 'General case' 0 CA--C 1.538 0.504 0 CA-C-N 116.213 -0.449 . . . . 72.310000000000002 111.675 179.037 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 44.0 mt-10 -60.7 -42.47 97.24 Favored 'General case' 0 N--CA 1.471 0.611 0 N-CA-C 111.952 0.352 . . . . 72.209999999999994 111.952 179.446 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 52' ' ' LEU . . . . . 0.544 ' HG ' ' O ' ' A' ' 48' ' ' THR . 46.7 mt -54.81 -39.2 68.26 Favored 'General case' 0 N--CA 1.469 0.523 0 CA-C-O 121.504 0.669 . . . . 75.230000000000004 110.325 178.457 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 53' ' ' ILE . . . . . . . . . . . . . 88.5 mt -70.25 -58.09 6.34 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.517 0 CA-C-N 115.184 -0.916 . . . . 70.439999999999998 111.911 179.287 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 40.6 mt-10 -61.29 -31.7 71.53 Favored 'General case' 0 N--CA 1.468 0.469 0 N-CA-C 111.897 0.332 . . . . 71.340000000000003 111.897 -178.019 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 55' ' ' ARG . . . . . 0.525 ' HD3' ' HD2' ' A' ' 44' ' ' PRO . 35.2 ttm180 -65.53 -41.22 93.3 Favored 'General case' 0 CA--C 1.538 0.486 0 CA-C-O 120.76 0.314 . . . . 74.439999999999998 111.258 177.187 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 56' ' ' LEU . . . . . 0.735 HD22 HH21 ' A' ' 41' ' ' ARG . 79.6 mt -63.72 -47.7 80.07 Favored 'General case' 0 CA--C 1.537 0.46 0 CA-C-O 121.023 0.44 . . . . 63.530000000000001 111.043 174.015 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 74.6 mtp180 -61.67 -43.12 99.45 Favored 'General case' 0 CA--C 1.54 0.583 0 CA-C-N 116.098 -0.501 . . . . 75.030000000000001 111.466 179.328 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -64.8 -39.51 93.71 Favored 'General case' 0 N--CA 1.469 0.507 0 CA-C-N 116.419 -0.355 . . . . 63.109999999999999 111.673 179.456 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 59' ' ' TYR . . . . . . . . . . . . . 84.8 t80 -64.56 -47.29 79.28 Favored 'General case' 0 CA--C 1.537 0.468 0 CA-C-O 120.977 0.418 . . . . 71.319999999999993 110.677 176.371 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 60' ' ' GLN . . . . . . . . . . . . . 8.4 tp-100 -60.15 -41.35 92.56 Favored 'General case' 0 CA--C 1.54 0.564 0 CA-C-O 121.092 0.472 . . . . 73.409999999999997 110.914 176.664 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 61' ' ' ASP . . . . . . . . . . . . . 26.9 t70 -59.86 -49.4 77.87 Favored 'General case' 0 CA--C 1.543 0.704 0 CA-C-N 115.895 -0.593 . . . . 65.439999999999998 111.959 179.863 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 62' ' ' GLN . . . . . . . . . . . . . 10.8 pt20 . . . . . 0 CA--C 1.542 0.64 0 N-CA-C 112.681 0.623 . . . . 65.200000000000003 112.681 -176.573 . . . . . . . . 0 0 . 1 . 017 nuclear orig core ' A' A ' 22' ' ' LEU . . . . . 0.477 ' HB3' HD11 ' A' ' 26' ' ' LEU . 59.0 mt . . . . . 0 N--CA 1.469 0.486 0 CA-C-O 120.685 0.279 . . . . 73.450000000000003 111.714 . . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 23' ' ' PRO . . . . . 0.47 ' O ' ' HG ' ' A' ' 26' ' ' LEU . 53.6 Cg_exo -54.74 143.3 70.71 Favored 'Trans proline' 0 CA--C 1.541 0.833 0 C-N-CA 122.68 2.253 . . . . 74.230000000000004 112.523 173.899 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -72.02 -23.47 61.4 Favored 'General case' 0 CA--C 1.538 0.51 0 N-CA-C 112.36 0.504 . . . . 73.530000000000001 112.36 -177.547 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 25' ' ' ASN . . . . . 0.547 ' HB3' ' HB3' ' A' ' 28' ' ' ASP . 47.8 m-80 -102.13 27.13 6.91 Favored 'General case' 0 CA--C 1.543 0.702 0 N-CA-C 113.063 0.764 . . . . 75.150000000000006 113.063 -175.964 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 26' ' ' LEU . . . . . 0.477 HD11 ' HB3' ' A' ' 22' ' ' LEU . 71.5 mt -49.83 -42.37 47.13 Favored 'General case' 0 N--CA 1.479 1.017 0 CA-C-O 120.976 0.417 . . . . 73.319999999999993 111.973 177.738 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 3.7 m-20 -66.81 -35.11 79.31 Favored 'General case' 0 CA--C 1.543 0.676 0 CA-C-O 121.13 0.49 . . . . 75.219999999999999 111.286 178.402 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 28' ' ' ASP . . . . . 0.547 ' HB3' ' HB3' ' A' ' 25' ' ' ASN . 21.5 t70 -73.07 -31.49 64.42 Favored 'General case' 0 CA--C 1.542 0.649 0 CA-C-N 116.18 -0.464 . . . . 64.230000000000004 111.239 -179.732 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 29' ' ' MET . . . . . 0.459 ' HG3' ' O ' ' A' ' 25' ' ' ASN . 86.9 mtp -63.84 156.31 27.85 Favored 'General case' 0 CA--C 1.541 0.604 0 CA-C-O 121.434 0.635 . . . . 61.409999999999997 112.288 -177.531 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 30' ' ' LYS . . . . . 0.451 ' HB2' ' HG3' ' A' ' 33' ' ' GLU . 55.3 mtpt -80.82 157.78 25.62 Favored 'General case' 0 CA--C 1.538 0.515 0 CA-C-N 116.012 -0.54 . . . . 74.140000000000001 111.836 -178.643 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 31' ' ' VAL . . . . . 0.549 HG23 ' HB2' ' A' ' 49' ' ' LYS . 16.0 t -52.14 -50.77 34.61 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.614 0 CA-C-N 115.961 -0.563 . . . . 74.140000000000001 112.188 -176.61 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -64.1 -27.69 69.26 Favored 'General case' 0 CA--C 1.539 0.546 0 N-CA-C 112.435 0.532 . . . . 75.420000000000002 112.435 -179.714 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 33' ' ' GLU . . . . . 0.451 ' HG3' ' HB2' ' A' ' 30' ' ' LYS . 40.6 mt-10 -72.92 -42.36 63.6 Favored 'General case' 0 N--CA 1.469 0.51 0 CA-C-O 120.899 0.381 . . . . 74.439999999999998 110.809 179.248 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 84.8 mt -59.94 -35.22 74.46 Favored 'General case' 0 N--CA 1.469 0.522 0 CA-C-O 121.308 0.575 . . . . 70.209999999999994 110.805 174.898 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 35' ' ' LYS . . . . . 0.496 ' HE3' HG11 ' A' ' 31' ' ' VAL . 99.3 mttt -64.89 -30.14 71.12 Favored 'General case' 0 CA--C 1.537 0.473 0 CA-C-N 115.998 -0.546 . . . . 74.409999999999997 111.668 176.262 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 57.2 tp60 -66.73 -44.15 82.32 Favored 'General case' 0 CA--C 1.539 0.545 0 CA-C-O 120.934 0.397 . . . . 72.400000000000006 110.402 173.954 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 14.1 mm-40 -54.8 -51.9 64.34 Favored 'General case' 0 N--CA 1.471 0.575 0 CA-C-O 121.425 0.631 . . . . 65.310000000000002 110.895 173.887 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 38' ' ' LEU . . . . . 0.433 ' CD1' HD22 ' A' ' 52' ' ' LEU . 90.6 mt -58.74 -53.46 58.08 Favored 'General case' 0 CA--C 1.541 0.628 0 N-CA-C 113.207 0.817 . . . . 73.329999999999998 113.207 -176.773 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 18.2 ptpt -59.09 -33.67 71.1 Favored 'General case' 0 N--CA 1.474 0.768 0 N-CA-C 112.511 0.559 . . . . 72.109999999999999 112.511 -174.462 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 97.4 mt -67.8 -10.83 56.16 Favored 'General case' 0 N--CA 1.471 0.603 0 CA-C-O 121.072 0.463 . . . . 75.219999999999999 111.532 178.264 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 41' ' ' ARG . . . . . . . . . . . . . 33.8 mtt180 -123.1 15.77 9.91 Favored 'General case' 0 CA--C 1.54 0.564 0 CA-C-N 116.182 -0.463 . . . . 75.540000000000006 111.121 -177.058 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 69.8 m 60.85 31.56 20.04 Favored 'General case' 0 N--CA 1.476 0.862 0 CA-C-N 116.192 -0.458 . . . . 63.030000000000001 111.868 -179.224 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 83.7 mt -98.6 137.2 20.61 Favored Pre-proline 0 CA--C 1.543 0.676 0 CA-C-N 116.488 -0.324 . . . . 74.420000000000002 111.378 179.443 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 44' ' ' PRO . . . . . . . . . . . . . 32.0 Cg_endo -64.06 130.12 26.42 Favored 'Trans proline' 0 CA--C 1.543 0.971 0 C-N-CA 122.941 2.427 . . . . 72.409999999999997 113.122 -178.746 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 23.0 m -102.34 15.04 5.69 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.725 0 CA-C-N 115.953 -0.567 . . . . 72.409999999999997 112.027 -176.154 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 29.6 t -68.47 -43.12 77.68 Favored 'General case' 0 N--CA 1.474 0.733 0 N-CA-C 113.479 0.918 . . . . 73.510000000000005 113.479 -174.053 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . -71.52 179.97 32.41 Favored Glycine 0 CA--C 1.528 0.903 0 N-CA-C 115.393 0.917 . . . . 43.140000000000001 115.393 -170.898 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 48' ' ' THR . . . . . 0.563 ' O ' ' HG ' ' A' ' 52' ' ' LEU . 69.4 p -77.05 170.6 16.24 Favored 'General case' 0 N--CA 1.471 0.582 0 C-N-CA 122.86 0.464 . . . . 74.430000000000007 111.647 178.365 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 49' ' ' LYS . . . . . 0.549 ' HB2' HG23 ' A' ' 31' ' ' VAL . 88.2 tttt -50.53 -51.82 44.25 Favored 'General case' 0 N--CA 1.47 0.563 0 N-CA-C 112.41 0.522 . . . . 75.430000000000007 112.41 -176.794 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 50' ' ' THR . . . . . . . . . . . . . 91.5 m -54.9 -44.77 74.43 Favored 'General case' 0 N--CA 1.471 0.6 0 CA-C-O 120.79 0.329 . . . . 71.129999999999995 111.141 178.157 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 49.3 mt-10 -59.38 -42.25 91.25 Favored 'General case' 0 N--CA 1.47 0.554 0 CA-C-O 120.973 0.416 . . . . 74.510000000000005 111.319 177.066 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 52' ' ' LEU . . . . . 0.563 ' HG ' ' O ' ' A' ' 48' ' ' THR . 32.9 mt -65.38 -47.04 77.73 Favored 'General case' 0 CA--C 1.539 0.545 0 CA-C-N 116.312 -0.404 . . . . 65.530000000000001 111.141 -179.655 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 53' ' ' ILE . . . . . . . . . . . . . 66.9 mt -58.14 -50.46 78.16 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.545 0 CA-C-O 120.84 0.352 . . . . 74.150000000000006 111.117 178.235 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 47.3 mt-10 -58.35 -41.81 85.52 Favored 'General case' 0 CA--C 1.536 0.413 0 CA-C-N 116.347 -0.388 . . . . 73.329999999999998 111.181 177.702 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 41.7 ttm180 -63.3 -40.19 96.67 Favored 'General case' 0 CA--C 1.543 0.703 0 CA-C-N 116.586 -0.279 . . . . 64.439999999999998 111.471 178.592 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 78.9 mt -62.13 -51.27 68.54 Favored 'General case' 0 N--CA 1.47 0.544 0 CA-C-O 121.098 0.475 . . . . 73.340000000000003 111.366 175.113 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 55.1 mtt180 -74.4 -18.42 60.66 Favored 'General case' 0 CA--C 1.542 0.639 0 CA-C-N 116.268 -0.424 . . . . 70.239999999999995 111.999 -178.267 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -76.03 -42.68 47.12 Favored 'General case' 0 N--CA 1.468 0.464 0 CA-C-O 121.162 0.505 . . . . 74.340000000000003 110.333 170.596 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 59' ' ' TYR . . . . . . . . . . . . . 48.6 t80 -62.91 -27.35 69.31 Favored 'General case' 0 CA--C 1.54 0.577 0 CA-C-N 115.932 -0.576 . . . . 72.120000000000005 110.452 175.32 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 60' ' ' GLN . . . . . 0.471 ' HB2' HD12 ' A' ' 22' ' ' LEU . 8.4 tp-100 -76.45 -40.43 50.53 Favored 'General case' 0 CA--C 1.542 0.635 0 CA-C-N 115.919 -0.582 . . . . 74.019999999999996 111.664 177.009 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 61' ' ' ASP . . . . . . . . . . . . . 26.8 t70 -56.44 -26.66 54.38 Favored 'General case' 0 CA--C 1.547 0.837 0 N-CA-C 112.211 0.448 . . . . 64.140000000000001 112.211 -176.888 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 62' ' ' GLN . . . . . . . . . . . . . 14.1 pt20 . . . . . 0 CA--C 1.546 0.797 0 N-CA-C 112.345 0.498 . . . . 74.219999999999999 112.345 -178.791 . . . . . . . . 0 0 . 1 . 018 nuclear orig core ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 92.1 mt . . . . . 0 CA--C 1.541 0.602 0 CA-C-O 120.498 0.19 . . . . 75.239999999999995 110.989 . . . . . . . . . 0 0 . 1 . 018 nuclear orig core ' A' A ' 23' ' ' PRO . . . . . . . . . . . . . 19.2 Cg_endo -59.21 142.24 98.96 Favored 'Trans proline' 0 CA--C 1.54 0.82 0 C-N-CA 122.692 2.261 . . . . 70.019999999999996 112.931 -179.818 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -75.26 -24.41 57.61 Favored 'General case' 0 N--CA 1.469 0.49 0 CA-C-O 120.861 0.363 . . . . 54.200000000000003 111.833 -179.853 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 85.5 m-20 -86.49 36.67 0.71 Allowed 'General case' 0 CA--C 1.544 0.715 0 N-CA-C 112.873 0.694 . . . . 63.420000000000002 112.873 -175.705 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 26' ' ' LEU . . . . . 0.527 HD22 ' SD ' ' A' ' 29' ' ' MET . 87.5 mt -55.74 -29.28 59.29 Favored 'General case' 0 N--CA 1.475 0.795 0 CA-C-O 121.111 0.482 . . . . 65.219999999999999 110.856 175.433 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 3.6 m-20 -64.47 -35.33 80.58 Favored 'General case' 0 CA--C 1.541 0.627 0 CA-C-N 116.073 -0.512 . . . . 65.049999999999997 111.343 176.019 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 31.3 m-20 -81.71 -22.28 37.48 Favored 'General case' 0 CA--C 1.537 0.467 0 CA-C-O 121.062 0.458 . . . . 65.310000000000002 111.306 177.452 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 29' ' ' MET . . . . . 0.527 ' SD ' HD22 ' A' ' 26' ' ' LEU . 85.1 mtp -72.47 124.42 25.15 Favored 'General case' 0 CA--C 1.536 0.436 0 CA-C-O 120.958 0.409 . . . . 75.420000000000002 110.512 175.104 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 61.1 mtpt -72.42 170.53 14.08 Favored 'General case' 0 CA--C 1.537 0.459 0 CA-C-O 120.988 0.423 . . . . 72.219999999999999 111.807 -177.04 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 45.8 t -53.19 -46.76 56.41 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.659 0 CA-C-N 116.039 -0.528 . . . . 72.040000000000006 111.8 -175.475 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -61.45 -40.55 94.89 Favored 'General case' 0 N--CA 1.469 0.507 0 N-CA-C 112.064 0.394 . . . . 72.310000000000002 112.064 179.441 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 39.7 mt-10 -64.28 -46.39 83.87 Favored 'General case' 0 CA--C 1.537 0.471 0 CA-C-O 120.991 0.424 . . . . 73.319999999999993 111.117 179.42 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 92.9 mt -63.81 -49.17 73.93 Favored 'General case' 0 N--CA 1.47 0.53 0 CA-C-N 116.159 -0.473 . . . . 74.540000000000006 111.646 178.18 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 35' ' ' LYS . . . . . 0.425 ' HG2' ' HB ' ' A' ' 45' ' ' VAL . 56.1 mtpt -52.83 -45.18 67.18 Favored 'General case' 0 N--CA 1.473 0.678 0 CA-C-O 121.203 0.525 . . . . 75.099999999999994 111.149 175.252 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 36' ' ' GLN . . . . . 0.538 ' O ' ' HG ' ' A' ' 40' ' ' LEU . 1.0 OUTLIER -57.75 -49.6 76.02 Favored 'General case' 0 CA--C 1.541 0.632 0 CA-C-N 115.761 -0.654 . . . . 65.349999999999994 110.673 177.553 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 37' ' ' GLU . . . . . 0.464 ' HG3' ' HE1' ' A' ' 29' ' ' MET . 55.8 mm-40 -62.47 -35.14 78.39 Favored 'General case' 0 N--CA 1.471 0.578 0 N-CA-C 112.183 0.438 . . . . 73.049999999999997 112.183 178.743 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 38' ' ' LEU . . . . . 0.468 ' HB2' HG12 ' A' ' 45' ' ' VAL . 91.9 mt -66.53 -54.6 21.97 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-O 120.929 0.395 . . . . 74.040000000000006 111.591 177.88 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 17.6 ptmt -63.87 -24.2 67.65 Favored 'General case' 0 CA--C 1.541 0.616 0 N-CA-C 112.337 0.495 . . . . 75.010000000000005 112.337 -174.229 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 40' ' ' LEU . . . . . 0.538 ' HG ' ' O ' ' A' ' 36' ' ' GLN . 78.6 mt -58.03 -38.52 76.39 Favored 'General case' 0 N--CA 1.472 0.661 0 CA-C-O 121.421 0.629 . . . . 75.109999999999999 111.017 172.804 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 41' ' ' ARG . . . . . 0.414 ' NH2' ' HB3' ' A' ' 37' ' ' GLU . 41.6 mtm-85 -108.72 25.27 11.94 Favored 'General case' 0 CA--C 1.539 0.54 0 CA-C-N 115.514 -0.766 . . . . 74.25 111.724 -175.831 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 48.7 m 64.88 15.77 10.1 Favored 'General case' 0 N--CA 1.48 1.045 0 N-CA-C 112.877 0.695 . . . . 53.409999999999997 112.877 175.619 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 75.4 mt -79.57 140.52 55.55 Favored Pre-proline 0 CA--C 1.54 0.579 0 C-N-CA 122.029 0.132 . . . . 74.299999999999997 111.221 178.998 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 44' ' ' PRO . . . . . 0.462 ' HD2' ' HD3' ' A' ' 55' ' ' ARG . 41.4 Cg_endo -66.0 126.1 15.28 Favored 'Trans proline' 0 CA--C 1.538 0.717 0 C-N-CA 122.227 1.951 . . . . 73.200000000000003 112.452 -178.829 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 45' ' ' VAL . . . . . 0.468 HG12 ' HB2' ' A' ' 38' ' ' LEU . 21.5 m -94.04 -8.23 9.92 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.476 0 CA-C-O 121.103 0.478 . . . . 73.109999999999999 111.767 -177.352 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 38.6 m -76.7 74.85 3.37 Favored 'General case' 0 N--CA 1.47 0.534 0 CA-C-O 121.119 0.485 . . . . 72.420000000000002 111.938 -177.615 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . -166.89 177.2 41.71 Favored Glycine 0 CA--C 1.524 0.62 0 C-N-CA 121.298 -0.477 . . . . 71.540000000000006 112.909 176.2 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 48' ' ' THR . . . . . 0.541 ' O ' ' HG ' ' A' ' 52' ' ' LEU . 31.1 p -72.04 159.06 34.83 Favored 'General case' 0 N--CA 1.471 0.614 0 O-C-N 122.535 -0.391 . . . . 73.519999999999996 110.957 179.178 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 49' ' ' LYS . . . . . 0.406 ' HE3' ' O ' ' A' ' 29' ' ' MET . 87.4 tttt -48.84 -35.98 15.82 Favored 'General case' 0 N--CA 1.471 0.585 0 CA-C-O 121.174 0.511 . . . . 73.200000000000003 110.897 176.481 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 50' ' ' THR . . . . . 0.43 ' O ' ' HG3' ' A' ' 54' ' ' GLU . 10.1 m -58.24 -53.87 53.36 Favored 'General case' 0 N--CA 1.467 0.399 0 CA-C-N 115.726 -0.67 . . . . 74.150000000000006 110.979 176.367 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 41.1 mt-10 -58.16 -40.38 81.25 Favored 'General case' 0 N--CA 1.468 0.467 0 CA-C-N 116.076 -0.511 . . . . 72.310000000000002 111.66 178.526 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 52' ' ' LEU . . . . . 0.541 ' HG ' ' O ' ' A' ' 48' ' ' THR . 22.4 mt -60.68 -43.49 97.66 Favored 'General case' 0 CA--C 1.542 0.638 0 CA-C-O 121.155 0.502 . . . . 75.409999999999997 111.123 -179.843 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 53' ' ' ILE . . . . . . . . . . . . . 78.7 mt -65.5 -52.03 56.25 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.686 0 CA-C-N 116.162 -0.472 . . . . 72.040000000000006 111.36 177.065 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 54' ' ' GLU . . . . . 0.43 ' HG3' ' O ' ' A' ' 50' ' ' THR . 45.5 mt-10 -55.88 -42.54 76.09 Favored 'General case' 0 N--CA 1.471 0.622 0 CA-C-O 121.204 0.526 . . . . 65.310000000000002 111.068 178.966 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 55' ' ' ARG . . . . . 0.462 ' HD3' ' HD2' ' A' ' 44' ' ' PRO . 30.0 ttm180 -65.22 -43.89 90.02 Favored 'General case' 0 CA--C 1.539 0.55 0 CA-C-N 115.681 -0.69 . . . . 75.420000000000002 112.187 -177.171 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 51.1 mt -62.35 -47.28 84.91 Favored 'General case' 0 CA--C 1.54 0.561 0 O-C-N 122.249 -0.282 . . . . 75.340000000000003 111.288 175.881 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 98.3 mtt180 -57.92 -51.46 69.52 Favored 'General case' 0 N--CA 1.471 0.577 0 CA-C-O 120.971 0.415 . . . . 75.239999999999995 111.139 176.788 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -61.36 -37.87 84.92 Favored 'General case' 0 N--CA 1.47 0.563 0 CA-C-N 116.143 -0.48 . . . . 70.040000000000006 112.276 -178.854 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 59' ' ' TYR . . . . . . . . . . . . . 69.7 t80 -68.98 -44.34 73.08 Favored 'General case' 0 CA--C 1.538 0.507 0 CA-C-O 120.765 0.317 . . . . 75.349999999999994 111.523 179.069 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 60' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -65.62 -41.92 92.13 Favored 'General case' 0 CA--C 1.542 0.655 0 CA-C-O 121.596 0.712 . . . . 74.109999999999999 109.993 177.403 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 61' ' ' ASP . . . . . . . . . . . . . 21.6 t70 -60.16 -29.91 68.97 Favored 'General case' 0 CA--C 1.543 0.684 0 CA-C-N 115.486 -0.779 . . . . 75.340000000000003 112.189 -178.762 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 62' ' ' GLN . . . . . . . . . . . . . 10.9 pt20 . . . . . 0 N--CA 1.473 0.723 0 N-CA-C 112.468 0.544 . . . . 65.450000000000003 112.468 -178.33 . . . . . . . . 0 0 . 1 . 019 nuclear orig core ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 86.9 mt . . . . . 0 CA--C 1.536 0.411 0 CA-C-O 120.38 0.133 . . . . 73.329999999999998 110.957 . . . . . . . . . 0 0 . 1 . 019 nuclear orig core ' A' A ' 23' ' ' PRO . . . . . 0.584 ' O ' ' HG ' ' A' ' 26' ' ' LEU . 28.0 Cg_exo -62.03 147.19 95.61 Favored 'Trans proline' 0 CA--C 1.537 0.67 0 C-N-CA 122.213 1.942 . . . . 74.239999999999995 112.109 176.448 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -67.18 -20.16 65.68 Favored 'General case' 0 CA--C 1.538 0.511 0 CA-C-O 121.166 0.507 . . . . 75.549999999999997 111.33 177.563 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 25' ' ' ASN . . . . . 0.443 ' O ' ' HG3' ' A' ' 29' ' ' MET . 8.1 m120 -89.33 23.3 2.57 Favored 'General case' 0 CA--C 1.547 0.85 0 N-CA-C 112.694 0.628 . . . . 74.200000000000003 112.694 -174.875 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 26' ' ' LEU . . . . . 0.584 ' HG ' ' O ' ' A' ' 23' ' ' PRO . 67.7 mt -48.04 -56.61 7.31 Favored 'General case' 0 N--CA 1.478 0.952 0 N-CA-C 112.851 0.686 . . . . 74.129999999999995 112.851 -177.151 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 8.2 p-10 -77.48 -7.91 56.95 Favored 'General case' 0 CA--C 1.541 0.614 0 N-CA-C 112.294 0.479 . . . . 72.109999999999999 112.294 -176.226 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 16.4 m-20 -90.85 -26.87 19.17 Favored 'General case' 0 CA--C 1.542 0.637 0 N-CA-C 111.75 0.278 . . . . 75.030000000000001 111.75 177.604 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 29' ' ' MET . . . . . 0.539 ' HE1' ' HA ' ' A' ' 26' ' ' LEU . 59.1 mtm -70.65 169.26 14.73 Favored 'General case' 0 N--CA 1.472 0.659 0 CA-C-O 121.366 0.603 . . . . 75.030000000000001 112.194 -178.558 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 30' ' ' LYS . . . . . 0.438 ' HB2' ' HG2' ' A' ' 33' ' ' GLU . 52.1 mtpt -76.98 157.66 31.1 Favored 'General case' 0 CA--C 1.536 0.427 0 CA-C-N 115.99 -0.55 . . . . 74.409999999999997 111.441 177.118 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 87.9 t -57.58 -40.17 73.59 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.5 0 CA-C-O 121.024 0.44 . . . . 65.010000000000005 110.643 175.451 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -59.51 -36.19 75.61 Favored 'General case' 0 CA--C 1.539 0.542 0 CA-C-N 116.135 -0.484 . . . . 75.430000000000007 111.775 177.04 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 33' ' ' GLU . . . . . 0.438 ' HG2' ' HB2' ' A' ' 30' ' ' LYS . 16.8 mm-40 -70.72 -40.99 72.47 Favored 'General case' 0 N--CA 1.47 0.536 0 CA-C-O 120.995 0.426 . . . . 63.009999999999998 110.73 178.309 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 34' ' ' LEU . . . . . 0.412 HD13 ' HB2' ' A' ' 52' ' ' LEU . 94.9 mt -59.07 -47.19 86.15 Favored 'General case' 0 CA--C 1.538 0.499 0 CA-C-O 121.021 0.439 . . . . 74.439999999999998 110.578 174.471 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 35' ' ' LYS . . . . . 0.548 ' HA ' HD13 ' A' ' 38' ' ' LEU . 95.5 mttt -59.72 -33.76 72.04 Favored 'General case' 0 N--CA 1.47 0.545 0 CA-C-N 116.295 -0.411 . . . . 74.129999999999995 111.469 176.253 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 36' ' ' GLN . . . . . 0.406 ' O ' ' HG ' ' A' ' 40' ' ' LEU . 22.8 tm0? -60.93 -47.99 83.85 Favored 'General case' 0 CA--C 1.537 0.448 0 CA-C-N 116.385 -0.37 . . . . 73.319999999999993 110.936 178.261 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 37' ' ' GLU . . . . . 0.462 ' HB3' ' NH2' ' A' ' 41' ' ' ARG . 29.5 mt-10 -67.86 -39.39 83.78 Favored 'General case' 0 CA--C 1.54 0.576 0 CA-C-O 120.824 0.345 . . . . 75.209999999999994 111.904 176.616 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 38' ' ' LEU . . . . . 0.548 HD13 ' HA ' ' A' ' 35' ' ' LYS . 83.9 mt -57.42 -55.42 34.99 Favored 'General case' 0 N--CA 1.471 0.606 0 N-CA-C 111.921 0.341 . . . . 75.010000000000005 111.921 179.189 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 17.7 ptpt -57.35 -30.6 64.97 Favored 'General case' 0 CA--C 1.542 0.645 0 N-CA-C 112.251 0.463 . . . . 75.129999999999995 112.251 -176.72 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 40' ' ' LEU . . . . . 0.406 ' HG ' ' O ' ' A' ' 36' ' ' GLN . 89.3 mt -68.2 -38.98 82.55 Favored 'General case' 0 N--CA 1.469 0.524 0 CA-C-O 120.926 0.393 . . . . 75.439999999999998 111.389 177.29 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 41' ' ' ARG . . . . . 0.665 HH21 HD23 ' A' ' 56' ' ' LEU . 0.0 OUTLIER -100.32 22.2 11.93 Favored 'General case' 0 CA--C 1.543 0.696 0 N-CA-C 112.055 0.391 . . . . 74.340000000000003 112.055 -179.211 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 44.1 t 62.32 27.96 16.67 Favored 'General case' 0 N--CA 1.481 1.087 0 N-CA-C 112.462 0.542 . . . . 74.430000000000007 112.462 174.619 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 70.6 mt -93.37 143.41 26.64 Favored Pre-proline 0 CA--C 1.543 0.705 0 CA-C-N 116.385 -0.371 . . . . 75.219999999999999 111.915 -179.312 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 44' ' ' PRO . . . . . 0.499 ' HD2' ' HD3' ' A' ' 55' ' ' ARG . 41.4 Cg_exo -57.07 119.54 6.86 Favored 'Trans proline' 0 CA--C 1.542 0.901 0 C-N-CA 122.743 2.295 . . . . 62.109999999999999 112.954 177.51 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 45' ' ' VAL . . . . . 0.467 ' O ' ' HE2' ' A' ' 35' ' ' LYS . 35.6 m -86.17 -16.73 9.59 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.675 0 N-CA-C 112.574 0.583 . . . . 64.310000000000002 112.574 -178.802 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 52.0 m -77.24 36.01 0.18 Allowed 'General case' 0 N--CA 1.478 0.952 0 N-CA-C 113.628 0.973 . . . . 73.040000000000006 113.628 -173.498 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . -112.15 176.34 17.88 Favored Glycine 0 CA--C 1.528 0.89 0 C-N-CA 120.892 -0.67 . . . . 73.5 112.912 177.71 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 48' ' ' THR . . . . . 0.565 ' O ' ' HG ' ' A' ' 52' ' ' LEU . 59.3 p -82.6 169.74 15.95 Favored 'General case' 0 N--CA 1.473 0.719 0 O-C-N 122.462 -0.434 . . . . 74.230000000000004 111.727 178.039 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 49' ' ' LYS . . . . . 0.436 ' O ' HG13 ' A' ' 53' ' ' ILE . 24.0 tptm -44.21 -59.64 2.27 Favored 'General case' 0 N--CA 1.473 0.713 0 C-N-CA 122.994 0.518 . . . . 70.420000000000002 112.227 -179.583 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 50' ' ' THR . . . . . 0.515 ' HA ' HD12 ' A' ' 53' ' ' ILE . 86.6 m -65.73 -38.19 88.46 Favored 'General case' 0 CA--C 1.541 0.598 0 N-CA-C 112.328 0.492 . . . . 71.329999999999998 112.328 -177.42 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 42.5 mt-10 -58.0 -50.83 72.07 Favored 'General case' 0 N--CA 1.473 0.699 0 CA-C-O 120.82 0.343 . . . . 74.430000000000007 111.533 177.613 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 52' ' ' LEU . . . . . 0.565 ' HG ' ' O ' ' A' ' 48' ' ' THR . 26.1 mt -59.1 -38.08 78.7 Favored 'General case' 0 CA--C 1.538 0.504 0 CA-C-N 116.435 -0.348 . . . . 75.310000000000002 111.441 -177.73 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 53' ' ' ILE . . . . . 0.515 HD12 ' HA ' ' A' ' 50' ' ' THR . 71.8 mt -57.69 -58.08 7.7 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.515 0 CA-C-O 121.093 0.473 . . . . 73.430000000000007 111.11 175.899 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 54' ' ' GLU . . . . . 0.424 ' HG2' HH11 ' A' ' 57' ' ' ARG . 44.4 mt-10 -65.7 -24.53 67.01 Favored 'General case' 0 N--CA 1.469 0.504 0 CA-C-N 116.207 -0.451 . . . . 71.409999999999997 111.864 179.697 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 55' ' ' ARG . . . . . 0.499 ' HD3' ' HD2' ' A' ' 44' ' ' PRO . 38.6 ttm180 -71.77 -44.46 63.98 Favored 'General case' 0 CA--C 1.54 0.57 0 CA-C-O 120.92 0.39 . . . . 70.519999999999996 110.912 177.329 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 56' ' ' LEU . . . . . 0.665 HD23 HH21 ' A' ' 41' ' ' ARG . 85.9 mt -58.96 -46.33 88.32 Favored 'General case' 0 N--CA 1.47 0.557 0 CA-C-O 121.236 0.541 . . . . 74.450000000000003 110.396 171.367 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 57' ' ' ARG . . . . . 0.424 HH11 ' HG2' ' A' ' 54' ' ' GLU . 48.6 mtp180 -59.47 -41.56 90.02 Favored 'General case' 0 CA--C 1.535 0.376 0 CA-C-N 115.499 -0.773 . . . . 72.310000000000002 111.419 177.58 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -59.55 -43.82 93.42 Favored 'General case' 0 CA--C 1.537 0.461 0 CA-C-N 116.472 -0.331 . . . . 54.210000000000001 111.663 179.218 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 59' ' ' TYR . . . . . . . . . . . . . 57.4 t80 -65.42 -48.28 73.33 Favored 'General case' 0 CA--C 1.54 0.56 0 CA-C-O 120.994 0.426 . . . . 64.129999999999995 110.918 178.368 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 60' ' ' GLN . . . . . . . . . . . . . 54.8 tp60 -59.89 -39.44 85.37 Favored 'General case' 0 CA--C 1.539 0.545 0 CA-C-O 121.347 0.594 . . . . 63.119999999999997 110.845 178.395 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 61' ' ' ASP . . . . . . . . . . . . . 24.2 t70 -56.21 -27.63 55.46 Favored 'General case' 0 CA--C 1.542 0.636 0 CA-C-N 115.459 -0.791 . . . . 72.209999999999994 111.821 178.048 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 62' ' ' GLN . . . . . . . . . . . . . 74.0 mt-30 . . . . . 0 CA--C 1.542 0.639 0 N-CA-C 112.41 0.522 . . . . 75.319999999999993 112.41 -177.775 . . . . . . . . 0 0 . 1 . 020 nuclear orig core ' A' A ' 22' ' ' LEU . . . . . 0.526 ' HG ' ' HG3' ' A' ' 60' ' ' GLN . 82.4 mt . . . . . 0 CA--C 1.537 0.464 0 N-CA-C 111.713 0.264 . . . . 63.329999999999998 111.713 . . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 23' ' ' PRO . . . . . 0.527 ' HD2' HD21 ' A' ' 26' ' ' LEU . 52.0 Cg_exo -57.77 150.52 61.92 Favored 'Trans proline' 0 CA--C 1.543 0.968 0 C-N-CA 122.403 2.069 . . . . 73.420000000000002 112.84 171.645 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -83.4 -9.45 59.02 Favored 'General case' 0 CA--C 1.539 0.54 0 N-CA-C 112.203 0.445 . . . . 72.129999999999995 112.203 -178.285 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 25' ' ' ASN . . . . . 0.51 ' HB3' ' HB3' ' A' ' 28' ' ' ASP . 15.4 m120 -112.67 24.98 11.89 Favored 'General case' 0 CA--C 1.541 0.632 0 N-CA-C 112.477 0.547 . . . . 71.439999999999998 112.477 -176.096 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 26' ' ' LEU . . . . . 0.527 HD21 ' HD2' ' A' ' 23' ' ' PRO . 95.1 mt -45.67 -47.29 15.05 Favored 'General case' 0 N--CA 1.48 1.033 0 N-CA-C 112.242 0.46 . . . . 63.5 112.242 -178.67 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 19.7 t70 -71.58 -30.9 66.36 Favored 'General case' 0 CA--C 1.539 0.526 0 CA-C-O 121.0 0.429 . . . . 75.420000000000002 111.533 -179.648 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 28' ' ' ASP . . . . . 0.51 ' HB3' ' HB3' ' A' ' 25' ' ' ASN . 20.9 t70 -78.23 -23.69 47.31 Favored 'General case' 0 CA--C 1.542 0.655 0 CA-C-O 121.193 0.52 . . . . 75.420000000000002 110.927 -179.89 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 29' ' ' MET . . . . . . . . . . . . . 71.5 mtp -73.23 -179.52 3.39 Favored 'General case' 0 CA--C 1.539 0.526 0 CA-C-N 115.823 -0.626 . . . . 72.519999999999996 111.966 -179.805 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 49.8 mtmt -95.76 153.81 17.55 Favored 'General case' 0 CA--C 1.54 0.562 0 CA-C-N 116.242 -0.435 . . . . 73.120000000000005 111.723 -176.654 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 31' ' ' VAL . . . . . 0.405 ' O ' ' HG3' ' A' ' 35' ' ' LYS . 57.7 t -51.55 -47.85 36.43 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.751 0 CA-C-N 116.196 -0.457 . . . . 74.510000000000005 111.924 -179.463 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -54.65 -45.37 73.79 Favored 'General case' 0 N--CA 1.473 0.679 0 CA-C-O 120.807 0.337 . . . . 43.450000000000003 111.752 178.687 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 13.8 mm-40 -53.58 -50.66 65.1 Favored 'General case' 0 N--CA 1.47 0.528 0 CA-C-O 121.193 0.52 . . . . 64.409999999999997 111.294 178.417 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 62.1 mt -62.63 -46.58 87.58 Favored 'General case' 0 CA--C 1.536 0.413 0 CA-C-N 115.497 -0.774 . . . . 71.239999999999995 111.422 -179.896 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 35' ' ' LYS . . . . . 0.405 ' HG3' ' O ' ' A' ' 31' ' ' VAL . 59.2 mtpt -56.22 -38.77 71.49 Favored 'General case' 0 CA--C 1.535 0.384 0 CA-C-N 116.284 -0.416 . . . . 74.0 111.549 179.834 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 16.8 mm100 -64.55 -51.34 63.37 Favored 'General case' 0 CA--C 1.537 0.468 0 CA-C-N 116.546 -0.297 . . . . 62.240000000000002 111.581 178.197 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 45.4 mt-10 -62.64 -20.75 65.11 Favored 'General case' 0 N--CA 1.473 0.71 0 CA-C-O 120.915 0.388 . . . . 75.549999999999997 111.86 179.893 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 38' ' ' LEU . . . . . 0.431 HD13 ' HA ' ' A' ' 52' ' ' LEU . 77.0 mt -76.18 -62.27 1.67 Allowed 'General case' 0 N--CA 1.47 0.527 0 CA-C-O 120.827 0.346 . . . . 72.150000000000006 111.211 170.734 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 14.1 ptmm? -62.41 -33.33 74.56 Favored 'General case' 0 CA--C 1.542 0.641 0 N-CA-C 112.31 0.485 . . . . 75.239999999999995 112.31 -173.861 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 95.2 mt -62.54 -27.28 69.05 Favored 'General case' 0 N--CA 1.473 0.707 0 CA-C-O 120.924 0.392 . . . . 65.239999999999995 111.164 174.765 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 41' ' ' ARG . . . . . 0.665 HH21 HD22 ' A' ' 56' ' ' LEU . 55.8 mtm180 -104.7 19.04 21.16 Favored 'General case' 0 CA--C 1.543 0.698 0 CA-C-N 116.418 -0.355 . . . . 75.5 111.132 179.386 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 25.7 m 68.72 13.26 8.87 Favored 'General case' 0 N--CA 1.479 1.008 0 C-N-CA 123.309 0.643 . . . . 42.439999999999998 112.715 177.154 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 80.6 mt -83.67 136.86 41.72 Favored Pre-proline 0 CA--C 1.54 0.572 0 O-C-N 122.316 -0.24 . . . . 72.409999999999997 111.085 178.33 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 44' ' ' PRO . . . . . . . . . . . . . 72.6 Cg_endo -74.94 126.83 10.26 Favored 'Trans proline' 0 CA--C 1.54 0.811 0 C-N-CA 122.55 2.167 . . . . 73.120000000000005 113.545 -178.621 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 26.1 m -85.48 20.93 0.3 Allowed 'Isoleucine or valine' 0 CA--C 1.544 0.736 0 CA-C-N 116.069 -0.514 . . . . 73.329999999999998 112.114 179.751 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 15.1 m -78.48 62.77 3.17 Favored 'General case' 0 N--CA 1.47 0.573 0 CA-C-O 120.821 0.343 . . . . 64.030000000000001 111.724 -176.308 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . -169.75 -177.34 40.13 Favored Glycine 0 CA--C 1.528 0.855 0 C-N-CA 120.598 -0.811 . . . . 72.209999999999994 113.961 -179.819 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 48' ' ' THR . . . . . 0.525 ' O ' ' HG ' ' A' ' 52' ' ' LEU . 47.6 p -82.25 171.65 14.02 Favored 'General case' 0 N--CA 1.473 0.677 0 C-N-CA 122.491 0.317 . . . . 70.209999999999994 111.38 179.705 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 79.8 tttt -48.0 -46.74 33.18 Favored 'General case' 0 N--CA 1.476 0.826 0 CA-C-O 120.999 0.428 . . . . 70.109999999999999 111.513 177.995 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 50' ' ' THR . . . . . 0.404 ' O ' ' HG3' ' A' ' 54' ' ' GLU . 13.6 m -58.77 -46.69 86.92 Favored 'General case' 0 CA--C 1.535 0.394 0 CA-C-N 116.053 -0.522 . . . . 64.200000000000003 111.229 179.726 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 74.8 mm-40 -59.09 -41.69 88.66 Favored 'General case' 0 N--CA 1.47 0.559 0 CA-C-O 120.915 0.388 . . . . 73.219999999999999 111.401 179.559 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 52' ' ' LEU . . . . . 0.525 ' HG ' ' O ' ' A' ' 48' ' ' THR . 30.1 mt -57.71 -50.39 73.37 Favored 'General case' 0 CA--C 1.538 0.486 0 CA-C-O 121.334 0.588 . . . . 74.420000000000002 110.767 179.371 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 53' ' ' ILE . . . . . . . . . . . . . 67.9 mt -60.46 -53.72 44.94 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.44 0 CA-C-N 115.607 -0.724 . . . . 71.230000000000004 111.541 178.7 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 54' ' ' GLU . . . . . 0.404 ' HG3' ' O ' ' A' ' 50' ' ' THR . 85.6 mt-10 -60.69 -37.91 83.22 Favored 'General case' 0 CA--C 1.537 0.468 0 CA-C-N 115.795 -0.639 . . . . 74.420000000000002 112.123 -177.084 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 55' ' ' ARG . . . . . 0.418 HH11 ' HD2' ' A' ' 55' ' ' ARG . 14.9 ttt180 -73.78 -37.77 64.87 Favored 'General case' 0 CA--C 1.539 0.528 0 O-C-N 122.14 -0.35 . . . . 73.409999999999997 111.21 179.863 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 56' ' ' LEU . . . . . 0.665 HD22 HH21 ' A' ' 41' ' ' ARG . 51.1 mt -53.03 -47.64 68.2 Favored 'General case' 0 N--CA 1.47 0.539 0 CA-C-O 121.028 0.442 . . . . 71.230000000000004 109.951 170.355 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 16.3 mtp180 -64.5 -57.02 10.37 Favored 'General case' 0 CA--C 1.539 0.548 0 CA-C-N 115.452 -0.794 . . . . 72.510000000000005 112.03 179.386 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -52.5 -44.85 65.93 Favored 'General case' 0 N--CA 1.472 0.666 0 CA-C-O 121.02 0.438 . . . . 41.340000000000003 112.074 -178.713 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 59' ' ' TYR . . . . . . . . . . . . . 79.4 t80 -67.28 -41.16 85.93 Favored 'General case' 0 CA--C 1.541 0.606 0 CA-C-N 116.397 -0.365 . . . . 73.420000000000002 111.793 178.952 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 60' ' ' GLN . . . . . 0.526 ' HG3' ' HG ' ' A' ' 22' ' ' LEU . 19.3 tm0? -70.56 -33.97 71.71 Favored 'General case' 0 CA--C 1.54 0.573 0 CA-C-O 121.207 0.527 . . . . 75.010000000000005 110.692 179.958 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 61' ' ' ASP . . . . . . . . . . . . . 24.8 t70 -66.92 -48.21 69.36 Favored 'General case' 0 CA--C 1.541 0.615 0 CA-C-N 115.993 -0.549 . . . . 74.349999999999994 111.801 179.304 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 62' ' ' GLN . . . . . . . . . . . . . 10.9 pt20 . . . . . 0 N--CA 1.474 0.761 0 N-CA-C 111.829 0.307 . . . . 74.010000000000005 111.829 -179.025 . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 90.2 mmm . . . . . 0 N--CA 1.489 1.518 0 CA-C-O 120.57 0.224 . . . . 72.25 110.738 . . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . -152.39 172.02 31.6 Favored Glycine 0 CA--C 1.525 0.691 0 C-N-CA 121.077 -0.582 . . . . 38.100000000000001 113.279 -177.907 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 3' ' ' HIS . . . . . . . . . . . . . 21.4 p-80 -79.41 78.17 5.94 Favored 'General case' 0 CA--C 1.543 0.702 0 CA-C-O 121.244 0.545 . . . . 75.129999999999995 111.765 -177.209 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 4' ' ' HIS . . . . . . . . . . . . . 27.8 p-80 -93.0 101.04 13.37 Favored 'General case' 0 N--CA 1.472 0.639 0 CA-C-O 121.075 0.464 . . . . 73.140000000000001 112.071 -178.366 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 5' ' ' HIS . . . . . . . . . . . . . 16.9 p80 -158.82 144.21 16.33 Favored 'General case' 0 N--CA 1.472 0.633 0 CA-C-N 116.417 -0.356 . . . . 74.019999999999996 110.993 179.821 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 52.9 p-80 -141.03 129.8 22.94 Favored 'General case' 0 N--CA 1.47 0.563 0 N-CA-C 112.521 0.563 . . . . 73.420000000000002 112.521 -176.489 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 58.4 t-80 -176.6 136.11 0.25 Allowed 'General case' 0 N--CA 1.471 0.585 0 CA-C-N 116.202 -0.453 . . . . 73.019999999999996 110.446 176.109 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 8' ' ' HIS . . . . . . . . . . . . . 19.4 t60 -154.78 145.2 22.11 Favored 'General case' 0 CA--C 1.543 0.679 0 O-C-N 122.22 -0.3 . . . . 75.230000000000004 111.338 -177.999 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 93.2 p -149.85 158.65 44.38 Favored 'General case' 0 N--CA 1.478 0.959 0 CA-C-O 120.695 0.283 . . . . 74.25 111.561 178.436 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 17.2 p80 -175.08 151.05 1.26 Allowed 'General case' 0 N--CA 1.475 0.803 0 C-N-CA 122.46 0.304 . . . . 75.329999999999998 110.631 178.365 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 11' ' ' MET . . . . . . . . . . . . . 13.1 tpt -154.03 150.42 28.22 Favored 'General case' 0 N--CA 1.471 0.623 0 CA-C-O 121.036 0.446 . . . . 71.540000000000006 111.782 177.417 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 43.7 p -160.91 113.33 1.93 Allowed 'General case' 0 N--CA 1.471 0.616 0 CA-C-N 116.268 -0.424 . . . . 72.219999999999999 111.283 -178.829 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 13' ' ' THR . . . . . . . . . . . . . 64.6 p -97.32 138.02 21.17 Favored Pre-proline 0 N--CA 1.474 0.765 0 N-CA-C 111.923 0.342 . . . . 71.109999999999999 111.923 -179.065 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 14' ' ' PRO . . . . . . . . . . . . . 35.1 Cg_exo -59.04 121.57 10.16 Favored 'Trans proline' 0 CA--C 1.543 0.964 0 C-N-CA 122.686 2.258 . . . . 75.019999999999996 112.677 175.89 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 84.4 mt -99.85 169.07 9.48 Favored 'General case' 0 N--CA 1.473 0.714 0 CA-C-O 120.949 0.404 . . . . 70.209999999999994 112.045 -176.688 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 16' ' ' THR . . . . . . . . . . . . . 12.0 t -94.4 -170.1 2.19 Favored 'General case' 0 CA--C 1.544 0.715 0 CA-C-N 116.424 -0.353 . . . . 74.049999999999997 111.195 176.717 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . 90.11 88.5 1.31 Allowed Glycine 0 CA--C 1.522 0.496 0 N-CA-C 111.12 -0.792 . . . . 71.109999999999999 111.12 -172.616 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 20.1 ptmt -137.96 144.48 44.03 Favored Pre-proline 0 CA--C 1.538 0.519 0 N-CA-C 112.769 0.655 . . . . 74.420000000000002 112.769 -165.234 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 97.6 Cg_endo -83.96 -158.49 0.09 OUTLIER 'Trans proline' 0 CA--C 1.544 0.993 0 C-N-CA 122.754 2.303 . . . . 70.239999999999995 112.092 170.838 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . 171.28 -97.73 0.12 Allowed Glycine 0 CA--C 1.529 0.918 0 C-N-CA 120.847 -0.692 . . . . 41.039999999999999 113.126 177.598 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -77.08 152.95 34.8 Favored 'General case' 0 N--CA 1.467 0.398 0 CA-C-O 121.187 0.518 . . . . 72.319999999999993 111.826 -179.161 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 83.4 mt -70.05 157.69 89.19 Favored Pre-proline 0 CA--C 1.543 0.692 0 CA-C-N 116.326 -0.397 . . . . 74.120000000000005 111.559 179.62 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 23' ' ' PRO . . . . . 0.486 ' O ' ' HG ' ' A' ' 26' ' ' LEU . 38.7 Cg_exo -61.26 125.3 16.62 Favored 'Trans proline' 0 CA--C 1.541 0.84 0 C-N-CA 122.353 2.035 . . . . 74.519999999999996 112.459 177.364 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -77.73 -2.52 36.61 Favored 'General case' 0 N--CA 1.472 0.629 0 N-CA-C 112.087 0.403 . . . . 72.510000000000005 112.087 -178.122 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 23.0 m120 -101.93 31.37 3.92 Favored 'General case' 0 CA--C 1.54 0.562 0 N-CA-C 112.108 0.411 . . . . 73.150000000000006 112.108 179.94 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 26' ' ' LEU . . . . . 0.486 ' HG ' ' O ' ' A' ' 23' ' ' PRO . 92.5 mt -56.94 -44.29 82.37 Favored 'General case' 0 N--CA 1.471 0.578 0 CA-C-O 120.98 0.419 . . . . 74.340000000000003 111.122 177.307 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 5.4 m-20 -63.14 -31.8 73.03 Favored 'General case' 0 CA--C 1.54 0.579 0 CA-C-N 116.078 -0.51 . . . . 73.299999999999997 111.728 178.046 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 22.3 m-20 -75.59 -23.15 56.46 Favored 'General case' 0 CA--C 1.536 0.431 0 CA-C-N 116.244 -0.435 . . . . 65.010000000000005 112.13 -177.966 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 29' ' ' MET . . . . . . . . . . . . . 65.8 mtm -85.86 179.36 7.04 Favored 'General case' 0 CA--C 1.538 0.482 0 CA-C-O 121.498 0.666 . . . . 72.549999999999997 112.325 -177.278 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 30' ' ' LYS . . . . . 0.561 ' HB2' ' HG2' ' A' ' 33' ' ' GLU . 45.7 mtpt -85.69 158.71 19.99 Favored 'General case' 0 CA--C 1.538 0.493 0 CA-C-N 115.647 -0.706 . . . . 54.109999999999999 111.246 -179.255 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 60.9 t -57.04 -40.98 76.52 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.506 0 CA-C-O 121.055 0.455 . . . . 63.409999999999997 110.76 177.669 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -56.94 -43.98 82.05 Favored 'General case' 0 CA--C 1.538 0.494 0 CA-C-N 115.871 -0.604 . . . . 72.0 111.875 177.759 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 33' ' ' GLU . . . . . 0.561 ' HG2' ' HB2' ' A' ' 30' ' ' LYS . 5.4 mm-40 -60.13 -41.58 92.97 Favored 'General case' 0 N--CA 1.47 0.562 0 CA-C-O 121.112 0.482 . . . . 75.329999999999998 110.649 179.928 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 70.6 mt -62.95 -45.63 91.56 Favored 'General case' 0 N--CA 1.468 0.446 0 CA-C-N 115.952 -0.567 . . . . 75.319999999999993 110.685 176.88 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 28.1 mtpp -60.52 -34.12 73.64 Favored 'General case' 0 CA--C 1.542 0.635 0 CA-C-N 115.974 -0.557 . . . . 73.540000000000006 110.979 176.449 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 56.9 tp60 -64.76 -50.31 67.34 Favored 'General case' 0 CA--C 1.541 0.6 0 CA-C-O 121.024 0.44 . . . . 73.109999999999999 111.057 175.711 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 37' ' ' GLU . . . . . 0.414 ' O ' ' HG3' ' A' ' 41' ' ' ARG . 23.2 mm-40 -58.64 -40.0 82.15 Favored 'General case' 0 CA--C 1.539 0.546 0 CA-C-N 116.293 -0.412 . . . . 75.510000000000005 111.832 177.199 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 38' ' ' LEU . . . . . 0.481 ' HB2' HG13 ' A' ' 45' ' ' VAL . 92.3 mt -64.36 -56.04 17.07 Favored 'General case' 0 CA--C 1.538 0.49 0 N-CA-C 112.089 0.403 . . . . 75.230000000000004 112.089 178.422 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 19.8 ptpt -55.51 -40.88 72.35 Favored 'General case' 0 N--CA 1.473 0.703 0 N-CA-C 112.02 0.378 . . . . 75.519999999999996 112.02 -175.367 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 93.4 mt -66.13 -22.72 66.39 Favored 'General case' 0 N--CA 1.471 0.596 0 CA-C-O 120.883 0.373 . . . . 72.340000000000003 111.85 -179.255 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 41' ' ' ARG . . . . . 0.414 ' HG3' ' O ' ' A' ' 37' ' ' GLU . 75.7 mtt-85 -104.22 18.24 22.49 Favored 'General case' 0 CA--C 1.541 0.61 0 CA-C-O 120.73 0.3 . . . . 75.120000000000005 111.441 -179.676 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 33.1 t 67.0 16.57 10.38 Favored 'General case' 0 N--CA 1.478 0.932 0 C-N-CA 122.949 0.5 . . . . 63.240000000000002 112.315 178.458 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 65.6 mt -90.52 143.38 29.12 Favored Pre-proline 0 CA--C 1.542 0.641 0 N-CA-C 111.947 0.351 . . . . 75.540000000000006 111.947 -178.851 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 44' ' ' PRO . . . . . . . . . . . . . 42.9 Cg_endo -67.89 132.41 26.47 Favored 'Trans proline' 0 CA--C 1.542 0.891 0 C-N-CA 122.622 2.215 . . . . 75.319999999999993 113.008 176.812 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 45' ' ' VAL . . . . . 0.481 HG13 ' HB2' ' A' ' 38' ' ' LEU . 33.6 m -96.49 36.47 0.13 Allowed 'Isoleucine or valine' 0 N--CA 1.471 0.622 0 CA-C-N 116.122 -0.49 . . . . 72.450000000000003 111.806 -177.375 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 17.4 m -80.65 -61.67 1.9 Allowed 'General case' 0 CA--C 1.542 0.657 0 N-CA-C 114.064 1.135 . . . . 74.219999999999999 114.064 -168.777 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . -66.91 -170.82 4.4 Favored Glycine 0 CA--C 1.53 0.976 0 N-CA-C 115.996 1.159 . . . . 64.329999999999998 115.996 -166.944 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 48' ' ' THR . . . . . 0.573 ' O ' ' HG ' ' A' ' 52' ' ' LEU . 62.4 p -74.38 175.5 7.62 Favored 'General case' 0 N--CA 1.471 0.584 0 CA-C-N 115.295 -0.453 . . . . 63.140000000000001 111.749 -178.337 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 49' ' ' LYS . . . . . 0.426 ' O ' HG13 ' A' ' 53' ' ' ILE . 87.8 tttt -49.96 -53.79 24.11 Favored 'General case' 0 CA--C 1.543 0.677 0 N-CA-C 111.847 0.314 . . . . 75.439999999999998 111.847 -178.868 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 50' ' ' THR . . . . . . . . . . . . . 47.8 m -59.24 -43.28 92.39 Favored 'General case' 0 N--CA 1.473 0.705 0 CA-C-O 120.799 0.333 . . . . 71.25 111.595 179.351 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 51' ' ' GLU . . . . . 0.403 ' CD ' HH21 ' A' ' 55' ' ' ARG . 0.7 OUTLIER -53.61 -54.5 36.72 Favored 'General case' 0 CA--C 1.539 0.542 0 CA-C-O 120.941 0.401 . . . . 73.430000000000007 110.512 176.632 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 52' ' ' LEU . . . . . 0.573 ' HG ' ' O ' ' A' ' 48' ' ' THR . 25.7 mt -57.2 -47.62 80.81 Favored 'General case' 0 CA--C 1.54 0.586 0 CA-C-N 116.024 -0.534 . . . . 73.329999999999998 111.199 -179.718 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 53' ' ' ILE . . . . . 0.426 HG13 ' O ' ' A' ' 49' ' ' LYS . 91.2 mt -54.52 -52.73 37.57 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.616 0 CA-C-O 121.304 0.573 . . . . 60.439999999999998 111.678 177.951 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 35.0 mt-10 -70.95 -24.86 62.51 Favored 'General case' 0 CA--C 1.536 0.432 0 N-CA-C 112.164 0.431 . . . . 74.340000000000003 112.164 -178.253 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 55' ' ' ARG . . . . . 0.403 HH21 ' CD ' ' A' ' 51' ' ' GLU . 46.6 ttm-85 -68.52 -36.45 78.88 Favored 'General case' 0 CA--C 1.538 0.502 0 CA-C-O 121.095 0.474 . . . . 73.409999999999997 110.257 175.639 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 89.9 mt -61.4 -44.73 96.65 Favored 'General case' 0 N--CA 1.469 0.495 0 CA-C-N 116.176 -0.466 . . . . 74.420000000000002 110.81 172.556 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 40.3 mtm180 -62.89 -42.42 99.77 Favored 'General case' 0 N--CA 1.471 0.582 0 CA-C-O 121.027 0.442 . . . . 73.519999999999996 111.061 176.751 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 58' ' ' ALA . . . . . 0.401 ' O ' ' HG3' ' A' ' 62' ' ' GLN . . . -61.65 -39.45 91.39 Favored 'General case' 0 N--CA 1.469 0.495 0 CA-C-O 121.113 0.483 . . . . 74.540000000000006 111.482 178.027 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 59' ' ' TYR . . . . . . . . . . . . . 63.2 t80 -62.78 -47.17 84.63 Favored 'General case' 0 CA--C 1.537 0.462 0 CA-C-O 121.094 0.474 . . . . 75.510000000000005 110.806 176.021 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 60' ' ' GLN . . . . . . . . . . . . . 7.5 tp-100 -58.44 -44.62 89.26 Favored 'General case' 0 N--CA 1.468 0.468 0 CA-C-N 116.027 -0.533 . . . . 74.239999999999995 110.941 176.163 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 61' ' ' ASP . . . . . . . . . . . . . 31.9 t70 -59.03 -23.0 61.59 Favored 'General case' 0 CA--C 1.545 0.774 0 CA-C-O 121.208 0.527 . . . . 71.140000000000001 111.699 -178.401 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 62' ' ' GLN . . . . . 0.401 ' HG3' ' O ' ' A' ' 58' ' ' ALA . 48.5 mt-30 -88.87 -52.29 5.18 Favored 'General case' 0 CA--C 1.54 0.592 0 CA-C-N 116.299 -0.409 . . . . 75.129999999999995 111.683 178.675 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 63' ' ' ILE . . . . . . . . . . . . . 36.3 pt -72.58 -21.66 19.99 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.58 0 N-CA-C 112.343 0.497 . . . . 74.310000000000002 112.343 -178.04 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 40.0 t -167.81 91.82 0.67 Allowed Pre-proline 0 CA--C 1.541 0.629 0 CA-C-N 116.338 -0.392 . . . . 74.319999999999993 111.279 -178.573 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 65' ' ' PRO . . . . . . . . . . . . . 94.2 Cg_endo -76.52 32.84 0.41 Allowed 'Trans proline' 0 CA--C 1.543 0.932 0 C-N-CA 122.847 2.365 . . . . 62.210000000000001 113.926 -176.426 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 66' ' ' VAL . . . . . . . . . . . . . 34.0 m -121.2 161.6 39.96 Favored Pre-proline 0 CA--C 1.542 0.644 0 O-C-N 122.321 -0.237 . . . . 74.040000000000006 111.199 -179.035 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 67' ' ' PRO . . . . . . . . . . . . . 16.1 Cg_exo -69.32 30.33 0.17 Allowed 'Trans proline' 0 CA--C 1.547 1.13 0 C-N-CA 123.144 2.563 . . . . 74.129999999999995 114.18 -179.524 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 92.42 77.29 1.36 Allowed Glycine 0 CA--C 1.528 0.856 0 C-N-CA 121.067 -0.587 . . . . 73.209999999999994 112.766 -177.653 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . -157.59 146.41 14.62 Favored Pre-proline 0 CA--C 1.539 0.54 0 O-C-N 122.745 -0.268 . . . . 61.109999999999999 111.304 -178.799 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 70' ' ' PRO . . . . . . . . . . . . . 27.9 Cg_exo -62.2 126.49 18.75 Favored 'Trans proline' 0 CA--C 1.541 0.851 0 C-N-CA 122.449 2.099 . . . . 71.540000000000006 112.262 177.405 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 53.6 mtmt -77.35 30.22 0.15 Allowed 'General case' 0 N--CA 1.474 0.75 0 N-CA-C 112.405 0.52 . . . . 71.510000000000005 112.405 -176.627 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -163.67 145.53 7.46 Favored Pre-proline 0 CA--C 1.539 0.535 0 C-N-CA 122.689 0.395 . . . . 71.549999999999997 110.714 -179.451 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 73' ' ' PRO . . . . . . . . . . . . . 22.2 Cg_exo -64.72 80.41 0.18 Allowed 'Trans proline' 0 CA--C 1.543 0.958 0 C-N-CA 122.421 2.08 . . . . 53.030000000000001 112.61 177.838 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -164.71 -173.37 2.97 Favored 'General case' 0 CA--C 1.537 0.443 0 CA-C-N 116.281 -0.418 . . . . 72.319999999999993 111.312 -178.396 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.253 1.25 0 CA-C-O 118.887 -0.578 . . . . 65.319999999999993 111.938 179.956 . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 62.8 mtt . . . . . 0 N--CA 1.494 1.767 0 CA-C-O 120.925 0.393 . . . . 71.409999999999997 111.529 . . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . -85.49 140.14 17.92 Favored Glycine 0 CA--C 1.525 0.692 0 CA-C-N 116.147 -0.479 . . . . 60.329999999999998 112.578 177.046 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 3' ' ' HIS . . . . . . . . . . . . . 58.8 t-80 -65.38 92.46 0.13 Allowed 'General case' 0 CA--C 1.543 0.695 0 CA-C-O 120.896 0.379 . . . . 71.409999999999997 111.804 -178.061 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 4' ' ' HIS . . . . . . . . . . . . . 39.7 p-80 -117.9 131.82 56.48 Favored 'General case' 0 N--CA 1.473 0.689 0 CA-C-O 120.919 0.39 . . . . 63.229999999999997 111.409 -179.884 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 5' ' ' HIS . . . . . . . . . . . . . 36.1 t-80 -107.94 144.71 34.83 Favored 'General case' 0 CA--C 1.539 0.524 0 CA-C-O 120.891 0.377 . . . . 43.299999999999997 111.711 -176.869 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 13.7 p80 -134.44 137.5 44.04 Favored 'General case' 0 CA--C 1.539 0.55 0 CA-C-O 120.883 0.373 . . . . 74.530000000000001 110.759 175.582 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 22.9 p80 -66.48 122.72 18.19 Favored 'General case' 0 CA--C 1.542 0.651 0 CA-C-O 121.027 0.441 . . . . 73.349999999999994 112.14 -176.653 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 8' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -84.04 154.3 23.33 Favored 'General case' 0 N--CA 1.47 0.553 0 CA-C-N 116.52 -0.309 . . . . 73.420000000000002 111.317 176.302 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 35.1 t -81.17 141.71 33.95 Favored 'General case' 0 N--CA 1.47 0.556 0 CA-C-O 121.109 0.481 . . . . 73.140000000000001 112.061 -178.414 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 23.4 t-80 -79.11 103.31 8.97 Favored 'General case' 0 CA--C 1.541 0.617 0 CA-C-N 116.142 -0.481 . . . . 73.140000000000001 111.075 177.835 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 11' ' ' MET . . . . . . . . . . . . . 62.8 mtt -115.57 96.27 5.55 Favored 'General case' 0 CA--C 1.54 0.585 0 CA-C-O 121.231 0.539 . . . . 71.230000000000004 112.375 -177.449 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 44.9 p -108.88 83.49 1.77 Allowed 'General case' 0 N--CA 1.469 0.488 0 CA-C-O 121.242 0.544 . . . . 64.239999999999995 110.176 174.432 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 13' ' ' THR . . . . . . . . . . . . . 69.3 p -99.26 155.01 37.02 Favored Pre-proline 0 N--CA 1.472 0.664 0 CA-C-N 116.062 -0.517 . . . . 74.310000000000002 112.328 -173.677 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 14' ' ' PRO . . . . . . . . . . . . . 28.2 Cg_endo -62.4 116.18 3.34 Favored 'Trans proline' 0 C--N 1.354 0.861 0 C-N-CA 122.52 2.147 . . . . 74.150000000000006 111.815 174.887 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 87.9 mt -85.62 134.54 33.99 Favored 'General case' 0 CA--C 1.536 0.42 0 CA-C-O 121.317 0.579 . . . . 65.299999999999997 112.375 -173.749 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 16' ' ' THR . . . . . . . . . . . . . 65.4 p -105.64 146.77 29.27 Favored 'General case' 0 N--CA 1.472 0.667 0 CA-C-N 115.721 -0.672 . . . . 64.310000000000002 111.195 178.046 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . -135.54 178.09 18.92 Favored Glycine 0 CA--C 1.53 1.005 0 C-N-CA 121.172 -0.537 . . . . 51.350000000000001 113.446 -179.257 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 75.6 mmtt -74.54 119.84 78.56 Favored Pre-proline 0 CA--C 1.546 0.822 0 N-CA-C 111.958 0.355 . . . . 75.109999999999999 111.958 179.484 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 91.1 Cg_endo -83.28 129.01 5.04 Favored 'Trans proline' 0 CA--C 1.545 1.061 0 C-N-CA 122.744 2.296 . . . . 63.109999999999999 113.127 177.946 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . -77.59 70.56 2.44 Favored Glycine 0 CA--C 1.529 0.967 0 C-N-CA 121.146 -0.55 . . . . 70.049999999999997 113.131 179.589 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -142.84 167.07 22.95 Favored 'General case' 0 CA--C 1.541 0.6 0 CA-C-O 120.933 0.397 . . . . 74.030000000000001 111.711 -178.889 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 22' ' ' LEU . . . . . 0.565 ' HG ' ' HG3' ' A' ' 60' ' ' GLN . 97.0 mt -115.4 155.64 46.82 Favored Pre-proline 0 N--CA 1.473 0.72 0 N-CA-C 112.331 0.493 . . . . 72.200000000000003 112.331 -178.229 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 23' ' ' PRO . . . . . . . . . . . . . 5.3 Cg_endo -85.97 149.14 9.51 Favored 'Trans proline' 0 CA--C 1.542 0.88 0 C-N-CA 123.133 2.555 . . . . 74.209999999999994 111.764 171.987 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -74.96 -10.33 59.38 Favored 'General case' 0 N--CA 1.471 0.59 0 N-CA-C 112.108 0.41 . . . . 73.099999999999994 112.108 -179.081 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 14.1 m120 -84.97 28.75 0.68 Allowed 'General case' 0 CA--C 1.546 0.81 0 N-CA-C 112.586 0.587 . . . . 64.319999999999993 112.586 -177.554 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 85.5 mt -57.75 -62.23 1.95 Allowed 'General case' 0 N--CA 1.473 0.711 0 N-CA-C 112.606 0.595 . . . . 74.239999999999995 112.606 -177.059 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 27' ' ' ASP . . . . . 0.501 ' HA ' ' HE2' ' A' ' 49' ' ' LYS . 29.9 t70 -71.61 -20.23 62.01 Favored 'General case' 0 N--CA 1.471 0.589 0 CA-C-O 121.012 0.434 . . . . 70.239999999999995 111.13 -179.127 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 5.6 m-20 -67.77 -29.02 68.12 Favored 'General case' 0 CA--C 1.538 0.504 0 CA-C-N 116.49 -0.323 . . . . 73.239999999999995 110.941 175.087 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 29' ' ' MET . . . . . 0.469 ' O ' ' HE3' ' A' ' 49' ' ' LYS . 59.8 mtm -83.25 164.32 20.19 Favored 'General case' 0 CA--C 1.539 0.521 0 CA-C-O 120.739 0.304 . . . . 73.25 110.57 172.04 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 59.2 mtpt -86.45 166.25 15.67 Favored 'General case' 0 CA--C 1.54 0.587 0 CA-C-O 121.441 0.639 . . . . 70.030000000000001 112.676 -177.08 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 31' ' ' VAL . . . . . 0.459 HG11 HD12 ' A' ' 52' ' ' LEU . 61.4 t -53.34 -47.94 57.02 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.798 0 CA-C-N 115.694 -0.685 . . . . 73.319999999999993 112.096 -177.812 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -61.33 -27.28 68.38 Favored 'General case' 0 CA--C 1.539 0.526 0 N-CA-C 112.221 0.452 . . . . 60.100000000000001 112.221 -179.598 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 33' ' ' GLU . . . . . 0.42 ' O ' ' HB3' ' A' ' 36' ' ' GLN . 40.9 mt-10 -78.79 -39.58 35.41 Favored 'General case' 0 N--CA 1.47 0.574 0 CA-C-O 121.035 0.445 . . . . 72.040000000000006 111.334 -179.925 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 92.9 mt -66.74 -40.87 88.5 Favored 'General case' 0 CA--C 1.538 0.513 0 CA-C-O 120.703 0.287 . . . . 71.129999999999995 111.385 177.478 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 35' ' ' LYS . . . . . 0.5 ' HA ' HD11 ' A' ' 38' ' ' LEU . 96.3 mttt -61.23 -30.28 70.35 Favored 'General case' 0 CA--C 1.538 0.518 0 CA-C-O 120.872 0.368 . . . . 73.409999999999997 111.218 176.194 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 36' ' ' GLN . . . . . 0.42 ' HB3' ' O ' ' A' ' 33' ' ' GLU . 2.5 tt0 -61.82 -54.15 46.2 Favored 'General case' 0 CA--C 1.538 0.514 0 CA-C-O 121.125 0.488 . . . . 75.109999999999999 110.115 171.694 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 36.6 mm-40 -57.57 -26.22 61.14 Favored 'General case' 0 CA--C 1.54 0.594 0 CA-C-N 115.916 -0.583 . . . . 62.329999999999998 112.133 177.575 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 38' ' ' LEU . . . . . 0.5 HD11 ' HA ' ' A' ' 35' ' ' LYS . 93.7 mt -72.5 -56.91 4.64 Favored 'General case' 0 CA--C 1.535 0.381 0 CA-C-O 120.931 0.396 . . . . 74.040000000000006 111.571 175.182 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 39' ' ' LYS . . . . . 0.404 ' HE2' ' HB3' ' A' ' 39' ' ' LYS . 16.9 ptpt -61.86 -30.13 70.65 Favored 'General case' 0 CA--C 1.539 0.557 0 N-CA-C 112.197 0.443 . . . . 75.049999999999997 112.197 -175.734 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 75.8 mt -58.05 -25.6 61.41 Favored 'General case' 0 N--CA 1.473 0.676 0 CA-C-O 120.891 0.377 . . . . 75.420000000000002 111.754 174.867 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 41' ' ' ARG . . . . . . . . . . . . . 13.7 mtm180 -121.71 24.55 9.69 Favored 'General case' 0 CA--C 1.539 0.539 0 CA-C-O 120.778 0.323 . . . . 75.109999999999999 111.761 -178.567 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 23.2 t 62.46 33.51 16.08 Favored 'General case' 0 N--CA 1.475 0.807 0 N-CA-C 112.336 0.495 . . . . 73.319999999999993 112.336 174.935 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 76.3 mt -97.01 147.56 33.09 Favored Pre-proline 0 CA--C 1.542 0.661 0 CA-C-O 120.72 0.295 . . . . 72.549999999999997 111.596 178.546 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 44' ' ' PRO . . . . . . . . . . . . . 35.6 Cg_endo -64.16 122.81 10.92 Favored 'Trans proline' 0 CA--C 1.541 0.844 0 C-N-CA 122.859 2.373 . . . . 75.120000000000005 113.445 -178.04 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 33.7 m -98.93 31.19 0.41 Allowed 'Isoleucine or valine' 0 CA--C 1.545 0.767 0 CA-C-N 116.184 -0.462 . . . . 74.329999999999998 112.027 -177.498 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 78.5 p -93.94 -41.08 9.79 Favored 'General case' 0 N--CA 1.473 0.716 0 N-CA-C 112.754 0.65 . . . . 75.430000000000007 112.754 -175.514 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . -66.69 -179.33 10.68 Favored Glycine 0 CA--C 1.534 1.254 0 N-CA-C 115.078 0.791 . . . . 73.409999999999997 115.078 -174.021 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 48' ' ' THR . . . . . 0.604 ' O ' ' HG ' ' A' ' 52' ' ' LEU . 50.8 p -85.39 179.56 7.14 Favored 'General case' 0 N--CA 1.475 0.791 0 C-N-CA 122.811 0.444 . . . . 72.200000000000003 112.164 -178.254 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 49' ' ' LYS . . . . . 0.501 ' HE2' ' HA ' ' A' ' 27' ' ' ASP . 24.1 tptm -41.82 -58.7 1.93 Allowed 'General case' 0 N--CA 1.476 0.831 0 C-N-CA 123.418 0.687 . . . . 73.420000000000002 112.561 179.506 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 50' ' ' THR . . . . . . . . . . . . . 24.1 m -60.96 -38.32 85.5 Favored 'General case' 0 CA--C 1.537 0.467 0 CA-C-O 120.866 0.365 . . . . 73.209999999999994 111.583 -178.315 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 51' ' ' GLU . . . . . 0.455 ' O ' ' HB2' ' A' ' 55' ' ' ARG . 57.4 mm-40 -60.95 -42.44 98.23 Favored 'General case' 0 N--CA 1.469 0.524 0 CA-C-N 116.445 -0.343 . . . . 71.030000000000001 111.08 178.542 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 52' ' ' LEU . . . . . 0.604 ' HG ' ' O ' ' A' ' 48' ' ' THR . 14.3 mt -61.68 -45.48 93.8 Favored 'General case' 0 N--CA 1.467 0.406 0 CA-C-O 121.085 0.469 . . . . 74.319999999999993 110.628 179.15 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 53' ' ' ILE . . . . . . . . . . . . . 68.3 mt -58.5 -53.85 41.06 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.49 0 CA-C-N 115.746 -0.661 . . . . 75.239999999999995 111.332 178.341 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 40.5 mt-10 -65.07 -32.64 74.45 Favored 'General case' 0 CA--C 1.536 0.419 0 CA-C-N 116.394 -0.367 . . . . 71.340000000000003 111.38 -179.76 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 55' ' ' ARG . . . . . 0.455 ' HB2' ' O ' ' A' ' 51' ' ' GLU . 0.0 OUTLIER -60.1 -53.23 60.25 Favored 'General case' 0 CA--C 1.537 0.45 0 CA-C-O 121.19 0.519 . . . . 74.140000000000001 110.588 177.573 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 98.3 mt -57.29 -50.93 71.36 Favored 'General case' 0 CA--C 1.537 0.444 0 CA-C-N 115.834 -0.621 . . . . 73.120000000000005 111.363 176.269 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 19.9 mtp180 -63.81 -30.49 71.58 Favored 'General case' 0 CA--C 1.541 0.602 0 N-CA-C 112.187 0.44 . . . . 75.530000000000001 112.187 -178.487 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -71.46 -48.08 51.6 Favored 'General case' 0 N--CA 1.469 0.516 0 CA-C-O 121.216 0.531 . . . . 72.310000000000002 110.921 175.896 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 59' ' ' TYR . . . . . . . . . . . . . 74.1 t80 -61.21 -42.66 98.98 Favored 'General case' 0 CA--C 1.539 0.527 0 CA-C-O 121.074 0.464 . . . . 73.329999999999998 111.234 177.841 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 60' ' ' GLN . . . . . 0.565 ' HG3' ' HG ' ' A' ' 22' ' ' LEU . 21.7 tm0? -71.82 -36.83 70.34 Favored 'General case' 0 CA--C 1.538 0.516 0 CA-C-N 116.255 -0.43 . . . . 75.040000000000006 111.145 -178.528 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 61' ' ' ASP . . . . . . . . . . . . . 20.7 t70 -56.33 -40.77 74.98 Favored 'General case' 0 N--CA 1.47 0.556 0 CA-C-O 121.306 0.574 . . . . 71.239999999999995 111.064 178.984 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 62' ' ' GLN . . . . . . . . . . . . . 48.1 mt-30 -65.3 -32.32 73.92 Favored 'General case' 0 CA--C 1.542 0.644 0 CA-C-N 115.377 -0.829 . . . . 70.140000000000001 112.148 -179.331 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 63' ' ' ILE . . . . . . . . . . . . . 30.7 pt -104.36 8.97 9.47 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.66 0 CA-C-O 120.753 0.311 . . . . 72.239999999999995 111.72 179.697 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 35.4 t -98.39 139.47 21.19 Favored Pre-proline 0 N--CA 1.473 0.681 0 CA-C-N 116.504 -0.317 . . . . 72.230000000000004 111.343 -179.386 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 65' ' ' PRO . . . . . . . . . . . . . 12.8 Cg_endo -54.5 133.26 55.62 Favored 'Trans proline' 0 CA--C 1.542 0.878 0 C-N-CA 122.882 2.388 . . . . 75.349999999999994 112.951 -179.357 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 66' ' ' VAL . . . . . . . . . . . . . 35.7 m -104.83 143.3 26.42 Favored Pre-proline 0 CA--C 1.539 0.537 0 CA-C-N 116.375 -0.375 . . . . 73.219999999999999 111.155 178.835 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 67' ' ' PRO . . . . . . . . . . . . . 98.8 Cg_endo -76.3 37.37 0.54 Allowed 'Trans proline' 0 CA--C 1.543 0.952 0 C-N-CA 122.844 2.363 . . . . 73.219999999999999 113.248 -178.605 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 96.56 11.95 52.3 Favored Glycine 0 CA--C 1.528 0.886 0 C-N-CA 121.228 -0.511 . . . . 74.019999999999996 113.091 -177.076 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . -83.48 124.67 75.37 Favored Pre-proline 0 CA--C 1.54 0.58 0 C-N-CA 122.351 0.261 . . . . 74.230000000000004 111.457 178.559 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 70' ' ' PRO . . . . . . . . . . . . . 40.3 Cg_exo -57.86 105.19 0.19 Allowed 'Trans proline' 0 CA--C 1.545 1.033 0 C-N-CA 122.883 2.389 . . . . 70.109999999999999 113.625 -179.266 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 32.0 mmtp -125.68 178.99 5.36 Favored 'General case' 0 N--CA 1.47 0.561 0 CA-C-N 116.165 -0.47 . . . . 74.530000000000001 111.26 177.172 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -71.53 138.65 83.55 Favored Pre-proline 0 CA--C 1.541 0.635 0 CA-C-N 116.253 -0.43 . . . . 64.409999999999997 110.873 174.783 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 73' ' ' PRO . . . . . . . . . . . . . 44.6 Cg_exo -56.94 97.12 0.07 OUTLIER 'Trans proline' 0 CA--C 1.541 0.839 0 C-N-CA 122.392 2.062 . . . . 73.409999999999997 112.939 -179.498 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -60.68 94.96 0.03 OUTLIER 'General case' 0 CA--C 1.537 0.465 0 CA-C-O 121.085 0.469 . . . . 75.420000000000002 111.718 179.222 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.251 1.153 0 CA-C-O 118.689 -0.672 . . . . 75.319999999999993 111.165 -179.395 . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 61.7 mtt . . . . . 0 N--CA 1.489 1.497 0 CA-C-O 120.788 0.328 . . . . 75.219999999999999 111.17 . . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . 81.53 -57.21 4.91 Favored Glycine 0 CA--C 1.527 0.823 0 C-N-CA 121.062 -0.59 . . . . 74.310000000000002 112.808 -179.763 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 3' ' ' HIS . . . . . . . . . . . . . 20.9 t-160 64.01 41.05 6.75 Favored 'General case' 0 CA--C 1.544 0.744 0 CA-C-O 121.192 0.52 . . . . 73.430000000000007 112.022 174.959 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 4' ' ' HIS . . . . . . . . . . . . . 20.6 t-80 -70.37 85.91 0.6 Allowed 'General case' 0 CA--C 1.539 0.521 0 CA-C-O 121.215 0.531 . . . . 65.519999999999996 110.878 178.302 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 5' ' ' HIS . . . . . . . . . . . . . 13.3 p-80 -64.53 135.3 55.87 Favored 'General case' 0 CA--C 1.539 0.531 0 CA-C-N 115.974 -0.557 . . . . 73.319999999999993 111.477 179.22 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 6.7 p-80 -128.74 93.55 3.65 Favored 'General case' 0 CA--C 1.538 0.51 0 CA-C-O 121.431 0.634 . . . . 74.129999999999995 111.436 -178.736 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 38.7 t-80 -99.62 123.8 44.23 Favored 'General case' 0 CA--C 1.538 0.486 0 CA-C-N 115.779 -0.646 . . . . 70.310000000000002 110.617 179.638 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 8' ' ' HIS . . . . . . . . . . . . . 23.3 p-80 -144.56 137.83 27.06 Favored 'General case' 0 N--CA 1.472 0.653 0 CA-C-O 121.203 0.525 . . . . 74.409999999999997 111.998 -178.279 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 36.0 p -142.63 134.09 26.4 Favored 'General case' 0 N--CA 1.47 0.527 0 CA-C-N 115.775 -0.648 . . . . 75.340000000000003 110.664 177.228 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 72.5 t60 -164.02 134.4 4.25 Favored 'General case' 0 CA--C 1.54 0.563 0 CA-C-O 120.866 0.365 . . . . 71.129999999999995 111.818 -178.553 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 11' ' ' MET . . . . . . . . . . . . . 25.7 ptm -131.91 177.66 7.37 Favored 'General case' 0 N--CA 1.473 0.699 0 CA-C-N 116.443 -0.344 . . . . 74.310000000000002 110.688 174.222 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 87.1 p -115.46 147.37 40.69 Favored 'General case' 0 N--CA 1.473 0.691 0 CA-C-O 120.89 0.376 . . . . 74.310000000000002 111.097 177.872 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 13' ' ' THR . . . . . . . . . . . . . 68.8 p -130.77 109.19 15.68 Favored Pre-proline 0 N--CA 1.471 0.621 0 CA-C-N 116.583 -0.281 . . . . 61.140000000000001 111.574 179.597 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 14' ' ' PRO . . . . . . . . . . . . . 75.0 Cg_endo -75.93 -177.99 4.03 Favored 'Trans proline' 0 CA--C 1.54 0.802 0 C-N-CA 122.624 2.216 . . . . 73.219999999999999 112.54 175.331 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 70.7 mt -73.26 104.93 4.46 Favored 'General case' 0 CA--C 1.537 0.446 0 CA-C-O 121.157 0.504 . . . . 73.109999999999999 111.394 179.132 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 16' ' ' THR . . . . . . . . . . . . . 70.3 p -77.02 108.39 10.05 Favored 'General case' 0 N--CA 1.467 0.401 0 CA-C-O 121.282 0.563 . . . . 74.510000000000005 111.212 179.724 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . -164.21 -144.26 3.98 Favored Glycine 0 CA--C 1.523 0.532 0 CA-C-N 115.975 -0.557 . . . . 73.140000000000001 112.756 -179.624 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 45.6 mmtm 69.06 141.8 0.08 OUTLIER Pre-proline 0 CA--C 1.545 0.767 0 C-N-CA 123.218 0.607 . . . . 74.109999999999999 112.163 179.61 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 89.7 Cg_endo -84.11 103.03 0.96 Allowed 'Trans proline' 0 CA--C 1.543 0.944 0 C-N-CA 122.634 2.223 . . . . 71.209999999999994 113.257 179.825 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . -72.92 67.57 1.37 Allowed Glycine 0 CA--C 1.525 0.718 0 C-N-CA 121.287 -0.482 . . . . 71.030000000000001 112.253 173.995 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -124.2 -158.32 0.81 Allowed 'General case' 0 CA--C 1.539 0.524 0 C-N-CA 122.679 0.392 . . . . 72.230000000000004 111.693 -175.793 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 22' ' ' LEU . . . . . 0.592 ' HG ' ' HG3' ' A' ' 60' ' ' GLN . 91.6 mt -95.58 158.86 33.78 Favored Pre-proline 0 N--CA 1.472 0.655 0 N-CA-C 111.916 0.339 . . . . 75.439999999999998 111.916 179.741 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 23' ' ' PRO . . . . . . . . . . . . . 32.9 Cg_exo -62.19 166.61 12.42 Favored 'Trans proline' 0 CA--C 1.541 0.844 0 C-N-CA 122.656 2.237 . . . . 73.519999999999996 111.845 169.233 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -76.36 -65.07 0.97 Allowed 'General case' 0 CA--C 1.54 0.577 0 CA-C-O 120.963 0.411 . . . . 62.450000000000003 112.053 -177.532 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 25' ' ' ASN . . . . . 0.573 ' HB3' ' HB2' ' A' ' 28' ' ' ASP . 1.8 m-20 -81.27 67.54 7.25 Favored 'General case' 0 CA--C 1.541 0.613 0 CA-C-O 121.086 0.47 . . . . 71.230000000000004 111.85 -175.578 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 26' ' ' LEU . . . . . 0.418 HD23 ' HB3' ' A' ' 22' ' ' LEU . 95.4 mt -58.87 -51.75 68.66 Favored 'General case' 0 CA--C 1.542 0.635 0 N-CA-C 112.834 0.679 . . . . 72.120000000000005 112.834 -176.284 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 35.4 t70 -71.81 -17.01 62.19 Favored 'General case' 0 CA--C 1.54 0.578 0 CA-C-O 121.03 0.443 . . . . 71.409999999999997 111.622 -177.975 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 28' ' ' ASP . . . . . 0.573 ' HB2' ' HB3' ' A' ' 25' ' ' ASN . 6.0 m-20 -80.5 -25.26 38.85 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-O 120.775 0.322 . . . . 73.150000000000006 110.986 174.802 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 29' ' ' MET . . . . . 0.431 ' HG3' ' O ' ' A' ' 25' ' ' ASN . 87.4 mtp -67.74 139.95 56.69 Favored 'General case' 0 CA--C 1.537 0.448 0 CA-C-O 121.129 0.49 . . . . 73.109999999999999 110.575 173.835 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 49.9 mtmt -66.41 151.96 46.07 Favored 'General case' 0 CA--C 1.538 0.484 0 CA-C-O 121.023 0.439 . . . . 73.5 111.769 -176.514 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 31' ' ' VAL . . . . . 0.482 HG11 ' HE3' ' A' ' 35' ' ' LYS . 39.8 t -49.67 -42.74 17.87 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.684 0 CA-C-N 116.085 -0.507 . . . . 74.540000000000006 112.288 -176.842 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -63.04 -37.54 87.6 Favored 'General case' 0 CA--C 1.539 0.556 0 N-CA-C 111.854 0.316 . . . . 53.149999999999999 111.854 178.041 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 38.2 mt-10 -64.29 -40.55 96.17 Favored 'General case' 0 N--CA 1.469 0.518 0 CA-C-O 120.987 0.423 . . . . 75.310000000000002 111.114 179.114 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 88.1 mt -61.96 -46.17 90.47 Favored 'General case' 0 N--CA 1.468 0.47 0 CA-C-N 116.111 -0.495 . . . . 72.120000000000005 110.911 176.487 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 35' ' ' LYS . . . . . 0.482 ' HE3' HG11 ' A' ' 31' ' ' VAL . 98.0 mttt -63.8 -32.74 74.34 Favored 'General case' 0 CA--C 1.539 0.538 0 CA-C-N 116.199 -0.455 . . . . 73.540000000000006 111.602 177.311 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 36' ' ' GLN . . . . . 0.465 ' O ' ' HG ' ' A' ' 40' ' ' LEU . 25.6 tm0? -62.92 -41.75 99.57 Favored 'General case' 0 CA--C 1.538 0.502 0 CA-C-O 120.844 0.354 . . . . 74.140000000000001 110.704 176.744 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 52.9 mm-40 -67.18 -46.69 73.2 Favored 'General case' 0 CA--C 1.542 0.641 0 CA-C-O 120.907 0.384 . . . . 73.319999999999993 111.513 174.219 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 38' ' ' LEU . . . . . . . . . . . . . 81.1 mt -53.57 -52.51 59.52 Favored 'General case' 0 N--CA 1.47 0.574 0 N-CA-C 112.472 0.545 . . . . 74.120000000000005 112.472 179.942 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 18.4 ptpt -58.59 -40.37 82.98 Favored 'General case' 0 N--CA 1.473 0.678 0 N-CA-C 111.751 0.278 . . . . 72.420000000000002 111.751 -177.7 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 40' ' ' LEU . . . . . 0.465 ' HG ' ' O ' ' A' ' 36' ' ' GLN . 94.9 mt -59.69 -30.09 68.54 Favored 'General case' 0 N--CA 1.472 0.642 0 CA-C-O 121.341 0.591 . . . . 63.219999999999999 110.993 176.963 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 41' ' ' ARG . . . . . 0.43 ' NH1' ' OE1' ' A' ' 60' ' ' GLN . 60.2 mtt-85 -99.67 14.07 31.37 Favored 'General case' 0 CA--C 1.537 0.466 0 CA-C-N 115.695 -0.684 . . . . 74.310000000000002 111.778 -175.804 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 47.7 m 64.16 19.51 11.8 Favored 'General case' 0 N--CA 1.479 0.986 0 CA-C-O 121.066 0.46 . . . . 72.430000000000007 111.985 179.045 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 74.3 mt -91.03 146.52 33.83 Favored Pre-proline 0 CA--C 1.541 0.599 0 CA-C-N 116.085 -0.507 . . . . 73.230000000000004 111.639 -178.88 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 44' ' ' PRO . . . . . 0.525 ' HD2' ' HD3' ' A' ' 55' ' ' ARG . 33.6 Cg_exo -57.99 134.06 59.83 Favored 'Trans proline' 0 CA--C 1.545 1.03 0 C-N-CA 122.305 2.003 . . . . 75.420000000000002 112.546 174.737 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 34.0 m -105.64 -12.91 9.54 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.772 0 N-CA-C 112.57 0.581 . . . . 72.140000000000001 112.57 -175.197 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 57.4 p -85.0 37.13 0.65 Allowed 'General case' 0 N--CA 1.478 0.948 0 N-CA-C 112.802 0.667 . . . . 65.430000000000007 112.802 -174.933 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . -108.54 174.11 18.41 Favored Glycine 0 CA--C 1.529 0.92 0 C-N-CA 121.277 -0.487 . . . . 61.310000000000002 112.946 177.638 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 48' ' ' THR . . . . . 0.483 ' O ' ' HG ' ' A' ' 52' ' ' LEU . 70.6 p -80.96 162.1 24.01 Favored 'General case' 0 N--CA 1.474 0.76 0 O-C-N 122.437 -0.449 . . . . 75.340000000000003 111.476 177.811 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 22.8 tptm -37.99 -60.44 0.75 Allowed 'General case' 0 N--CA 1.478 0.946 0 N-CA-C 113.106 0.78 . . . . 72.329999999999998 113.106 -177.561 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 50' ' ' THR . . . . . . . . . . . . . 60.3 m -58.99 -41.01 86.59 Favored 'General case' 0 N--CA 1.472 0.629 0 N-CA-C 112.146 0.424 . . . . 73.209999999999994 112.146 -178.072 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 47.3 mt-10 -62.54 -41.99 99.24 Favored 'General case' 0 N--CA 1.469 0.489 0 CA-C-O 120.803 0.335 . . . . 75.420000000000002 111.274 179.784 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 52' ' ' LEU . . . . . 0.483 ' HG ' ' O ' ' A' ' 48' ' ' THR . 42.4 mt -57.63 -46.94 83.49 Favored 'General case' 0 N--CA 1.47 0.527 0 CA-C-O 121.254 0.549 . . . . 70.019999999999996 110.803 179.783 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 53' ' ' ILE . . . . . . . . . . . . . 66.3 mt -63.81 -57.5 11.42 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.55 0 CA-C-N 115.578 -0.737 . . . . 73.109999999999999 111.934 -179.685 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 21.0 mm-40 -60.03 -33.14 71.61 Favored 'General case' 0 CA--C 1.538 0.485 0 CA-C-N 116.277 -0.419 . . . . 72.019999999999996 111.86 -177.918 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 55' ' ' ARG . . . . . 0.525 ' HD3' ' HD2' ' A' ' 44' ' ' PRO . 40.5 ttm180 -64.19 -44.93 90.5 Favored 'General case' 0 CA--C 1.542 0.666 0 CA-C-O 120.814 0.34 . . . . 75.299999999999997 111.161 175.576 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 81.1 mt -57.73 -45.87 85.23 Favored 'General case' 0 N--CA 1.471 0.619 0 CA-C-O 121.232 0.539 . . . . 73.329999999999998 111.184 174.561 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 81.2 mtp180 -65.26 -43.11 92.34 Favored 'General case' 0 CA--C 1.536 0.439 0 CA-C-N 115.88 -0.6 . . . . 71.140000000000001 111.442 -179.041 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 58' ' ' ALA . . . . . 0.404 ' O ' ' HG3' ' A' ' 62' ' ' GLN . . . -60.93 -40.43 93.17 Favored 'General case' 0 CA--C 1.535 0.392 0 CA-C-O 120.916 0.389 . . . . 55.109999999999999 111.269 178.775 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 59' ' ' TYR . . . . . . . . . . . . . 81.5 t80 -59.55 -49.92 75.91 Favored 'General case' 0 CA--C 1.54 0.571 0 CA-C-N 115.848 -0.615 . . . . 74.010000000000005 111.395 176.396 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 60' ' ' GLN . . . . . 0.592 ' HG3' ' HG ' ' A' ' 22' ' ' LEU . 14.3 mm100 -66.75 -30.19 70.35 Favored 'General case' 0 N--CA 1.471 0.614 0 N-CA-C 111.885 0.328 . . . . 73.420000000000002 111.885 178.969 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 61' ' ' ASP . . . . . . . . . . . . . 17.2 t70 -63.37 -40.87 98.43 Favored 'General case' 0 CA--C 1.539 0.545 0 CA-C-O 120.942 0.401 . . . . 65.439999999999998 111.437 177.799 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 62' ' ' GLN . . . . . 0.404 ' HG3' ' O ' ' A' ' 58' ' ' ALA . 51.1 mt-30 -62.65 -49.26 75.86 Favored 'General case' 0 CA--C 1.537 0.469 0 CA-C-N 116.319 -0.4 . . . . 72.209999999999994 111.768 179.389 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 63' ' ' ILE . . . . . . . . . . . . . 32.9 pt -79.51 -19.79 12.52 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.655 0 N-CA-C 111.898 0.333 . . . . 72.420000000000002 111.898 179.258 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 28.6 t 67.81 147.13 0.11 Allowed Pre-proline 0 N--CA 1.48 1.039 0 C-N-CA 123.305 0.642 . . . . 72.109999999999999 111.695 179.706 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 65' ' ' PRO . . . . . . . . . . . . . 6.8 Cg_endo -48.7 108.79 0.2 Allowed 'Trans proline' 0 CA--C 1.541 0.869 0 C-N-CA 122.576 2.184 . . . . 72.310000000000002 112.484 177.611 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 66' ' ' VAL . . . . . . . . . . . . . 33.7 m -62.7 133.65 95.07 Favored Pre-proline 0 CA--C 1.542 0.673 0 N-CA-C 112.31 0.485 . . . . 74.099999999999994 112.31 -176.099 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 67' ' ' PRO . . . . . . . . . . . . . 71.6 Cg_endo -75.56 55.45 4.24 Favored 'Trans proline' 0 CA--C 1.54 0.815 0 C-N-CA 122.793 2.328 . . . . 65.0 112.41 178.051 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 77.69 74.51 1.0 Allowed Glycine 0 CA--C 1.527 0.782 0 C-N-CA 121.277 -0.487 . . . . 73.420000000000002 113.091 -176.959 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . -164.73 128.51 1.74 Allowed Pre-proline 0 CA--C 1.539 0.526 0 O-C-N 122.752 -0.263 . . . . 73.329999999999998 111.353 -178.587 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 70' ' ' PRO . . . . . . . . . . . . . 76.0 Cg_endo -76.61 145.11 25.83 Favored 'Trans proline' 0 CA--C 1.541 0.872 0 C-N-CA 122.36 2.04 . . . . 74.049999999999997 112.884 177.863 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 41.9 mtmt -74.12 -40.76 62.44 Favored 'General case' 0 N--CA 1.469 0.509 0 CA-C-O 121.43 0.633 . . . . 74.349999999999994 110.724 179.352 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -109.15 155.48 40.91 Favored Pre-proline 0 CA--C 1.539 0.556 0 CA-C-N 115.617 -0.72 . . . . 73.109999999999999 110.575 177.393 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 73' ' ' PRO . . . . . . . . . . . . . 71.9 Cg_endo -75.45 41.33 0.77 Allowed 'Trans proline' 0 CA--C 1.545 1.07 0 C-N-CA 122.563 2.176 . . . . 72.540000000000006 113.379 179.716 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -152.98 179.57 8.56 Favored 'General case' 0 CA--C 1.538 0.499 0 CA-C-N 116.431 -0.349 . . . . 75.400000000000006 111.245 -178.585 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.252 1.219 0 CA-C-O 118.755 -0.64 . . . . 65.209999999999994 112.023 -179.145 . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 25.6 ptt? . . . . . 0 N--CA 1.489 1.478 0 CA-C-O 120.637 0.256 . . . . 75.25 111.437 . . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . -79.03 138.31 20.5 Favored Glycine 0 CA--C 1.529 0.963 0 C-N-CA 121.394 -0.431 . . . . 65.540000000000006 113.311 -178.329 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 3' ' ' HIS . . . . . . . . . . . . . 13.0 p80 -109.23 111.95 23.84 Favored 'General case' 0 N--CA 1.474 0.749 0 CA-C-O 121.111 0.481 . . . . 73.239999999999995 111.374 -178.922 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 4' ' ' HIS . . . . . . . . . . . . . 49.1 m-70 -131.18 168.32 17.66 Favored 'General case' 0 N--CA 1.471 0.577 0 CA-C-O 120.994 0.426 . . . . 74.129999999999995 111.55 -179.44 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 5' ' ' HIS . . . . . . . . . . . . . 99.0 m-70 -116.96 151.96 35.6 Favored 'General case' 0 N--CA 1.471 0.575 0 CA-C-N 116.263 -0.426 . . . . 72.230000000000004 111.692 -179.948 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 42.1 t-80 -140.68 134.44 30.38 Favored 'General case' 0 N--CA 1.469 0.511 0 CA-C-N 116.391 -0.368 . . . . 74.329999999999998 111.58 -175.985 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 61.1 t60 -62.78 139.04 58.67 Favored 'General case' 0 CA--C 1.544 0.73 0 N-CA-C 112.957 0.725 . . . . 75.120000000000005 112.957 -177.662 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 8' ' ' HIS . . . . . . . . . . . . . 84.7 m-70 -113.94 113.63 25.09 Favored 'General case' 0 CA--C 1.541 0.608 0 CA-C-N 115.894 -0.594 . . . . 74.099999999999994 110.623 173.334 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 67.8 m -73.49 153.97 40.11 Favored 'General case' 0 N--CA 1.47 0.536 0 CA-C-O 120.98 0.419 . . . . 60.240000000000002 111.887 -178.618 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 23.0 p-80 -160.13 129.62 5.17 Favored 'General case' 0 CA--C 1.539 0.529 0 CA-C-N 116.234 -0.439 . . . . 71.530000000000001 111.577 -178.01 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 11' ' ' MET . . . . . . . . . . . . . 83.9 mtp -128.74 177.01 7.36 Favored 'General case' 0 CA--C 1.541 0.608 0 CA-C-O 121.139 0.495 . . . . 73.099999999999994 111.682 -179.295 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 75.4 m -153.45 127.66 9.12 Favored 'General case' 0 N--CA 1.479 0.978 0 CA-C-N 116.327 -0.397 . . . . 71.230000000000004 111.456 178.253 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 13' ' ' THR . . . . . . . . . . . . . 81.8 p -110.39 146.63 34.67 Favored Pre-proline 0 N--CA 1.473 0.696 0 C-N-CA 122.293 0.237 . . . . 75.140000000000001 111.236 179.79 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 14' ' ' PRO . . . . . . . . . . . . . 71.7 Cg_endo -74.87 174.3 12.98 Favored 'Trans proline' 0 CA--C 1.54 0.782 0 C-N-CA 122.41 2.073 . . . . 75.530000000000001 112.642 179.106 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 89.9 mt -87.34 158.09 19.12 Favored 'General case' 0 N--CA 1.471 0.59 0 CA-C-O 121.151 0.5 . . . . 75.310000000000002 111.659 -179.378 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 16' ' ' THR . . . . . . . . . . . . . 81.4 p -82.69 118.14 23.13 Favored 'General case' 0 N--CA 1.471 0.601 0 CA-C-N 116.194 -0.457 . . . . 74.5 111.851 -178.274 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . 142.11 172.1 13.4 Favored Glycine 0 CA--C 1.526 0.76 0 C-N-CA 120.692 -0.766 . . . . 74.120000000000005 113.991 177.235 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 59.0 pttt -166.43 151.25 7.3 Favored Pre-proline 0 CA--C 1.543 0.688 0 C-N-CA 122.758 0.423 . . . . 63.310000000000002 111.176 178.883 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 24.9 Cg_exo -63.78 133.9 41.28 Favored 'Trans proline' 0 CA--C 1.542 0.92 0 C-N-CA 122.868 2.379 . . . . 74.540000000000006 114.127 -176.656 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . -94.96 -45.71 3.04 Favored Glycine 0 CA--C 1.526 0.77 0 CA-C-N 116.145 -0.48 . . . . 50.409999999999997 112.426 174.416 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -79.73 -178.65 6.5 Favored 'General case' 0 CA--C 1.54 0.595 0 CA-C-O 120.967 0.413 . . . . 61.140000000000001 111.711 178.301 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 76.2 mt -131.59 149.31 73.12 Favored Pre-proline 0 N--CA 1.472 0.644 0 CA-C-O 120.843 0.354 . . . . 75.230000000000004 111.783 178.807 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 23' ' ' PRO . . . . . . . . . . . . . 87.4 Cg_endo -83.54 171.14 11.2 Favored 'Trans proline' 0 CA--C 1.538 0.704 0 C-N-CA 122.797 2.331 . . . . 74.230000000000004 112.37 171.643 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -92.97 -2.7 55.53 Favored 'General case' 0 CA--C 1.541 0.631 0 CA-C-O 120.816 0.341 . . . . 73.120000000000005 111.481 176.31 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 1.5 m-20 -88.35 19.86 3.59 Favored 'General case' 0 N--CA 1.473 0.687 0 N-CA-C 112.203 0.446 . . . . 74.549999999999997 112.203 -177.138 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 99.1 mt -54.14 -51.83 63.0 Favored 'General case' 0 CA--C 1.545 0.767 0 N-CA-C 112.877 0.695 . . . . 74.439999999999998 112.877 -174.544 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 17.6 t70 -76.86 -16.47 59.4 Favored 'General case' 0 CA--C 1.543 0.709 0 CA-C-O 121.001 0.429 . . . . 62.310000000000002 111.571 -179.15 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 24.7 t70 -81.12 -29.14 34.87 Favored 'General case' 0 CA--C 1.543 0.694 0 CA-C-O 120.89 0.376 . . . . 74.129999999999995 111.474 179.985 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 29' ' ' MET . . . . . . . . . . . . . 58.2 mtm -81.55 172.66 13.21 Favored 'General case' 0 CA--C 1.541 0.623 0 CA-C-O 121.368 0.604 . . . . 74.510000000000005 111.989 -179.491 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 48.8 mtmt -77.95 156.04 30.47 Favored 'General case' 0 CA--C 1.539 0.544 0 CA-C-N 115.672 -0.694 . . . . 74.409999999999997 111.563 -179.402 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 59.7 t -57.79 -35.22 50.35 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.584 0 CA-C-O 120.934 0.397 . . . . 72.239999999999995 111.31 179.183 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -59.87 -37.17 78.56 Favored 'General case' 0 CA--C 1.54 0.559 0 CA-C-N 116.523 -0.308 . . . . 53.439999999999998 111.659 176.659 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 23.5 mm-40 -64.63 -45.86 85.03 Favored 'General case' 0 N--CA 1.469 0.476 0 CA-C-O 121.224 0.535 . . . . 61.100000000000001 110.824 178.046 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 63.1 mt -58.43 -51.29 70.47 Favored 'General case' 0 CA--C 1.537 0.444 0 CA-C-N 115.8 -0.636 . . . . 74.310000000000002 110.887 176.907 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 56.7 mtmt -60.82 -31.19 70.61 Favored 'General case' 0 CA--C 1.54 0.592 0 CA-C-N 116.085 -0.507 . . . . 71.230000000000004 111.374 177.183 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER -64.57 -45.62 86.29 Favored 'General case' 0 CA--C 1.54 0.571 0 CA-C-N 116.206 -0.452 . . . . 72.450000000000003 110.621 177.387 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 42.1 mm-40 -66.11 -40.91 91.08 Favored 'General case' 0 CA--C 1.538 0.488 0 CA-C-O 120.995 0.426 . . . . 60.210000000000001 111.505 176.446 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 38' ' ' LEU . . . . . 0.425 HD11 ' HB3' ' A' ' 52' ' ' LEU . 94.5 mt -58.28 -53.67 55.61 Favored 'General case' 0 CA--C 1.538 0.483 0 N-CA-C 112.07 0.396 . . . . 63.32 112.07 178.547 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 39' ' ' LYS . . . . . 0.76 ' HZ2' ' HB3' ' A' ' 39' ' ' LYS . 0.5 OUTLIER -59.59 -31.97 69.96 Favored 'General case' 0 N--CA 1.472 0.649 0 N-CA-C 112.11 0.411 . . . . 75.420000000000002 112.11 -176.224 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 78.2 mt -68.26 -28.1 66.91 Favored 'General case' 0 N--CA 1.469 0.503 0 CA-C-O 121.038 0.447 . . . . 75.310000000000002 111.364 176.584 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 41' ' ' ARG . . . . . . . . . . . . . 53.1 mtt-85 -103.23 16.18 27.26 Favored 'General case' 0 CA--C 1.539 0.537 0 CA-C-N 116.368 -0.378 . . . . 71.010000000000005 111.663 -175.91 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 51.1 m 62.45 24.69 14.71 Favored 'General case' 0 N--CA 1.48 1.028 0 CA-C-O 121.144 0.497 . . . . 75.430000000000007 111.888 -179.475 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 78.1 mt -95.2 135.8 23.12 Favored Pre-proline 0 CA--C 1.542 0.65 0 CA-C-N 116.135 -0.484 . . . . 75.239999999999995 111.592 -179.039 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 44' ' ' PRO . . . . . . . . . . . . . 58.6 Cg_endo -70.98 143.56 45.3 Favored 'Trans proline' 0 CA--C 1.545 1.027 0 C-N-CA 122.752 2.301 . . . . 72.200000000000003 113.57 179.392 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 27.5 m -100.26 34.92 0.26 Allowed 'Isoleucine or valine' 0 N--CA 1.475 0.776 0 CA-C-O 121.389 0.614 . . . . 73.439999999999998 111.254 -179.718 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 37.3 m -74.94 -26.33 59.53 Favored 'General case' 0 N--CA 1.473 0.712 0 N-CA-C 114.009 1.115 . . . . 74.409999999999997 114.009 -169.371 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . -94.95 -171.95 37.24 Favored Glycine 0 CA--C 1.529 0.919 0 C-N-CA 120.655 -0.783 . . . . 73.349999999999994 114.522 -175.281 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 48' ' ' THR . . . . . 0.509 ' O ' ' HG ' ' A' ' 52' ' ' LEU . 81.3 p -84.77 179.67 7.29 Favored 'General case' 0 N--CA 1.471 0.584 0 C-N-CA 122.581 0.353 . . . . 71.120000000000005 111.273 178.097 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 49' ' ' LYS . . . . . 0.428 ' O ' HG13 ' A' ' 53' ' ' ILE . 87.4 tttt -46.23 -59.92 2.62 Favored 'General case' 0 N--CA 1.475 0.812 0 N-CA-C 112.32 0.489 . . . . 74.209999999999994 112.32 -178.384 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 50' ' ' THR . . . . . . . . . . . . . 94.9 m -58.62 -39.86 81.66 Favored 'General case' 0 N--CA 1.472 0.627 0 N-CA-C 111.869 0.322 . . . . 64.530000000000001 111.869 -178.845 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -57.44 -54.08 50.91 Favored 'General case' 0 CA--C 1.536 0.433 0 CA-C-O 120.924 0.392 . . . . 71.349999999999994 110.819 176.989 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 52' ' ' LEU . . . . . 0.509 ' HG ' ' O ' ' A' ' 48' ' ' THR . 42.6 mt -54.64 -41.42 70.04 Favored 'General case' 0 CA--C 1.538 0.495 0 CA-C-O 121.229 0.538 . . . . 64.209999999999994 111.088 178.969 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 53' ' ' ILE . . . . . 0.448 HG23 ' HD3' ' A' ' 57' ' ' ARG . 77.6 mt -62.16 -47.78 91.53 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.636 0 CA-C-N 115.946 -0.57 . . . . 72.239999999999995 111.258 176.711 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 36.6 mm-40 -62.5 -35.56 79.77 Favored 'General case' 0 N--CA 1.468 0.472 0 CA-C-N 116.471 -0.332 . . . . 72.329999999999998 111.506 177.387 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 47.9 ttm-85 -65.08 -45.09 86.71 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-O 120.953 0.406 . . . . 72.329999999999998 110.995 178.009 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 81.9 mt -59.17 -48.49 81.4 Favored 'General case' 0 CA--C 1.537 0.479 0 CA-C-O 120.99 0.424 . . . . 73.230000000000004 110.918 174.76 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 57' ' ' ARG . . . . . 0.448 ' HD3' HG23 ' A' ' 53' ' ' ILE . 7.8 mtp85 -64.37 -41.16 96.87 Favored 'General case' 0 N--CA 1.471 0.597 0 CA-C-N 116.268 -0.424 . . . . 71.510000000000005 112.139 179.859 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -67.63 -30.64 70.26 Favored 'General case' 0 N--CA 1.469 0.479 0 CA-C-O 121.147 0.499 . . . . 64.239999999999995 111.514 177.92 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 59' ' ' TYR . . . . . . . . . . . . . 77.0 t80 -74.93 -44.47 48.43 Favored 'General case' 0 CA--C 1.539 0.527 0 CA-C-O 121.069 0.462 . . . . 74.340000000000003 110.986 175.956 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 60' ' ' GLN . . . . . 0.64 ' HG3' ' HB2' ' A' ' 64' ' ' SER . 8.9 tp-100 -65.52 -36.39 83.7 Favored 'General case' 0 CA--C 1.537 0.449 0 CA-C-N 116.367 -0.379 . . . . 75.109999999999999 110.912 178.409 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 61' ' ' ASP . . . . . . . . . . . . . 14.9 t70 -49.27 -32.44 10.84 Favored 'General case' 0 CA--C 1.543 0.69 0 CA-C-O 121.35 0.595 . . . . 75.0 111.404 175.771 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 62' ' ' GLN . . . . . . . . . . . . . 60.8 mt-30 -84.62 -17.17 39.52 Favored 'General case' 0 CA--C 1.543 0.696 0 CA-C-N 115.99 -0.55 . . . . 74.0 112.457 -176.923 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 63' ' ' ILE . . . . . . . . . . . . . 34.0 pt -129.2 6.63 2.61 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.881 0 N-CA-C 113.1 0.778 . . . . 73.439999999999998 113.1 -175.521 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 64' ' ' SER . . . . . 0.64 ' HB2' ' HG3' ' A' ' 60' ' ' GLN . 40.0 t -94.25 141.85 24.13 Favored Pre-proline 0 N--CA 1.475 0.818 0 O-C-N 122.092 -0.38 . . . . 74.209999999999994 111.542 -178.864 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 65' ' ' PRO . . . . . . . . . . . . . 17.7 Cg_exo -68.09 73.73 0.75 Allowed 'Trans proline' 0 CA--C 1.543 0.927 0 C-N-CA 122.801 2.334 . . . . 75.129999999999995 112.689 176.583 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 66' ' ' VAL . . . . . 0.494 HG11 ' HG ' ' A' ' 64' ' ' SER . 29.1 m -122.4 155.15 62.55 Favored Pre-proline 0 CA--C 1.539 0.555 0 CA-C-N 116.371 -0.377 . . . . 74.319999999999993 111.284 -178.979 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 67' ' ' PRO . . . . . . . . . . . . . 18.3 Cg_endo -59.87 -42.97 40.64 Favored 'Trans proline' 0 CA--C 1.541 0.839 0 C-N-CA 122.596 2.197 . . . . 73.019999999999996 112.686 177.973 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 161.28 29.51 0.02 OUTLIER Glycine 0 CA--C 1.527 0.816 0 C-N-CA 120.615 -0.802 . . . . 72.230000000000004 114.213 176.831 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 69' ' ' ALA . . . . . 0.626 ' HB1' ' HE2' ' A' ' 71' ' ' LYS . . . 64.95 156.38 0.12 Allowed Pre-proline 0 N--CA 1.477 0.883 0 N-CA-C 112.521 0.563 . . . . 70.019999999999996 112.521 178.686 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 70' ' ' PRO . . . . . . . . . . . . . 33.7 Cg_endo -63.86 104.15 0.45 Allowed 'Trans proline' 0 CA--C 1.539 0.741 0 C-N-CA 122.231 1.954 . . . . 73.439999999999998 112.171 177.361 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 71' ' ' LYS . . . . . 0.626 ' HE2' ' HB1' ' A' ' 69' ' ' ALA . 74.8 mmtt -110.28 113.95 27.03 Favored 'General case' 0 N--CA 1.467 0.381 0 CA-C-O 120.801 0.334 . . . . 74.140000000000001 111.252 -178.232 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -141.52 78.82 17.88 Favored Pre-proline 0 CA--C 1.538 0.481 0 CA-C-O 120.955 0.407 . . . . 74.140000000000001 111.169 176.673 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 73' ' ' PRO . . . . . . . . . . . . . 62.7 Cg_endo -90.0 10.07 3.15 Favored 'Trans proline' 0 CA--C 1.54 0.824 0 C-N-CA 122.875 2.384 . . . . 62.32 113.648 -178.601 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . 67.91 -65.69 0.24 Allowed 'General case' 0 N--CA 1.475 0.805 0 C-N-CA 122.879 0.472 . . . . 73.540000000000006 111.81 -176.733 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.252 1.234 0 CA-C-O 118.34 -0.838 . . . . 74.450000000000003 112.819 176.772 . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 58.1 mtt . . . . . 0 N--CA 1.49 1.574 0 CA-C-O 120.37 0.129 . . . . 64.549999999999997 110.863 . . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . 146.1 153.47 5.89 Favored Glycine 0 CA--C 1.526 0.762 0 C-N-CA 120.479 -0.867 . . . . 74.140000000000001 113.989 176.171 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 3' ' ' HIS . . . . . . . . . . . . . 66.5 m80 -134.38 114.7 13.21 Favored 'General case' 0 CA--C 1.539 0.537 0 CA-C-O 121.17 0.509 . . . . 75.109999999999999 110.953 177.371 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 4' ' ' HIS . . . . . . . . . . . . . 15.8 p80 -85.55 128.02 34.62 Favored 'General case' 0 CA--C 1.542 0.653 0 N-CA-C 113.087 0.773 . . . . 70.329999999999998 113.087 -172.09 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 5' ' ' HIS . . . . . . . . . . . . . 58.8 t-80 -94.63 136.15 35.27 Favored 'General case' 0 CA--C 1.541 0.612 0 CA-C-N 116.091 -0.504 . . . . 74.540000000000006 109.997 172.26 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 12.2 p80 -121.31 -176.75 3.36 Favored 'General case' 0 N--CA 1.471 0.599 0 CA-C-O 120.879 0.371 . . . . 74.540000000000006 111.245 -178.566 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 52.1 m80 -121.9 168.61 11.68 Favored 'General case' 0 CA--C 1.537 0.478 0 CA-C-O 121.034 0.445 . . . . 74.400000000000006 111.764 177.977 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 8' ' ' HIS . . . . . . . . . . . . . 64.9 t60 -145.17 96.68 2.88 Favored 'General case' 0 CA--C 1.538 0.515 0 CA-C-N 116.051 -0.522 . . . . 72.439999999999998 110.664 173.6 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 47.0 m -79.36 171.35 15.29 Favored 'General case' 0 N--CA 1.472 0.647 0 CA-C-O 121.368 0.604 . . . . 74.219999999999999 112.594 -175.205 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 57.0 p-80 -152.95 152.05 31.01 Favored 'General case' 0 CA--C 1.539 0.545 0 CA-C-N 115.785 -0.643 . . . . 71.310000000000002 110.668 176.581 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 11' ' ' MET . . . . . . . . . . . . . 86.2 mtp -120.89 134.24 55.29 Favored 'General case' 0 N--CA 1.472 0.644 0 CA-C-O 120.789 0.328 . . . . 64.120000000000005 111.37 179.154 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 45.5 m -73.15 119.09 16.91 Favored 'General case' 0 N--CA 1.469 0.5 0 CA-C-N 116.446 -0.343 . . . . 61.109999999999999 111.076 177.491 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 13' ' ' THR . . . . . . . . . . . . . 45.1 p -82.65 131.92 53.48 Favored Pre-proline 0 CA--C 1.542 0.65 0 CA-C-O 120.679 0.275 . . . . 74.319999999999993 111.713 -179.542 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 14' ' ' PRO . . . . . . . . . . . . . 64.0 Cg_endo -70.82 154.49 63.52 Favored 'Trans proline' 0 CA--C 1.542 0.878 0 C-N-CA 122.969 2.446 . . . . 74.049999999999997 113.81 -176.673 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 2.0 pp -119.2 -178.38 3.56 Favored 'General case' 0 N--CA 1.474 0.728 0 CA-C-N 116.027 -0.533 . . . . 74.209999999999994 112.137 -178.435 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 16' ' ' THR . . . . . . . . . . . . . 13.9 t -151.85 173.75 14.41 Favored 'General case' 0 N--CA 1.471 0.61 0 CA-C-N 116.425 -0.352 . . . . 75.219999999999999 111.081 178.373 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . -63.75 137.66 41.89 Favored Glycine 0 CA--C 1.528 0.882 0 N-CA-C 114.253 0.461 . . . . 53.299999999999997 114.253 -177.183 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 18' ' ' LYS . . . . . 0.493 ' HA ' ' HE2' ' A' ' 18' ' ' LYS . 8.9 mmpt? -127.3 128.42 24.06 Favored Pre-proline 0 CA--C 1.544 0.747 0 O-C-N 122.68 -0.306 . . . . 75.099999999999994 111.019 -179.315 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 98.5 Cg_endo -77.9 -175.23 2.59 Favored 'Trans proline' 0 CA--C 1.543 0.951 0 C-N-CA 122.727 2.285 . . . . 74.430000000000007 113.31 179.734 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . -84.35 -2.05 89.22 Favored Glycine 0 CA--C 1.528 0.889 0 C-N-CA 121.283 -0.484 . . . . 63.549999999999997 113.315 178.777 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -123.91 -177.48 3.77 Favored 'General case' 0 N--CA 1.467 0.415 0 CA-C-O 120.709 0.29 . . . . 74.340000000000003 110.896 176.632 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 95.1 mt -113.0 133.92 21.91 Favored Pre-proline 0 N--CA 1.468 0.431 0 CA-C-O 120.624 0.25 . . . . 71.120000000000005 111.503 179.311 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 23' ' ' PRO . . . . . 0.475 ' O ' ' HG ' ' A' ' 26' ' ' LEU . 72.3 Cg_endo -75.61 135.58 18.15 Favored 'Trans proline' 0 CA--C 1.539 0.763 0 C-N-CA 122.333 2.022 . . . . 74.109999999999999 112.478 177.31 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -59.41 -16.42 23.19 Favored 'General case' 0 CA--C 1.542 0.647 0 CA-C-O 121.151 0.5 . . . . 75.329999999999998 111.707 178.657 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 25' ' ' ASN . . . . . 0.407 ' O ' ' HG3' ' A' ' 29' ' ' MET . 17.5 m120 -71.94 -2.64 18.82 Favored 'General case' 0 CA--C 1.541 0.609 0 N-CA-C 113.171 0.804 . . . . 71.340000000000003 113.171 -179.565 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 26' ' ' LEU . . . . . 0.475 ' HG ' ' O ' ' A' ' 23' ' ' PRO . 89.4 mt -54.8 -31.64 59.25 Favored 'General case' 0 N--CA 1.474 0.744 0 CA-C-O 121.415 0.626 . . . . 74.120000000000005 110.531 174.392 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 13.3 t70 -62.09 -48.81 78.51 Favored 'General case' 0 CA--C 1.542 0.654 0 CA-C-N 115.697 -0.683 . . . . 74.430000000000007 110.901 173.09 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 20.7 m-20 -66.61 -35.37 80.03 Favored 'General case' 0 CA--C 1.543 0.698 0 CA-C-N 115.983 -0.553 . . . . 75.140000000000001 111.609 -179.877 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 29' ' ' MET . . . . . 0.433 ' SD ' HD23 ' A' ' 26' ' ' LEU . 83.6 mtp -62.01 146.87 48.9 Favored 'General case' 0 CA--C 1.537 0.463 0 CA-C-O 121.249 0.547 . . . . 71.420000000000002 111.935 -178.43 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 30' ' ' LYS . . . . . 0.566 ' HB2' ' HG2' ' A' ' 33' ' ' GLU . 22.1 mtpp -75.24 170.08 16.77 Favored 'General case' 0 CA--C 1.538 0.501 0 CA-C-N 115.76 -0.655 . . . . 73.040000000000006 111.682 -176.298 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 31' ' ' VAL . . . . . 0.488 HG13 ' HE3' ' A' ' 35' ' ' LYS . 45.7 t -60.48 -46.4 95.43 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.669 0 CA-C-N 116.017 -0.538 . . . . 72.439999999999998 111.796 -177.354 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -63.99 -36.66 84.71 Favored 'General case' 0 N--CA 1.47 0.532 0 N-CA-C 112.069 0.396 . . . . 74.030000000000001 112.069 -179.785 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 33' ' ' GLU . . . . . 0.566 ' HG2' ' HB2' ' A' ' 30' ' ' LYS . 3.3 mm-40 -64.21 -45.65 87.32 Favored 'General case' 0 N--CA 1.471 0.578 0 CA-C-O 121.076 0.465 . . . . 64.230000000000004 110.806 -179.032 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 87.6 mt -59.4 -44.57 92.79 Favored 'General case' 0 CA--C 1.539 0.543 0 CA-C-N 116.032 -0.531 . . . . 71.25 110.903 177.607 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 35' ' ' LYS . . . . . 0.488 ' HE3' HG13 ' A' ' 31' ' ' VAL . 99.2 mttt -59.35 -35.87 74.68 Favored 'General case' 0 N--CA 1.469 0.488 0 CA-C-N 116.267 -0.424 . . . . 75.010000000000005 111.36 176.101 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 36' ' ' GLN . . . . . 0.504 ' O ' ' HG ' ' A' ' 40' ' ' LEU . 54.4 tp60 -59.69 -43.93 93.85 Favored 'General case' 0 CA--C 1.535 0.392 0 CA-C-N 116.371 -0.377 . . . . 71.230000000000004 111.217 178.916 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 37' ' ' GLU . . . . . 0.485 ' O ' ' HG3' ' A' ' 41' ' ' ARG . 35.1 mt-10 -67.63 -42.76 81.8 Favored 'General case' 0 CA--C 1.537 0.464 0 C-N-CA 121.082 -0.247 . . . . 75.150000000000006 111.224 176.33 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 38' ' ' LEU . . . . . . . . . . . . . 78.7 mt -52.07 -58.84 5.35 Favored 'General case' 0 N--CA 1.472 0.673 0 N-CA-C 111.863 0.32 . . . . 73.340000000000003 111.863 177.295 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 16.1 ptpt -55.98 -36.63 68.07 Favored 'General case' 0 N--CA 1.473 0.692 0 N-CA-C 111.891 0.33 . . . . 75.430000000000007 111.891 -177.999 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 40' ' ' LEU . . . . . 0.504 ' HG ' ' O ' ' A' ' 36' ' ' GLN . 92.3 mt -68.72 -29.76 68.26 Favored 'General case' 0 CA--C 1.538 0.501 0 CA-C-O 121.015 0.436 . . . . 73.129999999999995 111.33 178.083 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 41' ' ' ARG . . . . . 0.485 ' HG3' ' O ' ' A' ' 37' ' ' GLU . 53.9 mtt-85 -96.01 16.04 18.98 Favored 'General case' 0 CA--C 1.541 0.617 0 CA-C-N 116.327 -0.397 . . . . 75.409999999999997 111.454 -179.921 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 50.5 m 65.66 27.52 11.35 Favored 'General case' 0 N--CA 1.48 1.067 0 CA-C-O 121.356 0.598 . . . . 61.530000000000001 112.154 178.268 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 49.1 mt -102.28 144.75 29.22 Favored Pre-proline 0 CA--C 1.544 0.734 0 CA-C-N 116.192 -0.458 . . . . 75.120000000000005 111.385 -179.916 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 44' ' ' PRO . . . . . . . . . . . . . 57.6 Cg_endo -70.13 123.84 10.36 Favored 'Trans proline' 0 CA--C 1.542 0.888 0 C-N-CA 122.479 2.12 . . . . 72.549999999999997 112.944 178.802 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 28.3 m -82.27 -15.04 12.11 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.596 0 N-CA-C 112.853 0.686 . . . . 71.150000000000006 112.853 -174.598 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 65.9 m -71.18 79.56 0.7 Allowed 'General case' 0 N--CA 1.472 0.658 0 N-CA-C 112.358 0.503 . . . . 71.010000000000005 112.358 -178.272 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . -158.05 173.41 35.27 Favored Glycine 0 CA--C 1.526 0.764 0 C-N-CA 121.239 -0.505 . . . . 74.5 113.193 177.404 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 48' ' ' THR . . . . . 0.525 ' O ' ' HG ' ' A' ' 52' ' ' LEU . 72.3 p -77.58 158.53 29.78 Favored 'General case' 0 N--CA 1.474 0.739 0 O-C-N 122.779 -0.248 . . . . 75.219999999999999 110.715 176.808 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 60.0 tttm -49.04 -40.95 33.31 Favored 'General case' 0 N--CA 1.476 0.846 0 CA-C-O 120.729 0.299 . . . . 72.129999999999995 111.596 -177.228 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 50' ' ' THR . . . . . 0.453 ' O ' ' HG2' ' A' ' 54' ' ' GLU . 89.2 m -60.63 -54.77 41.32 Favored 'General case' 0 N--CA 1.469 0.481 0 CA-C-O 120.818 0.342 . . . . 71.349999999999994 110.96 174.714 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 10.0 mm-40 -54.5 -35.15 62.81 Favored 'General case' 0 N--CA 1.47 0.541 0 CA-C-N 116.22 -0.445 . . . . 72.409999999999997 111.971 -179.564 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 52' ' ' LEU . . . . . 0.525 ' HG ' ' O ' ' A' ' 48' ' ' THR . 46.5 mt -62.36 -49.77 74.24 Favored 'General case' 0 CA--C 1.537 0.466 0 CA-C-O 120.977 0.418 . . . . 72.5 110.912 177.962 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 53' ' ' ILE . . . . . 0.502 ' O ' ' HG3' ' A' ' 57' ' ' ARG . 66.6 mt -60.71 -51.61 71.13 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.481 0 CA-C-N 116.149 -0.478 . . . . 74.120000000000005 110.847 177.757 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 54' ' ' GLU . . . . . 0.453 ' HG2' ' O ' ' A' ' 50' ' ' THR . 7.5 mm-40 -55.54 -40.75 72.26 Favored 'General case' 0 N--CA 1.47 0.548 0 CA-C-O 121.155 0.503 . . . . 74.510000000000005 111.205 178.778 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 23.7 ttm180 -67.37 -38.6 85.0 Favored 'General case' 0 CA--C 1.536 0.428 0 CA-C-N 116.048 -0.524 . . . . 75.040000000000006 111.333 -178.685 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 89.7 mt -60.63 -41.45 94.92 Favored 'General case' 0 CA--C 1.535 0.401 0 CA-C-O 120.916 0.388 . . . . 72.209999999999994 110.555 172.292 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 57' ' ' ARG . . . . . 0.502 ' HG3' ' O ' ' A' ' 53' ' ' ILE . 44.2 mtm180 -60.98 -53.99 50.42 Favored 'General case' 0 C--O 1.221 -0.41 0 CA-C-N 116.29 -0.413 . . . . 74.299999999999997 111.018 177.902 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 58' ' ' ALA . . . . . 0.425 ' O ' ' HG3' ' A' ' 62' ' ' GLN . . . -49.74 -48.82 49.85 Favored 'General case' 0 N--CA 1.471 0.582 0 N-CA-C 112.302 0.482 . . . . 71.239999999999995 112.302 -178.518 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 59' ' ' TYR . . . . . . . . . . . . . 70.1 t80 -57.63 -56.83 16.79 Favored 'General case' 0 CA--C 1.54 0.587 0 CA-C-O 120.94 0.4 . . . . 64.420000000000002 111.714 178.022 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 60' ' ' GLN . . . . . 0.522 ' NE2' ' HB2' ' A' ' 64' ' ' SER . 25.7 tm0? -66.47 -31.99 73.08 Favored 'General case' 0 CA--C 1.545 0.774 0 CA-C-N 116.131 -0.486 . . . . 62.229999999999997 111.485 -176.825 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 61' ' ' ASP . . . . . . . . . . . . . 32.6 t70 -64.34 -30.29 71.34 Favored 'General case' 0 CA--C 1.541 0.616 0 C-N-CA 123.267 0.627 . . . . 75.329999999999998 112.032 -177.622 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 62' ' ' GLN . . . . . 0.425 ' HG3' ' O ' ' A' ' 58' ' ' ALA . 47.2 mt-30 -58.22 -39.29 78.68 Favored 'General case' 0 N--CA 1.472 0.652 0 CA-C-O 120.93 0.395 . . . . 74.129999999999995 111.61 179.712 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 63' ' ' ILE . . . . . . . . . . . . . 29.7 pt -102.47 -17.3 7.05 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.607 0 N-CA-C 112.258 0.466 . . . . 71.430000000000007 112.258 -178.778 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 64' ' ' SER . . . . . 0.522 ' HB2' ' NE2' ' A' ' 60' ' ' GLN . 32.0 t -71.69 140.75 84.3 Favored Pre-proline 0 N--CA 1.472 0.664 0 N-CA-C 111.926 0.343 . . . . 73.040000000000006 111.926 -178.549 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 65' ' ' PRO . . . . . . . . . . . . . 53.0 Cg_exo -56.36 97.77 0.07 OUTLIER 'Trans proline' 0 CA--C 1.54 0.804 0 C-N-CA 122.512 2.141 . . . . 63.119999999999997 112.273 173.7 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 66' ' ' VAL . . . . . . . . . . . . . 26.7 m -81.82 148.63 61.72 Favored Pre-proline 0 CA--C 1.54 0.589 0 CA-C-N 116.437 -0.347 . . . . 62.240000000000002 111.595 -178.9 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 67' ' ' PRO . . . . . . . . . . . . . 73.8 Cg_endo -73.9 64.92 5.02 Favored 'Trans proline' 0 CA--C 1.545 1.044 0 C-N-CA 122.707 2.271 . . . . 73.239999999999995 113.182 -179.151 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 73.29 56.03 5.87 Favored Glycine 0 CA--C 1.529 0.918 0 C-N-CA 120.995 -0.621 . . . . 51.100000000000001 112.925 -178.56 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . 68.17 137.52 0.05 OUTLIER Pre-proline 0 N--CA 1.474 0.773 0 C-N-CA 123.355 0.662 . . . . 71.129999999999995 112.346 -176.459 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 70' ' ' PRO . . . . . . . . . . . . . 32.8 Cg_endo -63.3 128.77 23.49 Favored 'Trans proline' 0 CA--C 1.54 0.805 0 C-N-CA 122.364 2.043 . . . . 72.140000000000001 112.501 177.236 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 56.1 tptt -63.92 -40.96 97.67 Favored 'General case' 0 CA--C 1.539 0.535 0 CA-C-N 116.463 -0.335 . . . . 75.209999999999994 111.873 -177.668 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -83.81 121.56 76.08 Favored Pre-proline 0 CA--C 1.54 0.593 0 CA-C-O 120.609 0.242 . . . . 72.349999999999994 111.648 179.971 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 73' ' ' PRO . . . . . . . . . . . . . 37.7 Cg_endo -65.46 113.86 2.65 Favored 'Trans proline' 0 CA--C 1.542 0.877 0 C-N-CA 122.34 2.027 . . . . 63.119999999999997 112.67 179.557 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -57.43 117.52 4.22 Favored 'General case' 0 CA--C 1.538 0.511 0 N-CA-C 112.425 0.528 . . . . 72.340000000000003 112.425 -178.176 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.25 1.117 0 CA-C-O 119.08 -0.486 . . . . 65.409999999999997 111.743 178.879 . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 62.5 mtm . . . . . 0 N--CA 1.492 1.642 0 CA-C-O 120.604 0.24 . . . . 71.519999999999996 110.962 . . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . 147.11 157.78 7.53 Favored Glycine 0 CA--C 1.525 0.686 0 C-N-CA 120.998 -0.62 . . . . 65.239999999999995 113.388 178.103 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 3' ' ' HIS . . . . . . . . . . . . . 52.4 p-80 -163.53 117.17 1.55 Allowed 'General case' 0 CA--C 1.537 0.453 0 CA-C-O 120.744 0.307 . . . . 73.209999999999994 111.226 179.456 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 4' ' ' HIS . . . . . . . . . . . . . 9.8 p80 -64.87 127.55 32.03 Favored 'General case' 0 CA--C 1.539 0.526 0 O-C-N 122.25 -0.281 . . . . 64.209999999999994 110.383 176.868 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 5' ' ' HIS . . . . . . . . . . . . . 29.0 t-80 -62.12 112.89 2.55 Favored 'General case' 0 CA--C 1.54 0.585 0 CA-C-O 120.638 0.256 . . . . 72.329999999999998 111.639 -177.672 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 9.4 p-80 -107.65 173.08 6.48 Favored 'General case' 0 CA--C 1.54 0.579 0 CA-C-O 121.083 0.468 . . . . 75.409999999999997 111.693 178.52 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 31.6 p-80 -149.5 175.4 11.53 Favored 'General case' 0 N--CA 1.469 0.514 0 CA-C-O 120.961 0.41 . . . . 72.310000000000002 111.609 -177.916 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 8' ' ' HIS . . . . . . . . . . . . . 71.9 m80 -94.36 131.99 39.44 Favored 'General case' 0 CA--C 1.538 0.504 0 CA-C-N 116.405 -0.361 . . . . 72.200000000000003 110.894 176.127 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 70.0 m -103.16 137.33 41.45 Favored 'General case' 0 N--CA 1.473 0.685 0 CA-C-O 120.765 0.317 . . . . 75.519999999999996 111.09 178.557 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 42.7 p-80 -103.32 132.52 49.51 Favored 'General case' 0 N--CA 1.472 0.67 0 CA-C-O 120.62 0.247 . . . . 72.439999999999998 111.288 -178.457 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 11' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -125.84 179.27 5.27 Favored 'General case' 0 N--CA 1.471 0.618 0 CA-C-O 120.814 0.34 . . . . 72.439999999999998 111.581 179.682 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 65.1 p -131.02 150.49 52.12 Favored 'General case' 0 N--CA 1.475 0.821 0 CA-C-O 120.931 0.396 . . . . 64.319999999999993 111.608 -178.8 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 13' ' ' THR . . . . . . . . . . . . . 76.8 p -86.11 127.23 62.58 Favored Pre-proline 0 N--CA 1.472 0.663 0 N-CA-C 112.117 0.414 . . . . 74.530000000000001 112.117 -178.924 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 14' ' ' PRO . . . . . . . . . . . . . 30.5 Cg_endo -63.11 105.73 0.49 Allowed 'Trans proline' 0 CA--C 1.54 0.822 0 C-N-CA 122.778 2.319 . . . . 74.140000000000001 113.001 178.333 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 2.7 pp -79.11 156.22 28.39 Favored 'General case' 0 N--CA 1.472 0.657 0 CA-C-O 120.907 0.384 . . . . 65.420000000000002 111.994 179.82 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 16' ' ' THR . . . . . . . . . . . . . 63.5 p -95.37 -48.67 5.78 Favored 'General case' 0 N--CA 1.475 0.809 0 CA-C-O 121.084 0.468 . . . . 73.409999999999997 112.028 -177.844 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . 88.81 -58.32 4.04 Favored Glycine 0 CA--C 1.529 0.928 0 C-N-CA 121.313 -0.47 . . . . 71.019999999999996 113.171 179.764 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 18' ' ' LYS . . . . . 0.777 ' HZ3' ' HB3' ' A' ' 18' ' ' LYS . 0.3 OUTLIER -115.38 137.52 23.13 Favored Pre-proline 0 N--CA 1.471 0.617 0 O-C-N 122.536 -0.39 . . . . 73.439999999999998 111.62 -179.54 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 19' ' ' PRO . . . . . 0.409 ' HD3' ' HA ' ' A' ' 18' ' ' LYS . 35.7 Cg_exo -62.79 134.23 45.91 Favored 'Trans proline' 0 CA--C 1.543 0.933 0 C-N-CA 123.173 2.582 . . . . 72.420000000000002 113.558 -179.359 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . -83.94 88.26 1.53 Allowed Glycine 0 CA--C 1.531 1.051 0 C-N-CA 121.515 -0.374 . . . . 61.240000000000002 113.186 178.797 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -126.1 -170.39 2.18 Favored 'General case' 0 N--CA 1.47 0.565 0 CA-C-O 120.86 0.362 . . . . 73.030000000000001 111.572 -179.123 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 22' ' ' LEU . . . . . 0.447 ' HG ' ' HG3' ' A' ' 60' ' ' GLN . 95.9 mt -105.24 156.5 36.12 Favored Pre-proline 0 N--CA 1.471 0.615 0 CA-C-N 116.417 -0.356 . . . . 75.329999999999998 111.378 176.29 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 23' ' ' PRO . . . . . 0.421 ' HD2' HD21 ' A' ' 26' ' ' LEU . 39.3 Cg_exo -62.44 140.41 81.97 Favored 'Trans proline' 0 CA--C 1.543 0.97 0 C-N-CA 122.195 1.93 . . . . 73.430000000000007 112.249 171.562 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -60.66 -55.35 34.32 Favored 'General case' 0 CA--C 1.541 0.6 0 N-CA-C 112.235 0.458 . . . . 75.140000000000001 112.235 -178.907 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 61.7 m-20 -91.84 84.84 5.44 Favored 'General case' 0 CA--C 1.536 0.43 0 CA-C-O 120.914 0.388 . . . . 75.329999999999998 111.813 -177.021 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 26' ' ' LEU . . . . . 0.421 HD21 ' HD2' ' A' ' 23' ' ' PRO . 98.6 mt -84.12 -32.98 24.42 Favored 'General case' 0 CA--C 1.538 0.496 0 CA-C-O 120.881 0.372 . . . . 73.5 111.062 176.886 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 4.7 m-20 -66.29 -40.81 90.29 Favored 'General case' 0 CA--C 1.538 0.517 0 CA-C-N 116.308 -0.406 . . . . 71.299999999999997 111.562 -179.898 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 1.9 m-20 -60.39 -44.65 95.46 Favored 'General case' 0 CA--C 1.538 0.494 0 CA-C-N 116.21 -0.45 . . . . 65.329999999999998 112.05 179.506 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 29' ' ' MET . . . . . . . . . . . . . 59.0 mtm -66.46 157.48 31.94 Favored 'General case' 0 CA--C 1.54 0.573 0 CA-C-O 120.995 0.426 . . . . 63.240000000000002 111.429 179.874 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 30' ' ' LYS . . . . . 0.459 ' HB2' ' HG2' ' A' ' 33' ' ' GLU . 46.5 mtmt -78.71 160.88 27.25 Favored 'General case' 0 N--CA 1.47 0.551 0 CA-C-O 120.978 0.418 . . . . 74.510000000000005 111.902 -174.659 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 31' ' ' VAL . . . . . 0.412 HG13 ' HE3' ' A' ' 35' ' ' LYS . 47.9 t -54.8 -40.34 51.76 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.547 0 CA-C-O 121.19 0.519 . . . . 72.109999999999999 110.941 177.011 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -59.59 -39.44 84.18 Favored 'General case' 0 CA--C 1.54 0.565 0 CA-C-N 116.043 -0.526 . . . . 74.430000000000007 111.656 176.834 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 33' ' ' GLU . . . . . 0.459 ' HG2' ' HB2' ' A' ' 30' ' ' LYS . 45.8 mm-40 -64.27 -45.89 86.11 Favored 'General case' 0 CA--C 1.537 0.444 0 CA-C-O 121.195 0.522 . . . . 62.009999999999998 110.559 178.134 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 94.3 mt -59.5 -40.78 88.16 Favored 'General case' 0 N--CA 1.468 0.442 0 CA-C-N 115.963 -0.562 . . . . 73.519999999999996 111.484 178.597 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 35' ' ' LYS . . . . . 0.425 ' HA ' HD11 ' A' ' 38' ' ' LEU . 99.6 mttt -61.6 -36.93 82.11 Favored 'General case' 0 CA--C 1.538 0.517 0 CA-C-O 121.022 0.439 . . . . 71.109999999999999 111.428 177.082 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 36' ' ' GLN . . . . . 0.404 ' O ' ' HG2' ' A' ' 39' ' ' LYS . 8.4 tm0? -63.58 -42.38 98.3 Favored 'General case' 0 CA--C 1.539 0.555 0 CA-C-O 121.105 0.479 . . . . 74.430000000000007 110.748 174.357 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 37' ' ' GLU . . . . . 0.406 ' HA ' HH21 ' A' ' 41' ' ' ARG . 18.0 mm-40 -65.16 -40.52 94.44 Favored 'General case' 0 CA--C 1.541 0.6 0 CA-C-N 116.437 -0.347 . . . . 73.239999999999995 111.775 175.433 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 38' ' ' LEU . . . . . 0.494 HD12 HD22 ' A' ' 52' ' ' LEU . 86.0 mt -57.0 -52.74 64.06 Favored 'General case' 0 N--CA 1.468 0.464 0 N-CA-C 112.142 0.423 . . . . 73.099999999999994 112.142 179.377 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 39' ' ' LYS . . . . . 0.404 ' HG2' ' O ' ' A' ' 36' ' ' GLN . 17.6 ptpt -58.3 -33.92 69.98 Favored 'General case' 0 CA--C 1.542 0.64 0 CA-C-O 120.757 0.313 . . . . 75.540000000000006 111.737 -178.135 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 65.4 mt -69.06 -22.5 64.02 Favored 'General case' 0 N--CA 1.471 0.615 0 CA-C-O 121.016 0.436 . . . . 73.430000000000007 111.373 176.119 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 41' ' ' ARG . . . . . 0.412 HH11 ' HD2' ' A' ' 41' ' ' ARG . 0.6 OUTLIER -101.8 14.16 32.77 Favored 'General case' 0 CA--C 1.543 0.687 0 CA-C-N 116.12 -0.491 . . . . 73.140000000000001 111.415 178.354 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 62.5 m 63.01 18.84 11.24 Favored 'General case' 0 N--CA 1.48 1.058 0 CA-C-O 121.107 0.48 . . . . 72.230000000000004 112.237 -179.178 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 76.3 mt -93.14 146.64 32.32 Favored Pre-proline 0 CA--C 1.542 0.64 0 C-N-CA 122.714 0.406 . . . . 73.230000000000004 111.526 -179.131 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 44' ' ' PRO . . . . . . . . . . . . . 73.8 Cg_endo -73.26 145.51 38.88 Favored 'Trans proline' 0 CA--C 1.541 0.841 0 C-N-CA 122.58 2.187 . . . . 61.43 112.799 178.092 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 34.1 m -88.93 19.08 0.59 Allowed 'Isoleucine or valine' 0 CA--C 1.544 0.733 0 N-CA-C 112.583 0.586 . . . . 74.409999999999997 112.583 -175.439 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 46.7 t -100.49 104.15 15.52 Favored 'General case' 0 N--CA 1.475 0.787 0 CA-C-O 120.814 0.34 . . . . 61.399999999999999 111.724 -177.929 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 171.24 -175.22 44.9 Favored Glycine 0 CA--C 1.527 0.817 0 C-N-CA 121.052 -0.594 . . . . 54.310000000000002 113.417 178.844 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 48' ' ' THR . . . . . 0.534 ' O ' ' HG ' ' A' ' 52' ' ' LEU . 43.8 p -96.98 169.2 9.99 Favored 'General case' 0 N--CA 1.472 0.666 0 O-C-N 122.661 -0.317 . . . . 74.400000000000006 111.537 -179.957 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 21.4 tptm -50.16 -55.22 15.97 Favored 'General case' 0 N--CA 1.473 0.683 0 N-CA-C 111.924 0.342 . . . . 71.129999999999995 111.924 -179.686 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 50' ' ' THR . . . . . 0.427 ' O ' ' HG2' ' A' ' 54' ' ' GLU . 91.5 m -63.64 -43.77 95.82 Favored 'General case' 0 N--CA 1.471 0.583 0 CA-C-O 120.791 0.329 . . . . 75.349999999999994 111.536 178.049 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 51' ' ' GLU . . . . . 0.405 ' HB2' ' OG1' ' A' ' 48' ' ' THR . 2.6 tm-20 -55.19 -54.74 39.53 Favored 'General case' 0 CA--C 1.539 0.557 0 C-N-CA 122.896 0.478 . . . . 64.010000000000005 111.838 -177.656 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 52' ' ' LEU . . . . . 0.534 ' HG ' ' O ' ' A' ' 48' ' ' THR . 40.8 mt -55.12 -39.39 69.34 Favored 'General case' 0 N--CA 1.471 0.583 0 CA-C-O 120.902 0.382 . . . . 75.430000000000007 111.851 -177.15 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 53' ' ' ILE . . . . . . . . . . . . . 77.9 mt -61.41 -45.01 99.5 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.442 0 CA-C-O 121.31 0.576 . . . . 73.209999999999994 110.821 175.364 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 54' ' ' GLU . . . . . 0.456 ' CD ' HH21 ' A' ' 57' ' ' ARG . 8.9 mm-40 -64.93 -35.45 81.2 Favored 'General case' 0 N--CA 1.468 0.426 0 CA-C-N 115.772 -0.649 . . . . 63.350000000000001 111.207 179.064 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 55' ' ' ARG . . . . . 0.437 HH11 ' HD3' ' A' ' 55' ' ' ARG . 13.2 ttm180 -68.61 -39.76 80.69 Favored 'General case' 0 CA--C 1.541 0.599 0 CA-C-N 116.16 -0.473 . . . . 74.25 110.647 178.165 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 59.1 mt -59.75 -53.23 60.34 Favored 'General case' 0 N--CA 1.47 0.559 0 CA-C-N 116.293 -0.412 . . . . 72.140000000000001 111.228 174.138 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 57' ' ' ARG . . . . . 0.456 HH21 ' CD ' ' A' ' 54' ' ' GLU . 40.5 mtm105 -57.38 -45.89 83.97 Favored 'General case' 0 CA--C 1.537 0.47 0 CA-C-O 120.687 0.279 . . . . 75.040000000000006 111.442 179.594 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 58' ' ' ALA . . . . . 0.421 ' O ' ' HG3' ' A' ' 62' ' ' GLN . . . -60.33 -34.39 73.75 Favored 'General case' 0 N--CA 1.47 0.531 0 N-CA-C 112.115 0.413 . . . . 64.340000000000003 112.115 -179.624 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 59' ' ' TYR . . . . . . . . . . . . . 71.2 t80 -75.27 -54.17 7.53 Favored 'General case' 0 CA--C 1.539 0.549 0 CA-C-O 120.962 0.411 . . . . 74.219999999999999 111.555 179.176 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 60' ' ' GLN . . . . . 0.447 ' HG3' ' HG ' ' A' ' 22' ' ' LEU . 24.4 tm0? -60.26 -32.57 71.29 Favored 'General case' 0 CA--C 1.542 0.66 0 CA-C-O 120.923 0.392 . . . . 73.310000000000002 111.072 -177.865 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 61' ' ' ASP . . . . . . . . . . . . . 15.8 t70 -57.53 -29.96 64.79 Favored 'General case' 0 CA--C 1.545 0.756 0 C-N-CA 122.977 0.511 . . . . 70.530000000000001 111.909 175.169 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 62' ' ' GLN . . . . . 0.421 ' HG3' ' O ' ' A' ' 58' ' ' ALA . 68.9 mt-30 -80.3 -35.37 35.84 Favored 'General case' 0 N--CA 1.473 0.68 0 CA-C-O 120.889 0.376 . . . . 64.329999999999998 112.002 -177.487 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 63' ' ' ILE . . . . . . . . . . . . . 34.1 pt -86.59 -21.45 7.4 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.576 0 CA-C-O 120.876 0.37 . . . . 63.229999999999997 111.818 -179.356 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 41.2 t -94.04 134.12 26.48 Favored Pre-proline 0 N--CA 1.471 0.604 0 CA-C-N 116.553 -0.294 . . . . 70.040000000000006 111.36 179.703 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 65' ' ' PRO . . . . . . . . . . . . . 38.1 Cg_exo -58.09 104.57 0.18 Allowed 'Trans proline' 0 C--N 1.353 0.765 0 C-N-CA 122.582 2.188 . . . . 73.230000000000004 112.857 177.868 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 66' ' ' VAL . . . . . 0.536 ' HB ' ' HD2' ' A' ' 67' ' ' PRO . 35.1 m -68.03 160.78 72.6 Favored Pre-proline 0 CA--C 1.542 0.672 0 CA-C-N 116.259 -0.428 . . . . 73.329999999999998 111.182 178.994 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 67' ' ' PRO . . . . . 0.536 ' HD2' ' HB ' ' A' ' 66' ' ' VAL . 10.9 Cg_endo -53.21 -25.31 29.45 Favored 'Trans proline' 0 CA--C 1.544 0.997 0 C-N-CA 122.488 2.125 . . . . 54.119999999999997 113.809 -178.081 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . -83.53 -20.14 60.7 Favored Glycine 0 CA--C 1.528 0.887 0 C-N-CA 121.133 -0.556 . . . . 63.140000000000001 113.358 178.237 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . -92.94 154.37 41.87 Favored Pre-proline 0 CA--C 1.542 0.639 0 O-C-N 122.49 -0.418 . . . . 73.310000000000002 111.598 -178.137 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 70' ' ' PRO . . . . . . . . . . . . . 89.8 Cg_endo -79.36 153.14 23.97 Favored 'Trans proline' 0 CA--C 1.542 0.899 0 C-N-CA 122.579 2.186 . . . . 72.349999999999994 112.785 175.921 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 4.0 mppt? -86.37 136.59 33.07 Favored 'General case' 0 N--CA 1.47 0.566 0 O-C-N 122.341 -0.224 . . . . 71.310000000000002 110.97 178.403 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . 69.79 85.74 0.13 Allowed Pre-proline 0 N--CA 1.472 0.653 0 C-N-CA 123.133 0.573 . . . . 73.420000000000002 111.747 -174.978 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 73' ' ' PRO . . . . . . . . . . . . . 94.4 Cg_endo -77.37 -154.95 0.05 OUTLIER 'Trans proline' 0 CA--C 1.541 0.864 0 C-N-CA 122.841 2.361 . . . . 74.409999999999997 112.672 178.764 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -60.83 90.78 0.02 OUTLIER 'General case' 0 CA--C 1.541 0.606 0 CA-C-O 120.977 0.418 . . . . 72.299999999999997 111.995 178.752 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.254 1.32 0 CA-C-O 118.826 -0.607 . . . . 72.219999999999999 111.685 177.765 . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' A' A ' 1' ' ' MET . . . . . 0.566 ' SD ' ' N ' ' A' ' 1' ' ' MET . 1.2 mpt? . . . . . 0 N--CA 1.491 1.587 0 CA-C-O 120.752 0.31 . . . . 74.230000000000004 111.248 . . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . -92.45 96.41 2.14 Favored Glycine 0 CA--C 1.528 0.853 0 C-N-CA 121.2 -0.524 . . . . 61.350000000000001 112.7 177.817 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 3' ' ' HIS . . . . . . . . . . . . . 0.8 OUTLIER -60.95 -21.52 63.54 Favored 'General case' 0 N--CA 1.473 0.678 0 N-CA-C 112.558 0.577 . . . . 61.25 112.558 -178.514 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 4' ' ' HIS . . . . . . . . . . . . . 86.1 m-70 -141.34 102.49 4.23 Favored 'General case' 0 N--CA 1.47 0.53 0 CA-C-O 120.967 0.413 . . . . 62.539999999999999 110.614 175.761 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 5' ' ' HIS . . . . . . . . . . . . . 58.1 m80 -74.88 113.23 11.93 Favored 'General case' 0 CA--C 1.538 0.487 0 CA-C-O 121.122 0.486 . . . . 75.319999999999993 111.726 -177.52 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 73.6 m80 -85.81 125.53 33.34 Favored 'General case' 0 CA--C 1.535 0.396 0 CA-C-N 116.185 -0.462 . . . . 72.530000000000001 111.105 -179.334 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 80.0 m80 -75.37 120.16 20.45 Favored 'General case' 0 CA--C 1.537 0.473 0 CA-C-O 121.046 0.451 . . . . 65.329999999999998 111.155 179.092 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 8' ' ' HIS . . . . . . . . . . . . . 49.6 m80 -79.87 116.1 19.83 Favored 'General case' 0 CA--C 1.538 0.509 0 CA-C-N 116.224 -0.444 . . . . 71.219999999999999 112.073 -176.489 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 32.5 t -160.68 148.5 16.02 Favored 'General case' 0 N--CA 1.469 0.495 0 CA-C-N 116.318 -0.401 . . . . 71.340000000000003 110.759 176.162 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 33.2 m80 -82.92 166.68 18.68 Favored 'General case' 0 CA--C 1.538 0.496 0 CA-C-O 121.263 0.554 . . . . 64.310000000000002 111.945 -176.048 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 11' ' ' MET . . . . . . . . . . . . . 76.7 mmm -104.53 6.3 34.59 Favored 'General case' 0 CA--C 1.54 0.572 0 CA-C-N 115.671 -0.695 . . . . 74.019999999999996 110.77 174.965 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 51.0 m -76.73 -162.01 0.24 Allowed 'General case' 0 CA--C 1.542 0.66 0 CA-C-N 116.027 -0.533 . . . . 74.200000000000003 111.921 -178.312 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 13' ' ' THR . . . . . . . . . . . . . 70.9 p -57.75 136.39 82.99 Favored Pre-proline 0 N--CA 1.471 0.594 0 N-CA-C 111.946 0.35 . . . . 72.019999999999996 111.946 178.984 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 14' ' ' PRO . . . . . . . . . . . . . 32.0 Cg_exo -59.27 157.1 31.87 Favored 'Trans proline' 0 CA--C 1.54 0.785 0 C-N-CA 122.631 2.221 . . . . 73.109999999999999 112.963 177.888 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 72.4 mt -79.69 166.14 22.12 Favored 'General case' 0 CA--C 1.536 0.413 0 CA-C-O 121.02 0.438 . . . . 74.299999999999997 111.596 -179.733 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 16' ' ' THR . . . . . . . . . . . . . 9.0 t -121.4 140.6 51.92 Favored 'General case' 0 N--CA 1.471 0.589 0 CA-C-O 121.094 0.473 . . . . 75.010000000000005 111.559 179.904 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . -90.18 -179.75 44.04 Favored Glycine 0 CA--C 1.527 0.844 0 C-N-CA 120.992 -0.623 . . . . 35.25 113.53 -179.881 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 57.0 mtmt -113.31 146.28 34.98 Favored Pre-proline 0 CA--C 1.543 0.678 0 O-C-N 122.581 -0.364 . . . . 72.530000000000001 111.317 178.995 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 63.7 Cg_endo -72.4 155.13 55.81 Favored 'Trans proline' 0 CA--C 1.543 0.928 0 C-N-CA 122.652 2.235 . . . . 71.299999999999997 113.136 179.861 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . -77.03 65.46 2.97 Favored Glycine 0 CA--C 1.527 0.839 0 CA-C-N 116.217 -0.447 . . . . 35.25 113.097 179.759 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -166.02 -172.31 2.27 Favored 'General case' 0 N--CA 1.468 0.429 0 C-N-CA 122.785 0.434 . . . . 73.400000000000006 110.513 -178.747 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 22' ' ' LEU . . . . . 0.54 ' HG ' ' HG3' ' A' ' 60' ' ' GLN . 97.2 mt -60.47 135.74 91.82 Favored Pre-proline 0 CA--C 1.539 0.527 0 N-CA-C 111.83 0.308 . . . . 73.329999999999998 111.83 178.25 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 23' ' ' PRO . . . . . 0.442 ' O ' ' HG ' ' A' ' 26' ' ' LEU . 39.8 Cg_endo -67.82 120.7 7.71 Favored 'Trans proline' 0 CA--C 1.539 0.735 0 C-N-CA 122.186 1.924 . . . . 71.420000000000002 111.715 174.409 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -57.06 -11.95 1.84 Allowed 'General case' 0 N--CA 1.475 0.798 0 N-CA-C 112.861 0.689 . . . . 65.540000000000006 112.861 -177.201 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 25' ' ' ASN . . . . . 0.53 ' HB3' ' HB2' ' A' ' 28' ' ' ASP . 18.8 m120 -92.38 33.76 1.08 Allowed 'General case' 0 CA--C 1.542 0.651 0 N-CA-C 112.265 0.468 . . . . 72.430000000000007 112.265 179.408 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 26' ' ' LEU . . . . . 0.442 ' HG ' ' O ' ' A' ' 23' ' ' PRO . 95.6 mt -54.23 -33.16 57.73 Favored 'General case' 0 N--CA 1.474 0.762 0 CA-C-O 120.785 0.326 . . . . 74.040000000000006 111.859 -179.671 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 11.3 m-20 -69.15 -38.94 79.04 Favored 'General case' 0 N--CA 1.47 0.548 0 CA-C-O 120.826 0.346 . . . . 73.530000000000001 111.554 175.159 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 28' ' ' ASP . . . . . 0.53 ' HB2' ' HB3' ' A' ' 25' ' ' ASN . 6.3 m-20 -69.64 -32.61 71.38 Favored 'General case' 0 CA--C 1.539 0.549 0 CA-C-N 116.285 -0.416 . . . . 71.439999999999998 111.319 179.057 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 29' ' ' MET . . . . . . . . . . . . . 84.2 mtp -66.32 140.33 58.1 Favored 'General case' 0 N--CA 1.468 0.426 0 CA-C-O 121.001 0.429 . . . . 74.530000000000001 111.307 178.82 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 55.1 mtmt -79.1 158.94 27.7 Favored 'General case' 0 CA--C 1.541 0.605 0 CA-C-O 120.945 0.403 . . . . 72.329999999999998 111.899 -177.892 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 94.9 t -49.58 -49.26 19.45 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.7 0 N-CA-C 112.842 0.682 . . . . 61.310000000000002 112.842 -176.097 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -57.92 -37.69 74.53 Favored 'General case' 0 N--CA 1.469 0.524 0 CA-C-O 120.855 0.359 . . . . 70.239999999999995 111.591 179.657 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 40.6 mt-10 -65.84 -48.55 71.26 Favored 'General case' 0 N--CA 1.466 0.338 0 CA-C-N 116.214 -0.448 . . . . 73.540000000000006 111.172 178.347 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 91.5 mt -58.55 -45.37 89.07 Favored 'General case' 0 N--CA 1.469 0.477 0 CA-C-O 120.965 0.412 . . . . 74.420000000000002 111.293 178.25 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 35' ' ' LYS . . . . . 0.475 ' HA ' HD13 ' A' ' 38' ' ' LEU . 98.0 mttt -62.83 -31.28 72.25 Favored 'General case' 0 CA--C 1.54 0.592 0 CA-C-O 121.003 0.43 . . . . 74.340000000000003 111.565 177.159 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 23.7 tm0? -70.05 -43.91 70.24 Favored 'General case' 0 CA--C 1.542 0.656 0 CA-C-O 121.06 0.457 . . . . 75.25 109.85 175.192 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 37' ' ' GLU . . . . . 0.473 ' HB3' ' NH2' ' A' ' 41' ' ' ARG . 52.8 mm-40 -58.15 -32.66 68.39 Favored 'General case' 0 N--CA 1.473 0.682 0 CA-C-N 115.945 -0.571 . . . . 72.230000000000004 111.86 174.436 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 38' ' ' LEU . . . . . 0.475 HD13 ' HA ' ' A' ' 35' ' ' LYS . 99.1 mt -69.45 -58.23 4.25 Favored 'General case' 0 CA--C 1.539 0.547 0 CA-C-N 116.289 -0.414 . . . . 65.120000000000005 111.913 178.116 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 39' ' ' LYS . . . . . 0.74 ' HZ3' ' HB3' ' A' ' 39' ' ' LYS . 0.3 OUTLIER -57.83 -31.62 66.82 Favored 'General case' 0 N--CA 1.474 0.741 0 N-CA-C 112.373 0.508 . . . . 75.409999999999997 112.373 -174.059 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 95.9 mt -58.96 -35.2 72.76 Favored 'General case' 0 N--CA 1.474 0.74 0 CA-C-O 121.18 0.514 . . . . 75.310000000000002 111.764 176.908 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 41' ' ' ARG . . . . . 0.5 ' HB3' ' CE2' ' A' ' 59' ' ' TYR . 16.5 mtm180 -114.21 34.25 4.79 Favored 'General case' 0 CA--C 1.54 0.573 0 CA-C-N 116.034 -0.53 . . . . 74.319999999999993 112.366 -173.505 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 32.4 t 69.05 10.17 7.77 Favored 'General case' 0 N--CA 1.479 0.99 0 N-CA-C 113.048 0.759 . . . . 74.0 113.048 172.482 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 43' ' ' LEU . . . . . 0.41 HD23 ' HG2' ' A' ' 55' ' ' ARG . 83.4 mt -88.8 142.0 30.28 Favored Pre-proline 0 CA--C 1.543 0.676 0 N-CA-C 112.126 0.417 . . . . 72.349999999999994 112.126 -177.562 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 44' ' ' PRO . . . . . 0.444 ' HG2' HH11 ' A' ' 55' ' ' ARG . 75.6 Cg_endo -76.05 143.38 25.81 Favored 'Trans proline' 0 CA--C 1.544 0.988 0 C-N-CA 123.036 2.491 . . . . 65.329999999999998 113.362 178.754 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 25.8 m -97.57 -0.05 10.47 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.711 0 N-CA-C 112.716 0.636 . . . . 64.040000000000006 112.716 -176.006 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 19.7 p -79.83 45.89 0.74 Allowed 'General case' 0 N--CA 1.475 0.806 0 N-CA-C 112.866 0.691 . . . . 64.409999999999997 112.866 -176.258 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . -131.54 173.77 20.35 Favored Glycine 0 CA--C 1.531 1.032 0 C-N-CA 121.079 -0.582 . . . . 73.099999999999994 113.6 179.607 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 48' ' ' THR . . . . . 0.578 ' O ' ' HG ' ' A' ' 52' ' ' LEU . 68.7 p -81.43 173.45 12.42 Favored 'General case' 0 N--CA 1.473 0.7 0 C-N-CA 122.487 0.315 . . . . 74.030000000000001 111.287 177.548 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 24.3 tptm -50.17 -50.38 49.35 Favored 'General case' 0 N--CA 1.473 0.709 0 CA-C-O 120.829 0.347 . . . . 75.5 111.599 -179.871 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 50' ' ' THR . . . . . . . . . . . . . 86.5 m -62.84 -39.93 95.88 Favored 'General case' 0 N--CA 1.47 0.542 0 CA-C-N 116.351 -0.386 . . . . 74.219999999999999 111.368 177.365 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 61.4 mm-40 -61.06 -42.2 98.05 Favored 'General case' 0 N--CA 1.469 0.501 0 N-CA-C 111.892 0.33 . . . . 71.340000000000003 111.892 178.423 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 52' ' ' LEU . . . . . 0.578 ' HG ' ' O ' ' A' ' 48' ' ' THR . 31.4 mt -58.16 -49.84 75.62 Favored 'General case' 0 CA--C 1.538 0.519 0 CA-C-O 121.323 0.582 . . . . 72.329999999999998 110.294 177.999 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 53' ' ' ILE . . . . . 0.452 ' O ' ' HG3' ' A' ' 57' ' ' ARG . 72.5 mt -63.4 -55.71 21.42 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.666 0 CA-C-N 115.623 -0.717 . . . . 64.340000000000003 111.944 179.704 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 15.3 mm-40 -59.39 -42.36 91.55 Favored 'General case' 0 N--CA 1.472 0.663 0 N-CA-C 112.233 0.457 . . . . 72.219999999999999 112.233 -177.96 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 55' ' ' ARG . . . . . 0.444 HH11 ' HG2' ' A' ' 44' ' ' PRO . 10.5 ttm180 -66.11 -35.23 79.95 Favored 'General case' 0 CA--C 1.539 0.553 0 CA-C-O 120.892 0.377 . . . . 65.120000000000005 110.792 -178.743 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 45.8 mt -63.04 -51.48 66.57 Favored 'General case' 0 N--CA 1.469 0.507 0 CA-C-N 116.355 -0.384 . . . . 75.420000000000002 111.254 172.696 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 57' ' ' ARG . . . . . 0.452 ' HG3' ' O ' ' A' ' 53' ' ' ILE . 29.3 mtp-105 -58.53 -51.66 68.96 Favored 'General case' 0 N--CA 1.47 0.549 0 CA-C-N 116.424 -0.353 . . . . 74.239999999999995 111.647 -177.041 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -57.8 -53.21 60.78 Favored 'General case' 0 CA--C 1.539 0.553 0 CA-C-N 116.297 -0.411 . . . . 71.340000000000003 111.893 -179.702 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 59' ' ' TYR . . . . . 0.5 ' CE2' ' HB3' ' A' ' 41' ' ' ARG . 72.1 t80 -57.59 -58.68 7.26 Favored 'General case' 0 N--CA 1.471 0.58 0 CA-C-O 121.041 0.448 . . . . 73.219999999999999 111.778 179.772 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 60' ' ' GLN . . . . . 0.54 ' HG3' ' HG ' ' A' ' 22' ' ' LEU . 0.6 OUTLIER -56.69 -31.38 64.41 Favored 'General case' 0 CA--C 1.546 0.819 0 CA-C-N 116.147 -0.478 . . . . 74.340000000000003 111.349 -175.278 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 61' ' ' ASP . . . . . . . . . . . . . 17.8 t70 -79.35 -45.77 18.95 Favored 'General case' 0 CA--C 1.542 0.657 0 CA-C-O 120.862 0.363 . . . . 55.399999999999999 111.884 -179.865 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 62' ' ' GLN . . . . . . . . . . . . . 3.4 pt20 -70.53 -32.03 69.32 Favored 'General case' 0 CA--C 1.542 0.655 0 N-CA-C 112.455 0.539 . . . . 71.510000000000005 112.455 -174.654 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 63' ' ' ILE . . . . . 0.446 ' O ' ' HB1' ' A' ' 74' ' ' ALA . 34.8 pt -65.37 -17.98 23.02 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.725 0 N-CA-C 111.942 0.349 . . . . 75.140000000000001 111.942 -179.691 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 34.4 t 73.3 85.43 0.11 Allowed Pre-proline 0 N--CA 1.474 0.749 0 C-N-CA 123.119 0.568 . . . . 74.5 111.374 -178.26 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 65' ' ' PRO . . . . . . . . . . . . . 93.7 Cg_endo -80.35 -175.83 2.89 Favored 'Trans proline' 0 CA--C 1.539 0.758 0 C-N-CA 122.948 2.432 . . . . 75.510000000000005 113.824 -177.042 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 66' ' ' VAL . . . . . . . . . . . . . 19.5 m -90.68 122.04 67.49 Favored Pre-proline 0 CA--C 1.542 0.656 0 CA-C-N 115.988 -0.551 . . . . 74.049999999999997 111.639 177.815 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 67' ' ' PRO . . . . . . . . . . . . . 8.6 Cg_exo -72.49 65.0 3.74 Favored 'Trans proline' 0 CA--C 1.541 0.837 0 C-N-CA 122.547 2.165 . . . . 74.040000000000006 111.864 177.174 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 80.25 -57.19 4.66 Favored Glycine 0 CA--C 1.527 0.799 0 C-N-CA 121.368 -0.444 . . . . 50.399999999999999 112.604 -176.215 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . -87.43 149.3 46.43 Favored Pre-proline 0 CA--C 1.541 0.608 0 C-N-CA 122.264 0.226 . . . . 62.109999999999999 111.344 177.742 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 70' ' ' PRO . . . . . . . . . . . . . 35.4 Cg_endo -63.85 87.42 0.14 Allowed 'Trans proline' 0 CA--C 1.543 0.932 0 C-N-CA 122.382 2.054 . . . . 71.409999999999997 112.843 -179.5 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 39.5 ttpt -63.55 -59.57 4.46 Favored 'General case' 0 CA--C 1.539 0.553 0 CA-C-N 116.139 -0.482 . . . . 54.43 111.921 -179.443 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -179.66 146.16 0.44 Allowed Pre-proline 0 N--CA 1.471 0.602 0 CA-C-N 116.267 -0.424 . . . . 71.239999999999995 110.891 -178.352 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 73' ' ' PRO . . . . . . . . . . . . . 26.2 Cg_endo -61.8 106.81 0.47 Allowed 'Trans proline' 0 CA--C 1.54 0.81 0 C-N-CA 122.376 2.051 . . . . 72.510000000000005 111.964 176.335 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 74' ' ' ALA . . . . . 0.446 ' HB1' ' O ' ' A' ' 63' ' ' ILE . . . -94.38 -179.68 5.0 Favored 'General case' 0 N--CA 1.469 0.514 0 N-CA-C 112.796 0.665 . . . . 73.340000000000003 112.796 -173.939 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.254 1.303 0 CA-C-O 118.004 -0.998 . . . . 73.409999999999997 111.816 -177.416 . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 65.3 mtm . . . . . 0 N--CA 1.49 1.575 0 CA-C-O 120.531 0.205 . . . . 64.299999999999997 111.264 . . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . -50.18 112.69 1.6 Allowed Glycine 0 CA--C 1.534 1.229 0 N-CA-C 115.286 0.875 . . . . 73.540000000000006 115.286 -176.268 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 3' ' ' HIS . . . . . . . . . . . . . 41.3 p-80 -137.42 37.06 2.48 Favored 'General case' 0 N--CA 1.471 0.575 0 CA-C-O 121.732 0.777 . . . . 64.230000000000004 109.278 172.252 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 4' ' ' HIS . . . . . . . . . . . . . 49.0 t-80 -84.31 29.53 0.58 Allowed 'General case' 0 CA--C 1.55 0.965 0 CA-C-N 114.817 -1.083 . . . . 71.299999999999997 112.538 -167.982 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 5' ' ' HIS . . . . . . . . . . . . . 41.4 p-80 -65.96 140.63 58.33 Favored 'General case' 0 CA--C 1.545 0.767 0 CA-C-O 120.917 0.389 . . . . 75.200000000000003 112.047 -176.615 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 71.9 m80 -132.92 167.65 19.86 Favored 'General case' 0 N--CA 1.471 0.603 0 CA-C-O 121.293 0.568 . . . . 74.230000000000004 112.067 177.95 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 55.7 t-80 -165.35 131.15 2.64 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 115.468 -0.787 . . . . 74.439999999999998 109.973 174.388 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 8' ' ' HIS . . . . . . . . . . . . . 41.0 p-80 -154.57 179.17 9.3 Favored 'General case' 0 CA--C 1.537 0.452 0 CA-C-O 120.582 0.229 . . . . 74.409999999999997 111.313 -178.853 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 86.8 p -71.5 -175.97 1.43 Allowed 'General case' 0 N--CA 1.472 0.663 0 CA-C-O 120.884 0.373 . . . . 75.030000000000001 111.203 179.038 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 51.1 m80 -114.46 -67.17 1.02 Allowed 'General case' 0 N--CA 1.469 0.503 0 N-CA-C 112.497 0.555 . . . . 71.109999999999999 112.497 -178.29 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 11' ' ' MET . . . . . . . . . . . . . 48.4 ttm -151.09 132.9 15.01 Favored 'General case' 0 CA--C 1.535 0.386 0 CA-C-O 121.05 0.452 . . . . 73.150000000000006 112.123 -172.75 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 48.7 m -87.39 97.1 10.62 Favored 'General case' 0 CA--C 1.535 0.369 0 N-CA-C 109.982 -0.377 . . . . 72.010000000000005 109.982 174.386 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 13' ' ' THR . . . . . . . . . . . . . 81.5 p -60.36 125.62 82.32 Favored Pre-proline 0 N--CA 1.472 0.659 0 N-CA-C 112.859 0.688 . . . . 71.209999999999994 112.859 -173.447 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 14' ' ' PRO . . . . . . . . . . . . . 22.6 Cg_exo -64.64 85.53 0.17 Allowed 'Trans proline' 0 CA--C 1.541 0.826 0 C-N-CA 122.548 2.165 . . . . 75.349999999999994 111.461 172.615 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 15' ' ' LEU . . . . . 0.447 ' O ' HD12 ' A' ' 15' ' ' LEU . 3.7 pp -61.29 147.65 43.86 Favored 'General case' 0 N--CA 1.47 0.556 0 N-CA-C 113.069 0.766 . . . . 74.299999999999997 113.069 -174.22 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 16' ' ' THR . . . . . . . . . . . . . 8.8 t -134.39 164.38 27.56 Favored 'General case' 0 N--CA 1.47 0.568 0 CA-C-N 115.91 -0.587 . . . . 75.230000000000004 111.2 175.728 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . 138.69 -164.32 25.74 Favored Glycine 0 CA--C 1.529 0.917 0 C-N-CA 121.199 -0.524 . . . . 75.140000000000001 113.072 -178.143 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 13.7 ptmm? -145.2 146.41 30.37 Favored Pre-proline 0 CA--C 1.541 0.607 0 O-C-N 122.507 -0.408 . . . . 64.310000000000002 111.687 -179.808 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 90.5 Cg_endo -82.7 -157.54 0.08 OUTLIER 'Trans proline' 0 CA--C 1.541 0.827 0 C-N-CA 122.463 2.109 . . . . 52.240000000000002 112.525 172.944 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . 157.4 -104.45 0.25 Allowed Glycine 0 CA--C 1.523 0.539 0 C-N-CA 121.119 -0.563 . . . . 73.109999999999999 112.562 177.745 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . 179.85 -170.67 0.15 Allowed 'General case' 0 N--CA 1.472 0.669 0 CA-C-O 121.031 0.443 . . . . 71.549999999999997 111.636 -176.324 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 92.9 mt -105.4 160.21 26.83 Favored Pre-proline 0 CA--C 1.544 0.75 0 C-N-CA 122.793 0.437 . . . . 75.109999999999999 110.441 175.833 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 23' ' ' PRO . . . . . . . . . . . . . 35.9 Cg_endo -65.99 131.87 28.42 Favored 'Trans proline' 0 CA--C 1.544 0.978 0 C-N-CA 122.042 1.828 . . . . 71.099999999999994 112.283 174.859 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -68.08 -27.94 66.93 Favored 'General case' 0 N--CA 1.472 0.643 0 N-CA-C 112.266 0.469 . . . . 73.299999999999997 112.266 -177.02 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 19.6 m120 -87.18 52.41 2.5 Favored 'General case' 0 CA--C 1.539 0.543 0 CA-C-O 121.058 0.456 . . . . 63.420000000000002 112.056 -179.799 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 26' ' ' LEU . . . . . 0.433 ' HB2' HG21 ' A' ' 53' ' ' ILE . 87.5 mt -60.75 -27.71 68.15 Favored 'General case' 0 N--CA 1.469 0.518 0 CA-C-O 121.251 0.548 . . . . 71.150000000000006 110.662 173.835 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 7.6 p-10 -67.82 -28.91 67.98 Favored 'General case' 0 CA--C 1.54 0.579 0 CA-C-N 115.836 -0.62 . . . . 74.209999999999994 111.63 176.69 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 26.0 t70 -76.7 -39.71 51.12 Favored 'General case' 0 CA--C 1.54 0.578 0 CA-C-N 116.463 -0.335 . . . . 74.430000000000007 111.776 -178.963 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 29' ' ' MET . . . . . . . . . . . . . 58.6 mtm -68.56 157.62 35.65 Favored 'General case' 0 N--CA 1.471 0.614 0 CA-C-O 121.549 0.69 . . . . 65.549999999999997 112.366 -177.398 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 30' ' ' LYS . . . . . 0.42 ' HB2' ' HG2' ' A' ' 33' ' ' GLU . 50.5 mtmt -69.92 156.58 38.88 Favored 'General case' 0 CA--C 1.539 0.524 0 CA-C-N 115.535 -0.757 . . . . 75.510000000000005 112.138 -179.289 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 42.2 t -54.51 -42.71 60.79 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.561 0 CA-C-N 116.12 -0.491 . . . . 74.409999999999997 111.273 178.039 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -60.87 -33.74 73.54 Favored 'General case' 0 CA--C 1.54 0.57 0 CA-C-N 116.061 -0.518 . . . . 75.400000000000006 111.778 177.913 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 33' ' ' GLU . . . . . 0.42 ' HG2' ' HB2' ' A' ' 30' ' ' LYS . 36.9 mm-40 -67.37 -45.01 77.54 Favored 'General case' 0 N--CA 1.468 0.441 0 CA-C-O 121.122 0.487 . . . . 73.340000000000003 110.662 177.185 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 63.4 mt -58.75 -48.3 81.66 Favored 'General case' 0 CA--C 1.537 0.459 0 CA-C-N 115.954 -0.566 . . . . 75.329999999999998 110.973 177.481 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 35' ' ' LYS . . . . . 0.41 ' HA ' HD12 ' A' ' 38' ' ' LEU . 98.7 mttt -63.1 -29.6 70.94 Favored 'General case' 0 CA--C 1.54 0.564 0 CA-C-N 116.182 -0.463 . . . . 65.209999999999994 111.603 176.964 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 36' ' ' GLN . . . . . 0.554 ' HA ' ' HE3' ' A' ' 39' ' ' LYS . 56.8 tp60 -65.5 -49.72 67.95 Favored 'General case' 0 CA--C 1.537 0.474 0 CA-C-O 121.011 0.434 . . . . 73.340000000000003 110.654 174.701 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 7.8 mm-40 -63.45 -21.84 66.53 Favored 'General case' 0 CA--C 1.545 0.759 0 CA-C-O 121.128 0.49 . . . . 75.430000000000007 111.621 178.794 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 38' ' ' LEU . . . . . 0.426 ' CD1' HD23 ' A' ' 52' ' ' LEU . 94.8 mt -75.65 -56.24 4.88 Favored 'General case' 0 CA--C 1.539 0.531 0 CA-C-N 116.445 -0.343 . . . . 75.340000000000003 111.583 174.736 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 39' ' ' LYS . . . . . 0.554 ' HE3' ' HA ' ' A' ' 36' ' ' GLN . 17.0 ptpt -57.64 -35.96 71.21 Favored 'General case' 0 CA--C 1.543 0.682 0 CA-C-O 120.7 0.286 . . . . 74.319999999999993 111.682 -176.727 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 40' ' ' LEU . . . . . 0.458 ' HG ' ' O ' ' A' ' 36' ' ' GLN . 88.3 mt -66.32 -23.56 66.39 Favored 'General case' 0 N--CA 1.472 0.673 0 N-CA-C 111.855 0.317 . . . . 75.400000000000006 111.855 -179.793 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 41' ' ' ARG . . . . . 0.763 HH22 ' HA ' ' A' ' 56' ' ' LEU . 52.5 mtm180 -114.07 15.41 18.35 Favored 'General case' 0 CA--C 1.541 0.629 0 N-CA-C 111.987 0.366 . . . . 73.129999999999995 111.987 -176.612 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 33.3 t 63.23 73.68 0.45 Allowed 'General case' 0 N--CA 1.477 0.892 0 CA-C-O 121.146 0.498 . . . . 74.120000000000005 111.896 -179.056 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 43' ' ' LEU . . . . . 0.414 HD21 ' CD2' ' A' ' 59' ' ' TYR . 68.3 mt -144.3 143.74 23.21 Favored Pre-proline 0 N--CA 1.47 0.557 0 CA-C-N 116.183 -0.462 . . . . 72.450000000000003 111.616 -177.773 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 44' ' ' PRO . . . . . . . . . . . . . 56.7 Cg_endo -69.54 127.62 15.03 Favored 'Trans proline' 0 CA--C 1.543 0.933 0 C-N-CA 122.704 2.269 . . . . 74.030000000000001 113.09 178.868 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 33.6 m -96.91 23.05 0.94 Allowed 'Isoleucine or valine' 0 CA--C 1.544 0.736 0 CA-C-O 120.978 0.418 . . . . 65.340000000000003 112.068 -177.226 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 54.0 m -84.73 -8.33 58.88 Favored 'General case' 0 N--CA 1.477 0.917 0 N-CA-C 113.206 0.817 . . . . 62.210000000000001 113.206 -175.023 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . -87.3 170.74 41.3 Favored Glycine 0 CA--C 1.531 1.046 0 C-N-CA 120.928 -0.653 . . . . 74.239999999999995 113.824 -176.485 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 48' ' ' THR . . . . . 0.594 ' O ' ' HG ' ' A' ' 52' ' ' LEU . 63.1 p -77.31 167.69 21.29 Favored 'General case' 0 N--CA 1.477 0.91 0 O-C-N 122.637 -0.331 . . . . 64.230000000000004 111.359 177.511 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 65.0 tttm -48.37 -48.34 36.75 Favored 'General case' 0 N--CA 1.476 0.825 0 N-CA-C 112.357 0.503 . . . . 72.530000000000001 112.357 -176.364 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 50' ' ' THR . . . . . . . . . . . . . 87.3 m -64.55 -39.75 94.32 Favored 'General case' 0 N--CA 1.474 0.743 0 CA-C-O 120.949 0.404 . . . . 64.239999999999995 111.904 178.748 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 43.5 mt-10 -64.88 -40.71 95.54 Favored 'General case' 0 N--CA 1.472 0.634 0 CA-C-O 120.86 0.362 . . . . 71.120000000000005 111.331 177.933 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 52' ' ' LEU . . . . . 0.594 ' HG ' ' O ' ' A' ' 48' ' ' THR . 47.7 mt -58.34 -50.99 71.67 Favored 'General case' 0 CA--C 1.535 0.398 0 CA-C-O 121.082 0.468 . . . . 75.0 110.024 176.754 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 53' ' ' ILE . . . . . 0.433 HG21 ' HB2' ' A' ' 26' ' ' LEU . 85.2 mt -53.26 -54.73 16.19 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.577 0 CA-C-N 115.742 -0.663 . . . . 74.25 111.732 177.036 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -58.57 -38.43 77.87 Favored 'General case' 0 CA--C 1.537 0.443 0 CA-C-N 116.386 -0.37 . . . . 64.439999999999998 111.859 -178.974 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 55' ' ' ARG . . . . . 0.412 HH11 ' HD2' ' A' ' 55' ' ' ARG . 15.9 ttt180 -76.89 -25.1 52.64 Favored 'General case' 0 CA--C 1.541 0.613 0 O-C-N 122.112 -0.367 . . . . 60.200000000000003 111.257 -179.792 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 56' ' ' LEU . . . . . 0.763 ' HA ' HH22 ' A' ' 41' ' ' ARG . 85.2 mt -62.82 -49.34 75.31 Favored 'General case' 0 C--O 1.236 0.362 0 CA-C-O 121.126 0.489 . . . . 75.099999999999994 109.843 170.48 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 58.6 mtp180 -62.91 -47.83 81.59 Favored 'General case' 0 CA--C 1.538 0.518 0 CA-C-N 115.316 -0.856 . . . . 75.209999999999994 110.828 177.078 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 58' ' ' ALA . . . . . 0.502 ' O ' ' HG3' ' A' ' 62' ' ' GLN . . . -55.67 -57.43 12.0 Favored 'General case' 0 N--CA 1.469 0.495 0 CA-C-N 116.032 -0.531 . . . . 74.400000000000006 112.17 179.821 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 59' ' ' TYR . . . . . 0.414 ' CD2' HD21 ' A' ' 43' ' ' LEU . 54.1 t80 -54.46 -38.87 66.86 Favored 'General case' 0 N--CA 1.473 0.692 0 CA-C-O 120.993 0.425 . . . . 74.010000000000005 111.363 179.635 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 60' ' ' GLN . . . . . . . . . . . . . 23.9 tm0? -69.68 -34.75 74.38 Favored 'General case' 0 CA--C 1.538 0.492 0 CA-C-O 121.094 0.473 . . . . 73.299999999999997 110.461 177.614 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 61' ' ' ASP . . . . . . . . . . . . . 34.3 t70 -70.5 -33.63 71.44 Favored 'General case' 0 CA--C 1.543 0.692 0 CA-C-N 116.175 -0.466 . . . . 74.019999999999996 111.408 178.338 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 62' ' ' GLN . . . . . 0.502 ' HG3' ' O ' ' A' ' 58' ' ' ALA . 84.7 mt-30 -59.79 -41.89 92.15 Favored 'General case' 0 N--CA 1.473 0.724 0 CA-C-O 121.147 0.498 . . . . 74.400000000000006 111.345 178.43 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 63' ' ' ILE . . . . . . . . . . . . . 27.0 pt -82.65 -27.08 8.44 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.634 0 CA-C-N 116.306 -0.407 . . . . 63.229999999999997 110.665 175.089 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 10.2 t 73.87 142.62 0.09 OUTLIER Pre-proline 0 N--CA 1.477 0.894 0 C-N-CA 123.688 0.795 . . . . 63.43 111.908 178.382 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 65' ' ' PRO . . . . . . . . . . . . . 54.6 Cg_endo -68.7 81.79 0.57 Allowed 'Trans proline' 0 C--N 1.353 0.782 0 C-N-CA 122.348 2.032 . . . . 72.400000000000006 112.97 179.518 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 66' ' ' VAL . . . . . . . . . . . . . 29.7 m -132.22 143.62 49.69 Favored Pre-proline 0 CA--C 1.543 0.708 0 CA-C-N 116.063 -0.517 . . . . 71.340000000000003 111.597 178.602 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 67' ' ' PRO . . . . . . . . . . . . . 51.7 Cg_exo -55.93 -45.31 39.61 Favored 'Trans proline' 0 CA--C 1.541 0.847 0 C-N-CA 122.589 2.192 . . . . 65.019999999999996 112.453 175.413 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . -83.78 58.09 5.03 Favored Glycine 0 CA--C 1.526 0.767 0 C-N-CA 121.196 -0.526 . . . . 62.439999999999998 112.398 175.313 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . -59.82 121.84 61.06 Favored Pre-proline 0 CA--C 1.541 0.611 0 CA-C-O 120.687 0.279 . . . . 63.240000000000002 111.582 -179.633 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 70' ' ' PRO . . . . . . . . . . . . . 61.0 Cg_endo -71.43 -14.46 30.92 Favored 'Trans proline' 0 CA--C 1.54 0.801 0 C-N-CA 122.7 2.267 . . . . 44.420000000000002 113.847 -175.879 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 71' ' ' LYS . . . . . 0.574 ' HD2' ' O ' ' A' ' 72' ' ' ALA . 0.1 OUTLIER -67.64 158.54 31.94 Favored 'General case' 0 CA--C 1.544 0.741 0 CA-C-O 121.012 0.434 . . . . 64.299999999999997 111.793 -176.655 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 72' ' ' ALA . . . . . 0.574 ' O ' ' HD2' ' A' ' 71' ' ' LYS . . . -59.65 153.76 49.81 Favored Pre-proline 0 CA--C 1.547 0.851 0 N-CA-C 112.945 0.72 . . . . 65.310000000000002 112.945 -176.684 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 73' ' ' PRO . . . . . . . . . . . . . 81.8 Cg_exo -50.17 -15.33 1.29 Allowed 'Trans proline' 0 CA--C 1.543 0.967 0 C-N-CA 123.208 2.605 . . . . 61.310000000000002 114.176 179.037 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -51.79 120.5 5.32 Favored 'General case' 0 CA--C 1.539 0.551 0 CA-C-O 121.171 0.51 . . . . 44.350000000000001 112.368 178.279 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.252 1.195 0 CA-C-O 118.532 -0.747 . . . . 72.129999999999995 110.829 177.785 . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 64.9 mtt . . . . . 0 N--CA 1.49 1.566 0 CA-C-O 121.016 0.436 . . . . 54.020000000000003 111.316 . . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . 173.65 106.44 0.19 Allowed Glycine 0 CA--C 1.527 0.811 0 C-N-CA 120.974 -0.632 . . . . 70.209999999999994 113.06 179.376 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 3' ' ' HIS . . . . . . . . . . . . . 38.1 m80 -87.99 99.35 12.08 Favored 'General case' 0 CA--C 1.538 0.493 0 CA-C-O 120.766 0.317 . . . . 74.129999999999995 110.54 178.071 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 4' ' ' HIS . . . . . . . . . . . . . 13.2 t-80 -147.22 124.81 11.74 Favored 'General case' 0 CA--C 1.543 0.694 0 CA-C-O 120.738 0.304 . . . . 75.510000000000005 111.598 -173.574 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 5' ' ' HIS . . . . . . . . . . . . . 23.1 t60 -148.08 150.75 34.45 Favored 'General case' 0 CA--C 1.544 0.724 0 C-N-CA 122.744 0.418 . . . . 71.420000000000002 110.147 -179.3 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 8.3 p-80 -128.0 157.32 40.95 Favored 'General case' 0 N--CA 1.474 0.752 0 CA-C-O 120.863 0.364 . . . . 75.409999999999997 111.81 179.406 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 7.9 p80 -160.52 110.39 1.76 Allowed 'General case' 0 CA--C 1.541 0.631 0 CA-C-O 121.124 0.488 . . . . 75.439999999999998 111.701 176.219 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 8' ' ' HIS . . . . . . . . . . . . . 65.4 t60 -126.74 118.29 24.41 Favored 'General case' 0 CA--C 1.538 0.508 0 CA-C-N 116.197 -0.456 . . . . 75.120000000000005 111.172 178.814 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 47.5 t -145.72 145.23 30.78 Favored 'General case' 0 N--CA 1.471 0.581 0 CA-C-O 120.78 0.324 . . . . 73.540000000000006 111.339 179.181 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 32.8 t-80 -163.36 87.29 0.54 Allowed 'General case' 0 CA--C 1.541 0.602 0 CA-C-O 121.157 0.503 . . . . 55.119999999999997 110.757 178.335 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 11' ' ' MET . . . . . . . . . . . . . 26.3 ttt -91.4 139.45 30.71 Favored 'General case' 0 CA--C 1.543 0.675 0 CA-C-N 116.1 -0.5 . . . . 71.409999999999997 111.664 -176.702 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 67.0 m -115.72 137.58 51.95 Favored 'General case' 0 N--CA 1.475 0.823 0 CA-C-O 121.026 0.441 . . . . 75.209999999999994 111.818 179.736 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 13' ' ' THR . . . . . . . . . . . . . 74.6 p -89.77 157.53 46.25 Favored Pre-proline 0 N--CA 1.473 0.71 0 CA-C-N 116.185 -0.461 . . . . 74.310000000000002 111.401 -179.3 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 14' ' ' PRO . . . . . . . . . . . . . 63.3 Cg_exo -53.78 143.98 56.58 Favored 'Trans proline' 0 CA--C 1.543 0.937 0 C-N-CA 122.701 2.267 . . . . 65.209999999999994 113.389 177.007 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 86.5 mt -97.0 112.01 23.97 Favored 'General case' 0 CA--C 1.537 0.467 0 CA-C-O 120.912 0.386 . . . . 74.299999999999997 111.675 -178.327 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 16' ' ' THR . . . . . . . . . . . . . 9.8 t -90.15 170.83 9.98 Favored 'General case' 0 N--CA 1.472 0.654 0 CA-C-N 116.21 -0.45 . . . . 73.400000000000006 111.754 -179.316 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . -89.43 152.8 22.88 Favored Glycine 0 CA--C 1.53 0.976 0 CA-C-N 116.301 -0.409 . . . . 63.530000000000001 113.693 -177.256 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -155.31 155.26 29.73 Favored Pre-proline 0 N--CA 1.472 0.627 0 O-C-N 122.559 -0.377 . . . . 72.25 110.969 179.143 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 19' ' ' PRO . . . . . 0.401 ' HD3' ' HB3' ' A' ' 75' ' ' ALA . 26.0 Cg_exo -63.78 179.68 0.96 Allowed 'Trans proline' 0 CA--C 1.54 0.818 0 C-N-CA 122.38 2.053 . . . . 65.129999999999995 112.785 175.648 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . -87.31 -79.43 1.24 Allowed Glycine 0 CA--C 1.526 0.741 0 C-N-CA 121.003 -0.618 . . . . 42.130000000000003 112.455 178.087 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -174.72 147.53 1.04 Allowed 'General case' 0 N--CA 1.468 0.464 0 C-N-CA 122.649 0.38 . . . . 75.140000000000001 111.054 178.261 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 22' ' ' LEU . . . . . 0.438 HD11 ' HB3' ' A' ' 56' ' ' LEU . 79.4 mt -60.02 146.26 82.95 Favored Pre-proline 0 CA--C 1.54 0.576 0 CA-C-O 120.437 0.161 . . . . 71.519999999999996 111.086 176.052 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 23' ' ' PRO . . . . . 0.522 ' O ' ' HG ' ' A' ' 26' ' ' LEU . 74.5 Cg_exo -50.92 136.84 44.04 Favored 'Trans proline' 0 CA--C 1.539 0.764 0 C-N-CA 122.925 2.416 . . . . 74.030000000000001 113.644 -177.243 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -80.15 -15.12 57.76 Favored 'General case' 0 N--CA 1.467 0.421 0 CA-C-O 120.965 0.412 . . . . 72.140000000000001 111.309 177.167 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 25' ' ' ASN . . . . . 0.414 ' HB3' ' HB3' ' A' ' 28' ' ' ASP . 14.9 m120 -92.77 27.07 2.47 Favored 'General case' 0 CA--C 1.542 0.67 0 N-CA-C 112.161 0.43 . . . . 64.019999999999996 112.161 -177.807 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 26' ' ' LEU . . . . . 0.522 ' HG ' ' O ' ' A' ' 23' ' ' PRO . 82.8 mt -51.07 -38.26 50.59 Favored 'General case' 0 N--CA 1.476 0.839 0 N-CA-C 112.949 0.722 . . . . 75.450000000000003 112.949 -176.873 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 35.2 t70 -75.53 -31.25 60.04 Favored 'General case' 0 CA--C 1.541 0.62 0 O-C-N 122.091 -0.38 . . . . 72.450000000000003 111.332 179.077 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 28' ' ' ASP . . . . . 0.414 ' HB3' ' HB3' ' A' ' 25' ' ' ASN . 22.1 t70 -73.14 -23.3 60.45 Favored 'General case' 0 CA--C 1.541 0.627 0 CA-C-O 121.124 0.488 . . . . 72.049999999999997 110.254 175.791 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 29' ' ' MET . . . . . . . . . . . . . 76.3 mtp -70.83 160.67 32.33 Favored 'General case' 0 CA--C 1.537 0.479 0 CA-C-O 121.295 0.569 . . . . 73.439999999999998 111.559 176.038 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 46.3 mtpt -92.9 157.68 16.23 Favored 'General case' 0 CA--C 1.539 0.531 0 CA-C-N 115.898 -0.592 . . . . 72.219999999999999 112.003 -177.926 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 57.3 t -52.13 -47.86 43.17 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.693 0 CA-C-N 115.909 -0.587 . . . . 74.310000000000002 112.27 -176.418 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -61.73 -35.96 79.6 Favored 'General case' 0 N--CA 1.471 0.575 0 CA-C-O 120.919 0.39 . . . . 73.409999999999997 111.874 179.853 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 41.7 mt-10 -72.01 -35.47 69.43 Favored 'General case' 0 N--CA 1.47 0.546 0 CA-C-N 116.297 -0.41 . . . . 65.140000000000001 111.126 -178.895 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 90.6 mt -65.79 -50.45 64.66 Favored 'General case' 0 CA--C 1.537 0.473 0 CA-C-N 116.145 -0.48 . . . . 74.549999999999997 110.887 174.501 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 35' ' ' LYS . . . . . 0.401 ' HG2' ' HB ' ' A' ' 45' ' ' VAL . 60.3 mttm -54.99 -41.82 71.7 Favored 'General case' 0 N--CA 1.47 0.544 0 CA-C-O 121.043 0.449 . . . . 74.430000000000007 111.299 175.667 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 36' ' ' GLN . . . . . 0.478 ' O ' ' HG ' ' A' ' 40' ' ' LEU . 26.0 tm0? -56.15 -47.81 77.5 Favored 'General case' 0 CA--C 1.539 0.539 0 CA-C-N 115.8 -0.636 . . . . 70.219999999999999 111.32 -179.489 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 37' ' ' GLU . . . . . 0.717 ' HB3' ' NH2' ' A' ' 41' ' ' ARG . 42.5 mt-10 -70.79 -39.18 73.29 Favored 'General case' 0 CA--C 1.538 0.518 0 N-CA-C 112.095 0.405 . . . . 73.519999999999996 112.095 178.151 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 38' ' ' LEU . . . . . . . . . . . . . 77.5 mt -55.84 -54.3 46.21 Favored 'General case' 0 N--CA 1.467 0.424 0 CA-C-O 120.822 0.344 . . . . 73.030000000000001 111.573 176.913 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 18.7 ptmt -63.48 -25.68 68.37 Favored 'General case' 0 CA--C 1.541 0.628 0 N-CA-C 112.225 0.454 . . . . 74.409999999999997 112.225 -175.006 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 40' ' ' LEU . . . . . 0.478 ' HG ' ' O ' ' A' ' 36' ' ' GLN . 66.1 mt -72.08 -30.03 64.7 Favored 'General case' 0 N--CA 1.471 0.576 0 CA-C-O 120.805 0.336 . . . . 74.299999999999997 111.174 175.388 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 41' ' ' ARG . . . . . 0.717 ' NH2' ' HB3' ' A' ' 37' ' ' GLU . 0.0 OUTLIER -97.52 17.07 18.49 Favored 'General case' 0 N--CA 1.472 0.64 0 CA-C-N 116.412 -0.358 . . . . 64.420000000000002 111.258 173.951 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 30.0 t 63.32 16.48 9.52 Favored 'General case' 0 N--CA 1.48 1.057 0 N-CA-C 112.706 0.632 . . . . 73.200000000000003 112.706 176.989 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 58.4 mt -79.65 136.2 55.69 Favored Pre-proline 0 CA--C 1.543 0.674 0 N-CA-C 111.914 0.339 . . . . 74.430000000000007 111.914 -178.652 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 44' ' ' PRO . . . . . . . . . . . . . 51.6 Cg_exo -56.24 120.81 8.9 Favored 'Trans proline' 0 CA--C 1.542 0.905 0 C-N-CA 122.93 2.42 . . . . 72.239999999999995 113.227 178.588 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 45' ' ' VAL . . . . . 0.401 ' HB ' ' HG2' ' A' ' 35' ' ' LYS . 34.0 m -94.87 10.17 4.89 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.733 0 N-CA-C 112.719 0.637 . . . . 62.240000000000002 112.719 -176.419 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 37.1 t -73.99 -22.17 59.71 Favored 'General case' 0 N--CA 1.478 0.931 0 N-CA-C 113.063 0.764 . . . . 74.329999999999998 113.063 -176.226 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . -68.31 169.04 40.91 Favored Glycine 0 CA--C 1.534 1.25 0 C-N-CA 120.968 -0.634 . . . . 53.149999999999999 114.055 -176.944 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 48' ' ' THR . . . . . 0.577 ' O ' ' HG ' ' A' ' 52' ' ' LEU . 64.1 p -74.26 170.32 15.81 Favored 'General case' 0 N--CA 1.475 0.799 0 O-C-N 122.558 -0.378 . . . . 74.120000000000005 111.115 177.097 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 49' ' ' LYS . . . . . 0.411 ' O ' HG13 ' A' ' 53' ' ' ILE . 64.0 tttm -48.1 -44.98 32.32 Favored 'General case' 0 N--CA 1.471 0.611 0 N-CA-C 112.056 0.391 . . . . 73.510000000000005 112.056 -178.875 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 50' ' ' THR . . . . . . . . . . . . . 94.4 m -64.51 -43.86 92.75 Favored 'General case' 0 N--CA 1.472 0.634 0 CA-C-O 120.877 0.37 . . . . 74.140000000000001 111.313 177.565 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 44.8 mt-10 -64.6 -34.72 78.92 Favored 'General case' 0 N--CA 1.469 0.518 0 CA-C-N 116.45 -0.341 . . . . 74.430000000000007 111.533 -179.878 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 52' ' ' LEU . . . . . 0.577 ' HG ' ' O ' ' A' ' 48' ' ' THR . 44.5 mt -62.03 -44.51 96.55 Favored 'General case' 0 N--CA 1.471 0.6 0 CA-C-O 121.409 0.624 . . . . 72.25 110.318 176.381 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 53' ' ' ILE . . . . . 0.487 HG21 ' HD3' ' A' ' 57' ' ' ARG . 79.7 mt -60.91 -52.38 62.36 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.576 0 CA-C-N 115.525 -0.762 . . . . 74.230000000000004 111.301 176.172 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 11.8 mm-40 -61.45 -30.15 70.41 Favored 'General case' 0 N--CA 1.47 0.54 0 CA-C-N 116.204 -0.453 . . . . 54.409999999999997 111.757 178.68 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 55' ' ' ARG . . . . . 0.493 ' HA ' ' NE ' ' A' ' 55' ' ' ARG . 0.8 OUTLIER -67.33 -50.03 61.68 Favored 'General case' 0 CA--C 1.54 0.562 0 CA-C-O 120.865 0.364 . . . . 73.030000000000001 110.93 179.5 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 56' ' ' LEU . . . . . 0.585 HD22 HH21 ' A' ' 41' ' ' ARG . 60.7 mt -59.77 -51.34 70.16 Favored 'General case' 0 N--CA 1.472 0.667 0 CA-C-O 121.193 0.52 . . . . 64.340000000000003 111.126 175.376 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 57' ' ' ARG . . . . . 0.487 ' HD3' HG21 ' A' ' 53' ' ' ILE . 16.7 mtp85 -56.97 -39.11 74.0 Favored 'General case' 0 CA--C 1.539 0.538 0 CA-C-N 116.022 -0.536 . . . . 74.030000000000001 112.132 179.806 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -66.75 -40.03 88.14 Favored 'General case' 0 CA--C 1.54 0.575 0 CA-C-O 120.984 0.421 . . . . 74.329999999999998 111.5 176.797 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 59' ' ' TYR . . . . . . . . . . . . . 73.5 t80 -63.43 -38.09 89.8 Favored 'General case' 0 CA--C 1.542 0.657 0 CA-C-N 116.237 -0.438 . . . . 74.239999999999995 111.348 178.907 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 60' ' ' GLN . . . . . 0.413 ' HB2' HD12 ' A' ' 22' ' ' LEU . 0.0 OUTLIER -76.61 -45.7 29.12 Favored 'General case' 0 CA--C 1.542 0.669 0 CA-C-O 121.282 0.563 . . . . 75.319999999999993 110.536 178.618 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 61' ' ' ASP . . . . . . . . . . . . . 27.3 t70 -53.08 -28.77 26.68 Favored 'General case' 0 CA--C 1.545 0.787 0 N-CA-C 112.833 0.679 . . . . 74.120000000000005 112.833 -176.988 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 62' ' ' GLN . . . . . . . . . . . . . 10.1 pt20 -85.89 -23.92 26.84 Favored 'General case' 0 N--CA 1.473 0.699 0 N-CA-C 112.735 0.642 . . . . 50.020000000000003 112.735 -178.956 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 63' ' ' ILE . . . . . . . . . . . . . 32.0 pt -100.42 -16.09 7.29 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.777 0 N-CA-C 112.13 0.418 . . . . 75.409999999999997 112.13 -178.878 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 32.8 t -66.9 134.63 94.04 Favored Pre-proline 0 CA--C 1.541 0.612 0 N-CA-C 112.229 0.455 . . . . 72.099999999999994 112.229 -177.544 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 65' ' ' PRO . . . . . . . . . . . . . 6.6 Cg_exo -74.13 91.1 0.95 Allowed 'Trans proline' 0 CA--C 1.539 0.748 0 C-N-CA 122.694 2.263 . . . . 74.340000000000003 112.529 177.216 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 66' ' ' VAL . . . . . 0.471 ' HB ' ' HD2' ' A' ' 67' ' ' PRO . 33.4 m -73.99 157.19 87.35 Favored Pre-proline 0 CA--C 1.545 0.78 0 CA-C-N 116.636 -0.257 . . . . 71.439999999999998 111.346 176.709 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 67' ' ' PRO . . . . . 0.471 ' HD2' ' HB ' ' A' ' 66' ' ' VAL . 37.3 Cg_exo -36.04 -57.91 0.51 Allowed 'Trans proline' 0 C--N 1.359 1.081 0 C-N-CA 123.814 3.009 . . . . 71.349999999999994 115.176 -175.695 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . -119.76 63.57 0.46 Allowed Glycine 0 CA--C 1.527 0.814 0 C-N-CA 120.758 -0.734 . . . . 64.230000000000004 114.042 -175.422 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . -162.27 147.22 9.85 Favored Pre-proline 0 N--CA 1.47 0.574 0 O-C-N 122.352 -0.499 . . . . 54.450000000000003 111.951 176.065 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 70' ' ' PRO . . . . . . . . . . . . . 70.2 Cg_endo -73.3 163.65 37.32 Favored 'Trans proline' 0 CA--C 1.541 0.839 0 C-N-CA 122.498 2.132 . . . . 70.439999999999998 112.606 176.793 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 71' ' ' LYS . . . . . 0.496 ' HD3' ' N ' ' A' ' 71' ' ' LYS . 0.0 OUTLIER -152.3 168.66 24.67 Favored 'General case' 0 N--CA 1.47 0.572 0 CA-C-O 121.348 0.595 . . . . 72.530000000000001 112.511 -174.928 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -135.33 107.64 10.22 Favored Pre-proline 0 CA--C 1.539 0.54 0 CA-C-N 115.752 -0.658 . . . . 54.149999999999999 110.541 175.378 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 73' ' ' PRO . . . . . . . . . . . . . 74.5 Cg_endo -74.44 130.55 14.01 Favored 'Trans proline' 0 CA--C 1.542 0.909 0 C-N-CA 122.522 2.148 . . . . 71.430000000000007 113.536 -176.999 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -96.52 97.7 9.62 Favored 'General case' 0 CA--C 1.536 0.438 0 CA-C-N 116.385 -0.371 . . . . 73.519999999999996 111.176 177.113 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 75' ' ' ALA . . . . . 0.401 ' HB3' ' HD3' ' A' ' 19' ' ' PRO . . . . . . . . 0 C--O 1.253 1.242 0 CA-C-O 118.727 -0.654 . . . . 74.25 111.613 -178.838 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 49.9 ttp . . . . . 0 N--CA 1.49 1.54 0 CA-C-O 120.607 0.242 . . . . 73.340000000000003 111.063 . . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . 150.22 66.47 0.01 OUTLIER Glycine 0 CA--C 1.524 0.646 0 C-N-CA 120.962 -0.637 . . . . 73.030000000000001 113.245 177.607 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 3' ' ' HIS . . . . . . . . . . . . . 53.8 m80 -65.91 108.22 2.1 Favored 'General case' 0 N--CA 1.468 0.468 0 CA-C-O 120.95 0.405 . . . . 72.329999999999998 111.326 178.508 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 4' ' ' HIS . . . . . . . . . . . . . 40.3 m80 -67.55 118.73 11.25 Favored 'General case' 0 CA--C 1.539 0.542 0 CA-C-O 120.968 0.414 . . . . 71.019999999999996 111.144 -179.7 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 5' ' ' HIS . . . . . . . . . . . . . 33.1 p80 -75.15 157.01 35.31 Favored 'General case' 0 N--CA 1.473 0.695 0 N-CA-C 113.318 0.859 . . . . 75.439999999999998 113.318 -172.771 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 5.0 p-80 -127.04 161.02 29.39 Favored 'General case' 0 N--CA 1.469 0.483 0 CA-C-N 115.133 -0.939 . . . . 75.219999999999999 110.046 175.381 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 7.1 p80 -157.14 127.96 6.65 Favored 'General case' 0 CA--C 1.542 0.657 0 CA-C-O 121.258 0.552 . . . . 74.109999999999999 112.156 177.632 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 8' ' ' HIS . . . . . . . . . . . . . 15.8 p-80 -78.48 135.58 37.4 Favored 'General case' 0 N--CA 1.47 0.55 0 CA-C-N 115.859 -0.61 . . . . 74.109999999999999 111.411 179.045 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 78.5 p -135.88 125.36 25.08 Favored 'General case' 0 N--CA 1.471 0.605 0 CA-C-O 121.017 0.437 . . . . 75.120000000000005 111.697 179.595 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 59.1 t-80 -154.21 145.61 23.05 Favored 'General case' 0 CA--C 1.538 0.513 0 CA-C-N 116.285 -0.416 . . . . 63.299999999999997 110.785 176.841 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 11' ' ' MET . . . . . . . . . . . . . 58.5 ttp -113.97 146.94 39.41 Favored 'General case' 0 CA--C 1.545 0.753 0 CA-C-O 120.92 0.391 . . . . 74.420000000000002 111.982 -176.882 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 47.1 t -135.81 94.79 3.12 Favored 'General case' 0 N--CA 1.475 0.778 0 CA-C-O 121.085 0.469 . . . . 75.209999999999994 111.014 175.729 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 13' ' ' THR . . . . . . . . . . . . . 46.8 p -119.34 112.59 35.76 Favored Pre-proline 0 N--CA 1.472 0.633 0 CA-C-N 116.401 -0.363 . . . . 74.530000000000001 111.854 -178.834 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 14' ' ' PRO . . . . . . . . . . . . . 63.5 Cg_endo -72.98 123.27 8.77 Favored 'Trans proline' 0 CA--C 1.542 0.904 0 C-N-CA 122.393 2.062 . . . . 64.219999999999999 112.419 177.22 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 2.4 pp -85.04 170.5 12.91 Favored 'General case' 0 CA--C 1.539 0.547 0 CA-C-O 121.204 0.526 . . . . 73.420000000000002 112.041 -177.553 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 16' ' ' THR . . . . . . . . . . . . . 64.9 p -110.57 162.77 14.39 Favored 'General case' 0 N--CA 1.471 0.594 0 CA-C-O 121.084 0.469 . . . . 62.509999999999998 111.86 -179.55 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . 145.62 139.42 3.38 Favored Glycine 0 CA--C 1.526 0.749 0 CA-C-N 116.104 -0.498 . . . . 74.239999999999995 112.554 179.74 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 16.8 ptpt -141.83 90.07 8.74 Favored Pre-proline 0 CA--C 1.542 0.648 0 CA-C-O 121.189 0.518 . . . . 74.140000000000001 111.887 -178.628 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 87.9 Cg_endo -85.2 123.59 2.69 Favored 'Trans proline' 0 CA--C 1.543 0.929 0 C-N-CA 122.745 2.297 . . . . 75.299999999999997 112.686 176.318 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . -75.82 71.53 1.89 Allowed Glycine 0 CA--C 1.525 0.7 0 C-N-CA 120.947 -0.644 . . . . 73.140000000000001 112.639 179.335 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -141.17 173.9 11.05 Favored 'General case' 0 CA--C 1.539 0.544 0 CA-C-O 120.995 0.426 . . . . 73.450000000000003 112.022 -178.509 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 22' ' ' LEU . . . . . 0.462 ' HG ' ' HG3' ' A' ' 60' ' ' GLN . 91.3 mt -130.24 144.01 51.5 Favored Pre-proline 0 N--CA 1.475 0.786 0 CA-C-N 116.03 -0.532 . . . . 74.340000000000003 111.269 177.941 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 23' ' ' PRO . . . . . 0.438 ' HG2' HD22 ' A' ' 26' ' ' LEU . 46.9 Cg_endo -70.32 150.34 64.65 Favored 'Trans proline' 0 CA--C 1.541 0.838 0 C-N-CA 122.191 1.927 . . . . 75.230000000000004 111.751 170.714 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -67.17 -39.63 86.5 Favored 'General case' 0 N--CA 1.47 0.556 0 CA-C-O 121.023 0.44 . . . . 74.019999999999996 112.02 -177.855 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 25' ' ' ASN . . . . . 0.42 ' HB3' ' HB2' ' A' ' 28' ' ' ASP . 1.9 m-20 -92.57 72.44 5.08 Favored 'General case' 0 CA--C 1.537 0.456 0 CA-C-O 121.107 0.479 . . . . 75.340000000000003 111.812 -178.613 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 26' ' ' LEU . . . . . 0.438 HD22 ' HG2' ' A' ' 23' ' ' PRO . 92.9 mt -72.28 -33.49 67.48 Favored 'General case' 0 CA--C 1.536 0.412 0 CA-C-N 116.332 -0.395 . . . . 72.299999999999997 111.685 179.029 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 36.3 t70 -72.83 -25.17 61.03 Favored 'General case' 0 CA--C 1.538 0.516 0 O-C-N 122.17 -0.331 . . . . 73.340000000000003 111.42 178.611 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 28' ' ' ASP . . . . . 0.42 ' HB2' ' HB3' ' A' ' 25' ' ' ASN . 16.3 m-20 -74.91 -15.36 60.7 Favored 'General case' 0 N--CA 1.469 0.508 0 CA-C-O 120.89 0.376 . . . . 74.019999999999996 111.296 175.155 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 29' ' ' MET . . . . . . . . . . . . . 86.1 mtp -81.65 137.8 35.4 Favored 'General case' 0 CA--C 1.536 0.419 0 CA-C-O 121.01 0.433 . . . . 65.209999999999994 110.947 175.76 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 30' ' ' LYS . . . . . 0.439 ' HB2' ' HG2' ' A' ' 33' ' ' GLU . 51.3 mtmt -66.85 155.41 38.4 Favored 'General case' 0 CA--C 1.541 0.624 0 CA-C-N 116.302 -0.408 . . . . 74.409999999999997 111.357 -179.989 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 90.2 t -54.06 -42.4 54.82 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.713 0 N-CA-C 111.963 0.357 . . . . 73.239999999999995 111.963 -177.673 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -63.27 -33.08 74.72 Favored 'General case' 0 CA--C 1.539 0.528 0 CA-C-O 120.791 0.329 . . . . 74.510000000000005 111.643 177.68 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 33' ' ' GLU . . . . . 0.439 ' HG2' ' HB2' ' A' ' 30' ' ' LYS . 57.9 mm-40 -70.22 -47.61 60.68 Favored 'General case' 0 N--CA 1.468 0.426 0 CA-C-O 120.919 0.39 . . . . 71.530000000000001 110.636 177.462 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 97.7 mt -57.35 -46.08 83.68 Favored 'General case' 0 CA--C 1.539 0.535 0 CA-C-N 116.234 -0.439 . . . . 70.040000000000006 111.144 176.228 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 55.2 mtmt -63.98 -32.47 74.01 Favored 'General case' 0 CA--C 1.539 0.538 0 CA-C-N 116.426 -0.352 . . . . 74.230000000000004 111.568 177.5 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 51.5 tp60 -65.81 -49.6 67.69 Favored 'General case' 0 CA--C 1.539 0.533 0 CA-C-O 121.008 0.433 . . . . 71.510000000000005 110.067 175.495 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 37' ' ' GLU . . . . . 0.622 ' HB3' HH21 ' A' ' 41' ' ' ARG . 42.2 mm-40 -54.75 -31.77 59.0 Favored 'General case' 0 N--CA 1.472 0.637 0 CA-C-N 115.921 -0.581 . . . . 70.120000000000005 111.591 175.562 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 38' ' ' LEU . . . . . 0.423 ' CD1' HD23 ' A' ' 52' ' ' LEU . 91.5 mt -72.02 -62.2 1.51 Allowed 'General case' 0 CA--C 1.538 0.488 0 CA-C-N 116.284 -0.416 . . . . 73.409999999999997 111.92 176.694 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 20.6 ptmt -58.92 -34.28 71.53 Favored 'General case' 0 CA--C 1.541 0.599 0 N-CA-C 112.622 0.601 . . . . 72.209999999999994 112.622 -172.929 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 93.0 mt -64.87 -22.46 67.0 Favored 'General case' 0 N--CA 1.475 0.793 0 CA-C-O 121.193 0.521 . . . . 63.130000000000003 111.568 177.743 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 41' ' ' ARG . . . . . 0.622 HH21 ' HB3' ' A' ' 37' ' ' GLU . 15.5 mtm180 -109.72 27.12 9.89 Favored 'General case' 0 CA--C 1.541 0.603 0 CA-C-N 116.136 -0.484 . . . . 75.219999999999999 111.604 177.77 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 28.0 t 70.23 5.34 5.27 Favored 'General case' 0 N--CA 1.478 0.97 0 N-CA-C 112.809 0.67 . . . . 74.049999999999997 112.809 174.818 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 61.4 mt -82.8 142.38 45.26 Favored Pre-proline 0 CA--C 1.542 0.639 0 CA-C-O 120.723 0.297 . . . . 75.019999999999996 111.468 -179.569 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 44' ' ' PRO . . . . . 0.409 ' HG2' ' NH1' ' A' ' 55' ' ' ARG . 59.2 Cg_endo -70.13 143.79 50.14 Favored 'Trans proline' 0 C--N 1.352 0.723 0 C-N-CA 122.476 2.117 . . . . 73.310000000000002 112.567 178.411 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 30.2 m -95.09 16.45 1.99 Allowed 'Isoleucine or valine' 0 CA--C 1.54 0.59 0 CA-C-O 121.22 0.533 . . . . 71.310000000000002 111.93 -177.063 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 33.0 t -90.53 89.42 7.55 Favored 'General case' 0 N--CA 1.47 0.528 0 CA-C-N 116.247 -0.433 . . . . 74.450000000000003 111.455 179.713 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . -172.82 174.88 45.88 Favored Glycine 0 CA--C 1.528 0.867 0 C-N-CA 120.711 -0.757 . . . . 62.119999999999997 113.851 178.68 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 48' ' ' THR . . . . . 0.588 ' O ' ' HG ' ' A' ' 52' ' ' LEU . 68.3 p -93.12 170.03 9.95 Favored 'General case' 0 N--CA 1.469 0.516 0 C-N-CA 122.58 0.352 . . . . 72.400000000000006 111.019 178.748 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 22.8 tptm -44.47 -54.57 5.84 Favored 'General case' 0 N--CA 1.472 0.656 0 N-CA-C 112.135 0.42 . . . . 72.319999999999993 112.135 -179.02 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 50' ' ' THR . . . . . . . . . . . . . 51.4 m -69.96 -40.9 75.14 Favored 'General case' 0 CA--C 1.538 0.482 0 CA-C-N 116.405 -0.361 . . . . 75.219999999999999 111.781 -179.59 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 2.9 tm-20 -55.17 -48.82 73.24 Favored 'General case' 0 CA--C 1.542 0.647 0 CA-C-N 116.354 -0.384 . . . . 72.230000000000004 111.246 179.298 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 52' ' ' LEU . . . . . 0.588 ' HG ' ' O ' ' A' ' 48' ' ' THR . 54.2 mt -56.47 -46.38 80.44 Favored 'General case' 0 N--CA 1.47 0.556 0 CA-C-O 121.137 0.494 . . . . 73.239999999999995 111.059 179.169 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 53' ' ' ILE . . . . . . . . . . . . . 78.9 mt -56.23 -53.12 43.28 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.534 0 CA-C-N 115.948 -0.569 . . . . 75.150000000000006 111.634 178.162 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 38.9 mt-10 -68.31 -28.14 66.91 Favored 'General case' 0 CA--C 1.536 0.438 0 CA-C-N 116.243 -0.435 . . . . 72.450000000000003 111.816 -178.897 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 55' ' ' ARG . . . . . 0.409 ' NH1' ' HG2' ' A' ' 44' ' ' PRO . 41.9 ttm-85 -68.69 -38.71 80.54 Favored 'General case' 0 CA--C 1.537 0.481 0 CA-C-O 121.122 0.486 . . . . 74.230000000000004 110.596 176.752 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 62.4 mt -56.73 -48.39 77.88 Favored 'General case' 0 CA--C 1.538 0.494 0 CA-C-N 116.088 -0.506 . . . . 72.310000000000002 111.137 173.482 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 54.1 mtm180 -61.48 -41.96 98.05 Favored 'General case' 0 N--CA 1.469 0.497 0 CA-C-N 116.577 -0.283 . . . . 75.450000000000003 111.186 177.78 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -55.25 -41.21 71.85 Favored 'General case' 0 N--CA 1.471 0.584 0 CA-C-O 120.943 0.402 . . . . 61.119999999999997 111.682 179.703 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 59' ' ' TYR . . . . . . . . . . . . . 87.0 t80 -69.73 -51.57 33.07 Favored 'General case' 0 CA--C 1.536 0.44 0 CA-C-O 121.092 0.472 . . . . 74.319999999999993 110.833 176.207 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 60' ' ' GLN . . . . . 0.462 ' HG3' ' HG ' ' A' ' 22' ' ' LEU . 17.6 mm100 -58.42 -29.29 65.99 Favored 'General case' 0 CA--C 1.539 0.547 0 CA-C-N 116.101 -0.499 . . . . 71.129999999999995 112.264 179.484 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 61' ' ' ASP . . . . . . . . . . . . . 19.5 t70 -71.91 -45.27 61.8 Favored 'General case' 0 C--N 1.321 -0.65 0 CA-C-N 116.178 -0.465 . . . . 74.25 111.633 179.094 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 62' ' ' GLN . . . . . . . . . . . . . 11.0 pt20 -80.33 -18.62 48.64 Favored 'General case' 0 CA--C 1.54 0.589 0 N-CA-C 112.706 0.632 . . . . 75.430000000000007 112.706 -175.348 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 63' ' ' ILE . . . . . . . . . . . . . 39.5 pt -90.15 -22.34 6.41 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.721 0 O-C-N 121.841 -0.537 . . . . 74.219999999999999 112.076 177.012 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 33.0 t -102.19 133.43 20.62 Favored Pre-proline 0 N--CA 1.473 0.688 0 O-C-N 122.298 -0.251 . . . . 75.25 111.388 -178.073 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 65' ' ' PRO . . . . . . . . . . . . . 51.1 Cg_exo -56.74 122.11 11.23 Favored 'Trans proline' 0 CA--C 1.539 0.737 0 C-N-CA 122.659 2.24 . . . . 74.519999999999996 112.819 178.275 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 66' ' ' VAL . . . . . . . . . . . . . 27.6 m -67.79 114.14 18.48 Favored Pre-proline 0 CA--C 1.546 0.789 0 CA-C-O 120.864 0.364 . . . . 75.120000000000005 111.501 -179.79 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 67' ' ' PRO . . . . . . . . . . . . . 17.9 Cg_exo -66.84 93.92 0.33 Allowed 'Trans proline' 0 CA--C 1.537 0.639 0 C-N-CA 122.76 2.307 . . . . 72.420000000000002 112.767 -177.445 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 76.96 -55.7 3.51 Favored Glycine 0 CA--C 1.531 1.07 0 C-N-CA 121.235 -0.507 . . . . 71.349999999999994 113.489 -179.468 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . 70.29 145.33 0.11 Allowed Pre-proline 0 N--CA 1.472 0.653 0 C-N-CA 123.07 0.548 . . . . 71.230000000000004 112.09 -179.471 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 70' ' ' PRO . . . . . . . . . . . . . 52.2 Cg_exo -56.78 143.96 88.81 Favored 'Trans proline' 0 CA--C 1.542 0.901 0 C-N-CA 122.708 2.272 . . . . 73.150000000000006 113.123 177.653 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 71' ' ' LYS . . . . . 0.502 ' HD3' ' O ' ' A' ' 71' ' ' LYS . 0.1 OUTLIER -78.79 142.71 36.74 Favored 'General case' 0 CA--C 1.539 0.545 0 CA-C-O 121.114 0.483 . . . . 72.420000000000002 111.465 179.011 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -93.65 141.96 24.51 Favored Pre-proline 0 CA--C 1.542 0.65 0 CA-C-N 116.151 -0.477 . . . . 62.32 111.65 179.351 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 73' ' ' PRO . . . . . . . . . . . . . 33.9 Cg_exo -58.22 104.13 0.17 Allowed 'Trans proline' 0 CA--C 1.542 0.897 0 C-N-CA 122.609 2.206 . . . . 75.519999999999996 112.82 178.201 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -73.91 138.04 44.04 Favored 'General case' 0 CA--C 1.537 0.451 0 CA-C-O 120.941 0.4 . . . . 74.420000000000002 111.585 -178.973 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.253 1.275 0 CA-C-O 118.676 -0.678 . . . . 70.430000000000007 111.512 177.652 . . . . . . . . 0 0 . 1 . 011 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 21.2 mmt . . . . . 0 N--CA 1.49 1.539 0 N-CA-C 110.533 -0.173 . . . . 55.420000000000002 110.533 . . . . . . . . . 0 0 . 1 . 011 nuclear orig full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . 145.86 164.99 11.15 Favored Glycine 0 CA--C 1.526 0.748 0 C-N-CA 120.834 -0.698 . . . . 72.019999999999996 113.46 179.414 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 3' ' ' HIS . . . . . . . . . . . . . 47.7 m80 -146.85 -178.85 6.41 Favored 'General case' 0 N--CA 1.473 0.71 0 CA-C-O 121.448 0.642 . . . . 72.099999999999994 112.461 -178.186 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 4' ' ' HIS . . . . . . . . . . . . . 16.2 p-80 -151.22 121.17 7.11 Favored 'General case' 0 CA--C 1.54 0.587 0 CA-C-N 115.632 -0.713 . . . . 72.030000000000001 110.849 -178.85 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 5' ' ' HIS . . . . . . . . . . . . . 53.3 t-80 -144.19 138.62 28.21 Favored 'General case' 0 CA--C 1.54 0.594 0 CA-C-O 121.175 0.512 . . . . 75.439999999999998 112.355 -173.855 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 66.9 m80 -115.08 178.55 4.24 Favored 'General case' 0 N--CA 1.47 0.546 0 CA-C-N 115.933 -0.576 . . . . 72.329999999999998 110.479 172.612 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 29.1 p80 -126.11 161.67 27.11 Favored 'General case' 0 N--CA 1.472 0.636 0 CA-C-O 120.809 0.338 . . . . 75.109999999999999 111.256 178.533 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 8' ' ' HIS . . . . . . . . . . . . . 96.6 m-70 -77.67 167.08 22.16 Favored 'General case' 0 N--CA 1.469 0.487 0 CA-C-O 121.482 0.658 . . . . 64.319999999999993 112.602 -177.781 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 57.7 p -91.73 169.74 10.47 Favored 'General case' 0 N--CA 1.469 0.487 0 CA-C-N 115.062 -0.972 . . . . 73.510000000000005 110.674 174.355 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 49.0 m80 -106.06 87.79 2.65 Favored 'General case' 0 N--CA 1.469 0.483 0 CA-C-O 121.291 0.567 . . . . 73.400000000000006 112.153 -178.436 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 11' ' ' MET . . . . . . . . . . . . . 24.0 mmt -103.0 121.34 42.35 Favored 'General case' 0 CA--C 1.536 0.442 0 CA-C-N 116.033 -0.531 . . . . 74.5 110.956 179.65 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 35.2 t -114.81 176.64 4.96 Favored 'General case' 0 N--CA 1.474 0.764 0 CA-C-O 121.115 0.483 . . . . 74.340000000000003 112.083 -176.672 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 13' ' ' THR . . . . . . . . . . . . . 72.1 p -109.86 143.52 28.09 Favored Pre-proline 0 N--CA 1.473 0.689 0 CA-C-N 116.025 -0.534 . . . . 72.239999999999995 111.237 178.714 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 14' ' ' PRO . . . . . . . . . . . . . 15.5 Cg_exo -69.91 172.13 13.36 Favored 'Trans proline' 0 CA--C 1.54 0.793 0 C-N-CA 122.657 2.238 . . . . 65.349999999999994 112.743 177.33 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 76.4 mt -79.62 147.96 31.86 Favored 'General case' 0 CA--C 1.537 0.474 0 O-C-N 122.251 -0.28 . . . . 75.109999999999999 111.292 179.41 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 16' ' ' THR . . . . . . . . . . . . . 7.3 m -52.21 -48.03 65.31 Favored 'General case' 0 N--CA 1.475 0.776 0 N-CA-C 112.045 0.387 . . . . 72.420000000000002 112.045 -179.188 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . 173.46 61.65 0.05 OUTLIER Glycine 0 CA--C 1.527 0.837 0 C-N-CA 120.985 -0.626 . . . . 72.010000000000005 113.375 177.966 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 14.2 mptt -96.13 133.09 25.6 Favored Pre-proline 0 CA--C 1.544 0.74 0 O-C-N 122.39 -0.477 . . . . 75.340000000000003 111.223 178.272 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 71.8 Cg_endo -75.23 117.71 4.96 Favored 'Trans proline' 0 CA--C 1.541 0.831 0 C-N-CA 122.986 2.458 . . . . 73.049999999999997 113.264 -178.491 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . -100.47 124.6 8.3 Favored Glycine 0 CA--C 1.528 0.892 0 C-N-CA 121.089 -0.577 . . . . 55.5 113.216 179.52 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -160.67 -178.11 6.64 Favored 'General case' 0 N--CA 1.47 0.549 0 CA-C-O 121.011 0.434 . . . . 72.340000000000003 112.056 -179.576 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 98.8 mt -72.87 155.58 90.5 Favored Pre-proline 0 CA--C 1.541 0.632 0 CA-C-N 116.232 -0.44 . . . . 72.230000000000004 111.051 177.716 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 23' ' ' PRO . . . . . . . . . . . . . 74.5 Cg_exo -50.81 130.39 30.63 Favored 'Trans proline' 0 CA--C 1.541 0.87 0 C-N-CA 122.538 2.159 . . . . 74.299999999999997 112.898 177.266 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -55.33 -43.83 75.32 Favored 'General case' 0 CA--C 1.539 0.523 0 CA-C-O 121.106 0.479 . . . . 71.310000000000002 112.132 -178.022 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 14.7 m120 -97.77 67.97 2.03 Favored 'General case' 0 CA--C 1.537 0.455 0 N-CA-C 112.122 0.416 . . . . 62.119999999999997 112.122 179.219 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 96.5 mt -63.63 -28.58 70.01 Favored 'General case' 0 N--CA 1.47 0.539 0 CA-C-O 121.614 0.721 . . . . 73.340000000000003 110.086 170.444 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 8.8 p-10 -64.74 -25.17 67.81 Favored 'General case' 0 CA--C 1.539 0.54 0 CA-C-N 115.346 -0.843 . . . . 72.040000000000006 111.835 177.788 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 34.7 t70 -84.23 -6.77 59.44 Favored 'General case' 0 CA--C 1.543 0.698 0 CA-C-O 120.945 0.402 . . . . 73.319999999999993 111.65 -179.857 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 29' ' ' MET . . . . . 0.449 ' O ' ' HE3' ' A' ' 49' ' ' LYS . 83.6 mtp -87.66 166.78 14.43 Favored 'General case' 0 CA--C 1.541 0.613 0 CA-C-O 121.062 0.458 . . . . 70.420000000000002 111.752 179.875 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 30' ' ' LYS . . . . . 0.536 ' HB2' ' HG2' ' A' ' 33' ' ' GLU . 29.0 mtpp -84.17 153.1 23.87 Favored 'General case' 0 CA--C 1.54 0.585 0 CA-C-N 116.487 -0.324 . . . . 74.099999999999994 111.458 179.731 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 65.6 t -53.47 -57.1 5.77 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.772 0 N-CA-C 112.164 0.431 . . . . 74.409999999999997 112.164 -178.261 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 32' ' ' ALA . . . . . 0.524 ' HA ' ' HD3' ' A' ' 35' ' ' LYS . . . -58.38 -29.3 65.92 Favored 'General case' 0 N--CA 1.472 0.641 0 N-CA-C 112.214 0.449 . . . . 70.150000000000006 112.214 -178.85 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 33' ' ' GLU . . . . . 0.536 ' HG2' ' HB2' ' A' ' 30' ' ' LYS . 13.9 mm-40 -74.41 -38.95 62.94 Favored 'General case' 0 CA--C 1.538 0.519 0 CA-C-O 120.75 0.309 . . . . 74.319999999999993 110.938 179.413 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 92.9 mt -63.61 -44.14 94.82 Favored 'General case' 0 N--CA 1.47 0.531 0 CA-C-O 121.271 0.558 . . . . 72.230000000000004 110.308 172.925 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 35' ' ' LYS . . . . . 0.524 ' HD3' ' HA ' ' A' ' 32' ' ' ALA . 58.2 mtpt -55.84 -41.26 74.02 Favored 'General case' 0 N--CA 1.468 0.469 0 CA-C-N 115.775 -0.648 . . . . 74.120000000000005 111.447 176.658 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 36' ' ' GLN . . . . . 0.403 ' O ' ' HG ' ' A' ' 40' ' ' LEU . 58.3 tp60 -56.69 -52.85 63.34 Favored 'General case' 0 CA--C 1.539 0.531 0 CA-C-O 120.876 0.37 . . . . 74.010000000000005 110.775 175.855 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 37' ' ' GLU . . . . . 0.628 ' HB3' ' NH2' ' A' ' 41' ' ' ARG . 25.9 mm-40 -57.91 -36.43 72.43 Favored 'General case' 0 CA--C 1.54 0.594 0 N-CA-C 112.253 0.464 . . . . 71.439999999999998 112.253 177.784 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 38' ' ' LEU . . . . . 0.403 ' CD1' HD21 ' A' ' 52' ' ' LEU . 88.0 mt -66.26 -58.33 5.59 Favored 'General case' 0 CA--C 1.539 0.54 0 CA-C-O 120.887 0.375 . . . . 71.409999999999997 111.549 177.14 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 20.7 ptmt -61.25 -30.24 70.33 Favored 'General case' 0 CA--C 1.54 0.585 0 N-CA-C 111.99 0.367 . . . . 73.230000000000004 111.99 -175.433 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 40' ' ' LEU . . . . . 0.403 ' HG ' ' O ' ' A' ' 36' ' ' GLN . 87.1 mt -68.21 -25.9 65.45 Favored 'General case' 0 CA--C 1.541 0.611 0 O-C-N 122.249 -0.282 . . . . 74.549999999999997 111.722 176.851 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 41' ' ' ARG . . . . . 0.643 HH21 HD22 ' A' ' 56' ' ' LEU . 80.8 mtm-85 -110.77 25.5 11.71 Favored 'General case' 0 N--CA 1.472 0.656 0 N-CA-C 112.051 0.389 . . . . 75.450000000000003 112.051 179.953 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 31.9 t 63.1 34.15 13.94 Favored 'General case' 0 N--CA 1.479 1.008 0 N-CA-C 112.415 0.524 . . . . 72.239999999999995 112.415 174.832 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 64.3 mt -105.16 138.55 19.56 Favored Pre-proline 0 CA--C 1.541 0.625 0 CA-C-N 116.554 -0.293 . . . . 74.209999999999994 111.499 179.367 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 44' ' ' PRO . . . . . 0.412 ' HG2' ' NH1' ' A' ' 55' ' ' ARG . 37.2 Cg_endo -66.84 131.64 26.24 Favored 'Trans proline' 0 CA--C 1.544 1.007 0 C-N-CA 122.524 2.149 . . . . 63.43 112.801 178.066 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 34.2 m -102.47 17.22 4.51 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.748 0 N-CA-C 112.356 0.502 . . . . 75.150000000000006 112.356 -174.948 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 69.3 m -81.36 13.33 3.0 Favored 'General case' 0 N--CA 1.478 0.942 0 N-CA-C 113.329 0.863 . . . . 61.030000000000001 113.329 -175.552 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . -104.45 172.28 20.18 Favored Glycine 0 CA--C 1.529 0.912 0 C-N-CA 120.908 -0.663 . . . . 38.350000000000001 113.973 -175.983 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 48' ' ' THR . . . . . 0.563 ' O ' ' HG ' ' A' ' 52' ' ' LEU . 43.4 p -77.0 169.23 18.71 Favored 'General case' 0 N--CA 1.473 0.707 0 O-C-N 122.504 -0.41 . . . . 75.099999999999994 110.87 176.785 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 49' ' ' LYS . . . . . 0.504 ' HE2' HD12 ' A' ' 53' ' ' ILE . 23.7 tptm -42.22 -51.15 4.81 Favored 'General case' 0 N--CA 1.475 0.776 0 CA-C-O 120.942 0.401 . . . . 74.439999999999998 111.598 176.818 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 50' ' ' THR . . . . . . . . . . . . . 31.1 m -60.88 -47.07 88.08 Favored 'General case' 0 CA--C 1.539 0.548 0 CA-C-N 116.01 -0.541 . . . . 74.140000000000001 111.769 -179.919 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 42.4 mt-10 -64.44 -38.13 89.96 Favored 'General case' 0 N--CA 1.472 0.637 0 CA-C-O 120.798 0.332 . . . . 74.400000000000006 111.789 -177.018 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 52' ' ' LEU . . . . . 0.563 ' HG ' ' O ' ' A' ' 48' ' ' THR . 43.8 mt -61.24 -44.23 97.59 Favored 'General case' 0 N--CA 1.47 0.542 0 CA-C-O 121.309 0.576 . . . . 72.439999999999998 110.458 177.175 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 53' ' ' ILE . . . . . 0.504 HD12 ' HE2' ' A' ' 49' ' ' LYS . 70.0 mt -60.77 -55.82 22.01 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.51 0 CA-C-N 115.643 -0.708 . . . . 75.349999999999994 111.149 176.645 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 53.9 mm-40 -54.99 -41.11 70.82 Favored 'General case' 0 CA--C 1.538 0.493 0 CA-C-N 116.161 -0.472 . . . . 73.340000000000003 111.74 -179.493 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 55' ' ' ARG . . . . . 0.412 ' NH1' ' HG2' ' A' ' 44' ' ' PRO . 30.9 ttm180 -63.36 -38.12 89.9 Favored 'General case' 0 CA--C 1.541 0.625 0 CA-C-N 116.237 -0.438 . . . . 74.340000000000003 111.361 179.643 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 56' ' ' LEU . . . . . 0.643 HD22 HH21 ' A' ' 41' ' ' ARG . 68.6 mt -68.72 -46.81 67.98 Favored 'General case' 0 N--CA 1.472 0.631 0 CA-C-O 120.757 0.313 . . . . 73.409999999999997 111.452 174.563 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 57' ' ' ARG . . . . . 0.442 ' HG3' ' O ' ' A' ' 53' ' ' ILE . 69.0 mtp180 -55.79 -46.17 78.03 Favored 'General case' 0 N--CA 1.471 0.593 0 CA-C-O 121.246 0.546 . . . . 74.140000000000001 111.073 178.713 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -69.13 -40.97 77.94 Favored 'General case' 0 CA--C 1.536 0.434 0 CA-C-N 116.021 -0.536 . . . . 74.5 112.132 -179.954 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 59' ' ' TYR . . . . . . . . . . . . . 49.6 t80 -63.84 -28.47 69.88 Favored 'General case' 0 N--CA 1.469 0.508 0 CA-C-O 121.051 0.453 . . . . 75.200000000000003 110.894 177.695 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 60' ' ' GLN . . . . . . . . . . . . . 17.4 tm0? -78.36 -44.8 24.1 Favored 'General case' 0 CA--C 1.542 0.663 0 CA-C-N 116.196 -0.456 . . . . 75.310000000000002 110.355 176.381 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 61' ' ' ASP . . . . . . . . . . . . . 17.1 t70 -55.17 -45.97 75.78 Favored 'General case' 0 CA--C 1.542 0.642 0 N-CA-C 112.36 0.504 . . . . 64.230000000000004 112.36 179.359 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 62' ' ' GLN . . . . . . . . . . . . . 9.3 pt20 -65.29 -22.35 66.84 Favored 'General case' 0 CA--C 1.542 0.671 0 N-CA-C 112.588 0.588 . . . . 74.019999999999996 112.588 -177.36 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 63' ' ' ILE . . . . . . . . . . . . . 34.9 pt -102.37 -17.1 7.12 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.71 0 N-CA-C 112.0 0.37 . . . . 74.0 112.0 177.535 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 35.4 t 71.19 147.33 0.12 Allowed Pre-proline 0 N--CA 1.483 1.182 0 C-N-CA 123.348 0.659 . . . . 71.129999999999995 112.554 177.985 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 65' ' ' PRO . . . . . . . . . . . . . 36.1 Cg_exo -60.3 103.54 0.22 Allowed 'Trans proline' 0 C--N 1.357 0.983 0 C-N-CA 122.353 2.035 . . . . 73.239999999999995 112.422 174.186 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 66' ' ' VAL . . . . . . . . . . . . . 26.8 m -96.82 143.67 26.51 Favored Pre-proline 0 CA--C 1.542 0.644 0 N-CA-C 112.25 0.463 . . . . 73.239999999999995 112.25 -175.94 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 67' ' ' PRO . . . . . . . . . . . . . 38.2 Cg_endo -66.1 122.04 9.49 Favored 'Trans proline' 0 C--N 1.352 0.745 0 C-N-CA 122.597 2.198 . . . . 71.239999999999995 112.329 177.943 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 124.15 -32.64 4.1 Favored Glycine 0 CA--C 1.525 0.718 0 C-N-CA 121.244 -0.503 . . . . 70.420000000000002 112.55 -178.538 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 69' ' ' ALA . . . . . 0.432 ' HB3' ' HD2' ' A' ' 70' ' ' PRO . . . -70.58 167.01 30.37 Favored Pre-proline 0 CA--C 1.543 0.683 0 O-C-N 122.665 -0.315 . . . . 70.150000000000006 111.108 176.232 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 70' ' ' PRO . . . . . 0.432 ' HD2' ' HB3' ' A' ' 69' ' ' ALA . 86.0 Cg_exo -44.11 118.49 1.67 Allowed 'Trans proline' 0 CA--C 1.544 0.996 0 C-N-CA 122.663 2.242 . . . . 73.409999999999997 113.677 177.544 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 58.5 pttt -59.12 107.46 0.55 Allowed 'General case' 0 CA--C 1.545 0.781 0 CA-C-O 121.184 0.516 . . . . 71.310000000000002 112.161 -179.002 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -159.26 106.95 1.53 Allowed Pre-proline 0 CA--C 1.537 0.455 0 N-CA-C 112.32 0.489 . . . . 72.099999999999994 112.32 -179.565 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 73' ' ' PRO . . . . . . . . . . . . . 73.7 Cg_endo -75.33 167.6 26.37 Favored 'Trans proline' 0 CA--C 1.54 0.8 0 C-N-CA 122.017 1.812 . . . . 75.129999999999995 112.201 173.365 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -63.56 157.31 24.04 Favored 'General case' 0 CA--C 1.54 0.574 0 N-CA-C 112.24 0.459 . . . . 53.549999999999997 112.24 -178.159 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.253 1.277 0 CA-C-O 118.887 -0.577 . . . . 72.510000000000005 112.339 -178.606 . . . . . . . . 0 0 . 1 . 012 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 25.9 ptt? . . . . . 0 N--CA 1.49 1.55 0 CA-C-O 120.773 0.32 . . . . 72.129999999999995 111.291 . . . . . . . . . 0 0 . 1 . 012 nuclear orig full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . 72.55 29.22 66.11 Favored Glycine 0 CA--C 1.529 0.948 0 C-N-CA 120.855 -0.688 . . . . 72.030000000000001 113.124 -178.806 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 3' ' ' HIS . . . . . . . . . . . . . 32.1 t-80 -86.33 11.55 11.99 Favored 'General case' 0 CA--C 1.545 0.776 0 O-C-N 122.545 -0.385 . . . . 74.209999999999994 111.609 -178.125 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 4' ' ' HIS . . . . . . . . . . . . . 28.0 p80 -46.71 140.32 4.62 Favored 'General case' 0 N--CA 1.474 0.75 0 CA-C-O 120.957 0.408 . . . . 74.540000000000006 112.099 177.568 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 5' ' ' HIS . . . . . . . . . . . . . 12.1 p80 -149.39 98.09 2.74 Favored 'General case' 0 CA--C 1.539 0.538 0 CA-C-O 121.203 0.525 . . . . 73.299999999999997 111.551 179.898 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 10.3 p-80 -160.49 128.93 4.69 Favored 'General case' 0 N--CA 1.469 0.481 0 CA-C-N 116.214 -0.448 . . . . 74.219999999999999 110.932 177.869 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 8.1 p80 -173.4 139.39 0.76 Allowed 'General case' 0 N--CA 1.468 0.469 0 CA-C-N 116.541 -0.299 . . . . 62.030000000000001 111.219 -179.644 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 8' ' ' HIS . . . . . . . . . . . . . 28.5 t-80 -164.28 112.96 1.15 Allowed 'General case' 0 CA--C 1.538 0.494 0 CA-C-O 120.805 0.336 . . . . 75.329999999999998 111.474 178.966 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 66.7 m -94.62 147.11 23.62 Favored 'General case' 0 N--CA 1.471 0.62 0 CA-C-N 116.388 -0.369 . . . . 74.340000000000003 111.209 177.736 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 87.5 m-70 -100.12 155.91 17.47 Favored 'General case' 0 N--CA 1.471 0.621 0 CA-C-O 121.078 0.466 . . . . 64.540000000000006 111.665 178.809 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 11' ' ' MET . . . . . . . . . . . . . 65.5 mtt -109.85 133.01 53.63 Favored 'General case' 0 N--CA 1.468 0.46 0 CA-C-N 116.235 -0.439 . . . . 72.349999999999994 110.741 176.93 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 50.7 m -127.27 132.39 50.36 Favored 'General case' 0 N--CA 1.471 0.611 0 CA-C-O 120.946 0.403 . . . . 74.420000000000002 111.169 -178.298 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 13' ' ' THR . . . . . . . . . . . . . 67.8 p -90.38 152.18 45.24 Favored Pre-proline 0 N--CA 1.47 0.53 0 CA-C-O 120.67 0.271 . . . . 62.030000000000001 111.455 -179.351 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 14' ' ' PRO . . . . . . . . . . . . . 73.0 Cg_endo -74.01 -166.37 0.31 Allowed 'Trans proline' 0 CA--C 1.542 0.888 0 C-N-CA 122.673 2.249 . . . . 75.329999999999998 113.698 -178.956 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 15' ' ' LEU . . . . . 0.429 ' N ' HD21 ' A' ' 15' ' ' LEU . 2.3 pt? -143.27 -173.7 4.0 Favored 'General case' 0 CA--C 1.54 0.558 0 CA-C-N 116.124 -0.489 . . . . 73.409999999999997 110.938 -178.924 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 16' ' ' THR . . . . . . . . . . . . . 71.6 p -74.65 -57.97 3.58 Favored 'General case' 0 N--CA 1.474 0.738 0 CA-C-O 120.971 0.415 . . . . 71.319999999999993 111.681 179.422 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . 68.84 22.06 75.4 Favored Glycine 0 CA--C 1.525 0.683 0 CA-C-N 116.115 -0.493 . . . . 52.350000000000001 112.374 -177.02 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 18' ' ' LYS . . . . . 0.44 ' HZ3' ' CB ' ' A' ' 18' ' ' LYS . 9.3 mtpm? -144.52 149.93 45.72 Favored Pre-proline 0 CA--C 1.541 0.628 0 O-C-N 122.619 -0.342 . . . . 71.040000000000006 111.917 -175.461 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 19' ' ' PRO . . . . . 0.408 ' HD3' ' HA ' ' A' ' 18' ' ' LYS . 11.3 Cg_exo -72.02 161.2 45.49 Favored 'Trans proline' 0 CA--C 1.54 0.786 0 C-N-CA 123.031 2.488 . . . . 72.549999999999997 112.461 173.97 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . -58.32 -46.92 92.3 Favored Glycine 0 CA--C 1.529 0.948 0 C-N-CA 120.887 -0.673 . . . . 53.200000000000003 113.212 178.24 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -88.67 -164.61 1.16 Allowed 'General case' 0 CA--C 1.541 0.622 0 CA-C-O 121.02 0.438 . . . . 72.25 111.708 178.85 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 22' ' ' LEU . . . . . 0.5 HD13 ' HB2' ' A' ' 60' ' ' GLN . 88.8 mt -65.73 127.35 93.0 Favored Pre-proline 0 CA--C 1.542 0.655 0 CA-C-N 116.483 -0.326 . . . . 74.299999999999997 110.984 177.637 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 23' ' ' PRO . . . . . 0.462 ' HD3' ' HA ' ' A' ' 22' ' ' LEU . 23.3 Cg_exo -62.86 163.1 23.06 Favored 'Trans proline' 0 CA--C 1.539 0.762 0 C-N-CA 123.013 2.475 . . . . 73.310000000000002 113.942 -174.554 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -87.27 14.07 8.52 Favored 'General case' 0 N--CA 1.47 0.567 0 CA-C-O 121.269 0.557 . . . . 43.350000000000001 111.289 176.293 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 12.0 m120 -104.13 9.27 36.36 Favored 'General case' 0 CA--C 1.536 0.432 0 CA-C-N 116.0 -0.545 . . . . 74.439999999999998 111.739 -177.639 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 26' ' ' LEU . . . . . 0.452 HD22 ' SD ' ' A' ' 29' ' ' MET . 63.3 mt -56.39 -27.04 55.1 Favored 'General case' 0 N--CA 1.475 0.812 0 CA-C-O 121.052 0.453 . . . . 53.530000000000001 111.849 -174.811 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 5.1 m-20 -61.73 -53.21 59.06 Favored 'General case' 0 CA--C 1.543 0.681 0 CA-C-N 116.07 -0.514 . . . . 60.530000000000001 111.158 174.825 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 12.2 m-20 -73.48 -32.55 64.38 Favored 'General case' 0 N--CA 1.471 0.586 0 CA-C-N 116.188 -0.46 . . . . 72.439999999999998 111.696 179.484 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 29' ' ' MET . . . . . 0.452 ' SD ' HD22 ' A' ' 26' ' ' LEU . 87.7 mtp -57.13 123.01 13.77 Favored 'General case' 0 N--CA 1.468 0.426 0 CA-C-O 121.049 0.452 . . . . 63.32 110.67 178.461 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 30' ' ' LYS . . . . . 0.435 ' HB2' ' OE1' ' A' ' 33' ' ' GLU . 59.8 mtpt -70.22 167.1 18.62 Favored 'General case' 0 CA--C 1.541 0.624 0 N-CA-C 113.098 0.777 . . . . 75.030000000000001 113.098 -170.722 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 46.5 t -50.66 -55.47 6.55 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.681 0 N-CA-C 112.726 0.639 . . . . 72.420000000000002 112.726 -174.46 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -60.47 -40.15 90.21 Favored 'General case' 0 N--CA 1.471 0.587 0 CA-C-O 120.979 0.419 . . . . 72.310000000000002 111.717 -179.378 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 33' ' ' GLU . . . . . 0.435 ' OE1' ' HB2' ' A' ' 30' ' ' LYS . 0.9 OUTLIER -58.49 -46.19 87.17 Favored 'General case' 0 CA--C 1.541 0.62 0 CA-C-N 115.838 -0.619 . . . . 71.340000000000003 111.412 177.113 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 34' ' ' LEU . . . . . 0.68 HD11 ' HZ1' ' A' ' 49' ' ' LYS . 91.6 mt -64.77 -46.43 82.17 Favored 'General case' 0 N--CA 1.471 0.594 0 CA-C-O 121.305 0.574 . . . . 74.430000000000007 111.019 176.756 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 35' ' ' LYS . . . . . 0.411 ' HZ3' ' HB3' ' A' ' 35' ' ' LYS . 9.0 mtpm? -60.94 -29.36 69.57 Favored 'General case' 0 CA--C 1.538 0.519 0 CA-C-N 115.882 -0.599 . . . . 71.450000000000003 111.929 179.112 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 54.2 tp60 -62.48 -47.63 83.17 Favored 'General case' 0 CA--C 1.538 0.496 0 CA-C-O 120.838 0.352 . . . . 74.099999999999994 110.849 176.95 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 29.9 mm-40 -61.92 -45.22 94.67 Favored 'General case' 0 N--CA 1.47 0.555 0 CA-C-O 121.104 0.478 . . . . 75.0 111.129 175.446 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 38' ' ' LEU . . . . . 0.449 ' CD1' HD23 ' A' ' 52' ' ' LEU . 97.3 mt -57.63 -53.95 52.33 Favored 'General case' 0 CA--C 1.541 0.626 0 CA-C-N 116.092 -0.503 . . . . 73.230000000000004 112.342 -178.781 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 19.3 ptpt -57.25 -38.25 73.57 Favored 'General case' 0 N--CA 1.474 0.743 0 CA-C-O 120.823 0.344 . . . . 72.349999999999994 111.745 -176.975 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 95.8 mt -65.78 -24.34 66.91 Favored 'General case' 0 CA--C 1.538 0.514 0 CA-C-O 121.187 0.518 . . . . 71.219999999999999 111.493 178.279 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 41' ' ' ARG . . . . . . . . . . . . . 80.4 mtt-85 -107.13 13.84 26.93 Favored 'General case' 0 CA--C 1.539 0.549 0 CA-C-N 116.143 -0.48 . . . . 74.019999999999996 111.754 -177.454 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 69.0 m 62.78 21.75 12.97 Favored 'General case' 0 N--CA 1.478 0.926 0 CA-C-O 121.022 0.439 . . . . 71.140000000000001 112.176 178.937 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 57.1 mt -88.57 147.81 40.5 Favored Pre-proline 0 CA--C 1.54 0.575 0 CA-C-N 116.224 -0.443 . . . . 74.030000000000001 111.516 -179.563 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 44' ' ' PRO . . . . . 0.532 ' HD2' ' HD3' ' A' ' 55' ' ' ARG . 51.8 Cg_exo -55.47 117.48 4.09 Favored 'Trans proline' 0 C--N 1.353 0.799 0 C-N-CA 122.888 2.392 . . . . 71.010000000000005 113.607 177.176 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 33.4 m -92.21 -18.38 7.25 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.579 0 CA-C-N 116.251 -0.431 . . . . 75.430000000000007 112.007 -179.944 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 57.2 m -84.51 50.44 1.89 Allowed 'General case' 0 N--CA 1.473 0.705 0 CA-C-O 120.993 0.425 . . . . 71.5 112.025 -177.634 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . -125.16 165.71 18.19 Favored Glycine 0 CA--C 1.526 0.722 0 C-N-CA 121.406 -0.426 . . . . 51.43 112.58 175.486 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 48' ' ' THR . . . . . 0.505 ' O ' ' HG ' ' A' ' 52' ' ' LEU . 68.7 p -76.09 165.05 25.5 Favored 'General case' 0 N--CA 1.472 0.64 0 O-C-N 122.517 -0.402 . . . . 64.0 111.801 178.808 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 49' ' ' LYS . . . . . 0.68 ' HZ1' HD11 ' A' ' 34' ' ' LEU . 26.7 tptp -44.97 -53.77 7.31 Favored 'General case' 0 N--CA 1.474 0.728 0 C-N-CA 123.234 0.614 . . . . 65.340000000000003 112.549 -174.994 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 50' ' ' THR . . . . . . . . . . . . . 60.1 m -62.0 -42.97 99.73 Favored 'General case' 0 N--CA 1.47 0.575 0 CA-C-N 116.617 -0.265 . . . . 72.019999999999996 111.703 -179.841 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 44.2 mt-10 -57.4 -41.87 81.13 Favored 'General case' 0 N--CA 1.471 0.622 0 CA-C-O 120.927 0.394 . . . . 72.0 110.933 177.88 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 52' ' ' LEU . . . . . 0.505 ' HG ' ' O ' ' A' ' 48' ' ' THR . 39.1 mt -63.7 -43.21 97.27 Favored 'General case' 0 CA--C 1.539 0.549 0 CA-C-N 116.194 -0.457 . . . . 71.439999999999998 111.152 179.376 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 53' ' ' ILE . . . . . 0.433 HG13 ' O ' ' A' ' 49' ' ' LYS . 68.2 mt -65.2 -51.72 61.87 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.524 0 CA-C-N 116.281 -0.418 . . . . 74.540000000000006 111.529 -179.917 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 43.7 mt-10 -57.69 -44.47 85.85 Favored 'General case' 0 N--CA 1.47 0.553 0 CA-C-O 120.968 0.413 . . . . 65.319999999999993 110.997 177.663 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 55' ' ' ARG . . . . . 0.532 ' HD3' ' HD2' ' A' ' 44' ' ' PRO . 37.2 ttm180 -57.42 -46.49 83.48 Favored 'General case' 0 CA--C 1.539 0.53 0 CA-C-N 115.847 -0.615 . . . . 72.140000000000001 111.955 179.496 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 56' ' ' LEU . . . . . 0.442 ' HB3' HD12 ' A' ' 22' ' ' LEU . 77.8 mt -63.78 -49.1 74.28 Favored 'General case' 0 CA--C 1.538 0.485 0 CA-C-O 120.773 0.32 . . . . 65.140000000000001 111.725 177.647 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 57' ' ' ARG . . . . . 0.401 ' O ' ' HB2' ' A' ' 61' ' ' ASP . 32.8 mtm180 -64.54 -37.58 88.05 Favored 'General case' 0 CA--C 1.539 0.529 0 N-CA-C 111.83 0.307 . . . . 75.540000000000006 111.83 -178.698 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -73.71 -34.57 64.87 Favored 'General case' 0 N--CA 1.47 0.542 0 CA-C-O 121.165 0.507 . . . . 71.140000000000001 111.393 178.933 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 59' ' ' TYR . . . . . . . . . . . . . 85.3 t80 -64.43 -55.83 18.31 Favored 'General case' 0 CA--C 1.537 0.453 0 CA-C-O 121.034 0.445 . . . . 75.200000000000003 110.701 175.983 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 60' ' ' GLN . . . . . 0.5 ' HB2' HD13 ' A' ' 22' ' ' LEU . 57.0 tp60 -59.99 -38.53 82.84 Favored 'General case' 0 CA--C 1.539 0.544 0 CA-C-N 116.087 -0.506 . . . . 63.340000000000003 111.426 178.049 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 61' ' ' ASP . . . . . 0.401 ' HB2' ' O ' ' A' ' 57' ' ' ARG . 15.8 t70 -54.54 -56.71 16.07 Favored 'General case' 0 CA--C 1.541 0.626 0 CA-C-N 116.107 -0.497 . . . . 64.329999999999998 112.086 179.107 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 62' ' ' GLN . . . . . . . . . . . . . 11.3 pt20 -72.94 -30.38 63.83 Favored 'General case' 0 CA--C 1.541 0.619 0 N-CA-C 112.941 0.719 . . . . 74.109999999999999 112.941 -173.473 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 63' ' ' ILE . . . . . . . . . . . . . 32.5 pt -80.96 -18.96 11.72 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.737 0 O-C-N 122.06 -0.4 . . . . 74.319999999999993 111.425 179.82 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 27.7 t -88.53 136.76 30.96 Favored Pre-proline 0 N--CA 1.47 0.539 0 CA-C-N 116.329 -0.396 . . . . 62.32 111.172 177.222 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 65' ' ' PRO . . . . . . . . . . . . . 59.3 Cg_endo -71.2 119.54 6.36 Favored 'Trans proline' 0 CA--C 1.543 0.94 0 C-N-CA 122.535 2.156 . . . . 74.099999999999994 112.504 179.194 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 66' ' ' VAL . . . . . 0.491 ' HB ' ' HB3' ' A' ' 69' ' ' ALA . 27.9 m -60.45 124.41 78.27 Favored Pre-proline 0 CA--C 1.547 0.833 0 CA-C-O 121.128 0.489 . . . . 74.049999999999997 112.093 -179.127 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 67' ' ' PRO . . . . . . . . . . . . . 98.7 Cg_endo -78.58 91.71 1.18 Allowed 'Trans proline' 0 CA--C 1.541 0.837 0 C-N-CA 122.605 2.203 . . . . 73.310000000000002 113.252 -175.949 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 64.43 15.42 59.18 Favored Glycine 0 CA--C 1.531 1.033 0 CA-C-N 116.331 -0.395 . . . . 63.009999999999998 113.876 178.791 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 69' ' ' ALA . . . . . 0.491 ' HB3' ' HB ' ' A' ' 66' ' ' VAL . . . -77.55 139.37 63.23 Favored Pre-proline 0 CA--C 1.539 0.557 0 O-C-N 122.624 -0.339 . . . . 74.299999999999997 111.477 -179.145 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 70' ' ' PRO . . . . . . . . . . . . . 51.0 Cg_endo -68.26 89.92 0.39 Allowed 'Trans proline' 0 CA--C 1.538 0.7 0 C-N-CA 122.491 2.127 . . . . 63.009999999999998 112.992 -179.03 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 36.3 ttpt -82.47 -22.53 35.14 Favored 'General case' 0 CA--C 1.538 0.481 0 CA-C-N 115.941 -0.572 . . . . 73.299999999999997 111.088 178.03 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -108.18 95.24 14.93 Favored Pre-proline 0 CA--C 1.541 0.629 0 N-CA-C 112.219 0.451 . . . . 75.450000000000003 112.219 -176.647 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 73' ' ' PRO . . . . . . . . . . . . . 97.4 Cg_endo -83.84 -166.83 0.39 Allowed 'Trans proline' 0 CA--C 1.541 0.869 0 C-N-CA 122.446 2.097 . . . . 72.349999999999994 112.333 174.465 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -173.59 179.66 2.03 Favored 'General case' 0 N--CA 1.471 0.6 0 C-N-CA 122.49 0.316 . . . . 75.319999999999993 110.818 178.761 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.251 1.18 0 CA-C-O 118.989 -0.529 . . . . 74.299999999999997 111.297 175.43 . . . . . . . . 0 0 . 1 . 013 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 87.6 mtp . . . . . 0 N--CA 1.489 1.498 0 CA-C-O 120.775 0.322 . . . . 72.299999999999997 111.176 . . . . . . . . . 0 0 . 1 . 013 nuclear orig full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . 166.5 169.19 29.78 Favored Glycine 0 CA--C 1.521 0.441 0 C-N-CA 120.392 -0.909 . . . . 52.020000000000003 113.527 179.304 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 3' ' ' HIS . . . . . . . . . . . . . 87.9 m-70 -99.82 89.8 4.22 Favored 'General case' 0 CA--C 1.535 0.397 0 CA-C-O 121.541 0.686 . . . . 63.130000000000003 111.119 -179.058 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 4' ' ' HIS . . . . . . . . . . . . . 15.4 p80 -94.54 89.68 5.9 Favored 'General case' 0 CA--C 1.54 0.568 0 CA-C-N 115.721 -0.672 . . . . 74.329999999999998 111.563 -178.338 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 5' ' ' HIS . . . . . . . . . . . . . 14.9 p-80 -93.08 1.19 57.33 Favored 'General case' 0 CA--C 1.543 0.674 0 CA-C-N 115.935 -0.575 . . . . 63.340000000000003 111.894 -178.969 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 61.1 t60 69.03 161.59 0.21 Allowed 'General case' 0 CA--C 1.55 0.965 0 CA-C-O 121.082 0.468 . . . . 62.109999999999999 111.537 175.707 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 93.4 m-70 -95.2 166.43 11.91 Favored 'General case' 0 N--CA 1.475 0.799 0 O-C-N 121.888 -0.508 . . . . 70.200000000000003 112.023 -179.823 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 8' ' ' HIS . . . . . . . . . . . . . 80.2 m-70 -125.47 78.3 1.72 Allowed 'General case' 0 N--CA 1.47 0.572 0 CA-C-O 121.238 0.542 . . . . 75.040000000000006 111.012 173.323 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 71.5 p -81.86 115.55 21.11 Favored 'General case' 0 N--CA 1.468 0.452 0 CA-C-N 116.29 -0.413 . . . . 75.140000000000001 110.685 178.498 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 63.9 m-70 -76.88 124.81 28.29 Favored 'General case' 0 N--CA 1.469 0.48 0 CA-C-N 116.418 -0.356 . . . . 72.120000000000005 111.146 -175.915 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 11' ' ' MET . . . . . . . . . . . . . 22.9 ptt? -140.23 149.52 42.99 Favored 'General case' 0 N--CA 1.469 0.51 0 CA-C-N 116.481 -0.327 . . . . 71.230000000000004 111.008 -179.741 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 93.8 p -146.78 179.11 7.8 Favored 'General case' 0 N--CA 1.471 0.618 0 CA-C-O 121.24 0.543 . . . . 75.319999999999993 112.331 -177.703 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 13' ' ' THR . . . . . . . . . . . . . 35.1 p -94.62 148.78 35.47 Favored Pre-proline 0 N--CA 1.47 0.575 0 CA-C-N 115.957 -0.565 . . . . 73.450000000000003 111.504 177.264 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 14' ' ' PRO . . . . . . . . . . . . . 59.8 Cg_endo -71.7 133.22 21.65 Favored 'Trans proline' 0 CA--C 1.541 0.838 0 C-N-CA 122.593 2.195 . . . . 73.540000000000006 112.947 178.379 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 75.9 mt -98.38 170.41 8.87 Favored 'General case' 0 CA--C 1.54 0.589 0 CA-C-O 121.254 0.55 . . . . 64.219999999999999 111.837 -177.786 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 16' ' ' THR . . . . . . . . . . . . . 8.9 t -156.5 155.12 31.45 Favored 'General case' 0 N--CA 1.472 0.651 0 CA-C-N 116.267 -0.424 . . . . 71.239999999999995 111.363 177.731 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . -138.31 28.33 2.69 Favored Glycine 0 CA--C 1.525 0.659 0 C-N-CA 121.332 -0.461 . . . . 63.25 112.841 179.096 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 18' ' ' LYS . . . . . 0.578 ' HZ2' ' HB2' ' A' ' 18' ' ' LYS . 10.3 mtmp? -113.69 138.75 22.78 Favored Pre-proline 0 N--CA 1.472 0.632 0 O-C-N 122.606 -0.349 . . . . 74.510000000000005 111.651 179.545 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 73.4 Cg_endo -84.16 165.81 12.88 Favored 'Trans proline' 0 CA--C 1.543 0.951 0 C-N-CA 122.84 2.36 . . . . 74.530000000000001 112.852 175.674 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . -153.0 78.38 0.2 Allowed Glycine 0 CA--C 1.528 0.864 0 C-N-CA 120.92 -0.657 . . . . 55.350000000000001 113.461 179.774 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -139.87 134.63 31.94 Favored 'General case' 0 N--CA 1.47 0.551 0 CA-C-O 120.866 0.365 . . . . 71.310000000000002 111.766 178.305 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 88.5 mt -80.44 153.09 73.69 Favored Pre-proline 0 CA--C 1.542 0.648 0 CA-C-N 116.573 -0.285 . . . . 72.310000000000002 111.675 178.706 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 23' ' ' PRO . . . . . 0.463 ' O ' ' HG ' ' A' ' 26' ' ' LEU . 15.6 Cg_exo -68.74 114.21 3.46 Favored 'Trans proline' 0 CA--C 1.541 0.84 0 C-N-CA 122.418 2.079 . . . . 73.209999999999994 111.767 172.612 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -47.02 -30.68 2.77 Favored 'General case' 0 N--CA 1.474 0.771 0 N-CA-C 113.122 0.786 . . . . 71.129999999999995 113.122 -176.781 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 25' ' ' ASN . . . . . 0.463 ' HB3' ' HB3' ' A' ' 28' ' ' ASP . 14.4 m120 -82.34 33.84 0.41 Allowed 'General case' 0 CA--C 1.545 0.786 0 N-CA-C 112.465 0.542 . . . . 74.439999999999998 112.465 -178.719 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 26' ' ' LEU . . . . . 0.463 ' HG ' ' O ' ' A' ' 23' ' ' PRO . 85.6 mt -50.75 -56.84 10.17 Favored 'General case' 0 N--CA 1.476 0.829 0 N-CA-C 112.221 0.452 . . . . 75.319999999999993 112.221 179.128 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 15.5 t70 -64.59 -22.54 67.0 Favored 'General case' 0 CA--C 1.544 0.741 0 CA-C-O 120.893 0.378 . . . . 75.230000000000004 111.753 -177.768 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 28' ' ' ASP . . . . . 0.463 ' HB3' ' HB3' ' A' ' 25' ' ' ASN . 26.0 t70 -74.56 -34.18 62.86 Favored 'General case' 0 CA--C 1.54 0.591 0 CA-C-N 116.385 -0.371 . . . . 73.420000000000002 111.431 178.885 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 29' ' ' MET . . . . . . . . . . . . . 49.4 mtm -73.92 150.97 40.53 Favored 'General case' 0 CA--C 1.537 0.448 0 CA-C-O 121.048 0.451 . . . . 74.310000000000002 111.486 -179.694 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 52.0 mtmt -69.12 153.77 43.17 Favored 'General case' 0 CA--C 1.537 0.479 0 CA-C-N 116.162 -0.472 . . . . 74.239999999999995 111.822 -178.049 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 31' ' ' VAL . . . . . 0.427 HG13 HD12 ' A' ' 52' ' ' LEU . 91.7 t -49.09 -43.37 15.53 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.679 0 N-CA-C 112.316 0.488 . . . . 72.129999999999995 112.316 -177.75 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -58.96 -44.03 91.39 Favored 'General case' 0 N--CA 1.47 0.574 0 CA-C-O 120.814 0.34 . . . . 75.519999999999996 111.756 176.687 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 47.3 mt-10 -63.61 -36.36 83.57 Favored 'General case' 0 N--CA 1.47 0.56 0 CA-C-O 120.928 0.394 . . . . 71.420000000000002 111.079 178.73 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 34' ' ' LEU . . . . . 0.445 HD23 ' O ' ' A' ' 26' ' ' LEU . 89.4 mt -69.06 -40.83 78.28 Favored 'General case' 0 CA--C 1.539 0.537 0 CA-C-O 120.923 0.392 . . . . 74.319999999999993 111.339 176.372 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 94.6 mttt -67.56 -28.15 67.55 Favored 'General case' 0 CA--C 1.536 0.433 0 CA-C-O 120.873 0.368 . . . . 74.349999999999994 110.82 174.844 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 53.2 tp60 -64.68 -44.12 91.36 Favored 'General case' 0 N--CA 1.469 0.512 0 N-CA-C 109.89 -0.411 . . . . 70.120000000000005 109.89 172.912 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 37' ' ' GLU . . . . . 0.452 ' HB3' ' NH2' ' A' ' 41' ' ' ARG . 55.9 mm-40 -53.23 -40.9 64.89 Favored 'General case' 0 N--CA 1.471 0.607 0 CA-C-N 115.971 -0.559 . . . . 75.120000000000005 111.473 174.636 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 38' ' ' LEU . . . . . 0.512 HD11 ' O ' ' A' ' 44' ' ' PRO . 96.6 mt -70.53 -57.48 4.72 Favored 'General case' 0 CA--C 1.538 0.499 0 CA-C-N 115.958 -0.564 . . . . 74.109999999999999 112.129 -179.874 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 17.8 ptpt -59.54 -39.13 82.96 Favored 'General case' 0 N--CA 1.472 0.648 0 N-CA-C 112.265 0.469 . . . . 74.129999999999995 112.265 -173.99 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 86.0 mt -64.62 -13.6 54.32 Favored 'General case' 0 N--CA 1.473 0.691 0 N-CA-C 112.1 0.408 . . . . 73.519999999999996 112.1 179.826 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 41' ' ' ARG . . . . . 0.452 ' NH2' ' HB3' ' A' ' 37' ' ' GLU . 39.0 mtm-85 -124.83 25.59 7.35 Favored 'General case' 0 CA--C 1.543 0.679 0 CA-C-O 120.838 0.351 . . . . 72.510000000000005 111.526 179.506 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 73.3 m 63.58 32.44 14.05 Favored 'General case' 0 N--CA 1.48 1.035 0 N-CA-C 113.118 0.785 . . . . 61.310000000000002 113.118 174.175 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 71.6 mt -104.02 145.41 30.6 Favored Pre-proline 0 CA--C 1.544 0.741 0 CA-C-O 120.712 0.292 . . . . 73.420000000000002 111.731 178.226 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 44' ' ' PRO . . . . . 0.512 ' O ' HD11 ' A' ' 38' ' ' LEU . 32.1 Cg_exo -62.44 135.59 54.36 Favored 'Trans proline' 0 C--N 1.354 0.849 0 C-N-CA 122.724 2.283 . . . . 54.399999999999999 112.898 178.662 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 45' ' ' VAL . . . . . 0.452 HG11 ' HB2' ' A' ' 38' ' ' LEU . 33.1 m -109.39 12.1 8.8 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.853 0 N-CA-C 112.55 0.574 . . . . 72.540000000000006 112.55 -176.524 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 46.8 m -79.7 9.17 5.4 Favored 'General case' 0 N--CA 1.476 0.841 0 N-CA-C 113.22 0.822 . . . . 75.519999999999996 113.22 -173.869 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . -106.21 170.82 17.0 Favored Glycine 0 CA--C 1.529 0.909 0 C-N-CA 120.797 -0.716 . . . . 43.409999999999997 113.911 -178.966 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 48' ' ' THR . . . . . 0.603 ' O ' ' HG ' ' A' ' 52' ' ' LEU . 74.9 p -83.21 178.04 8.27 Favored 'General case' 0 N--CA 1.472 0.645 0 C-N-CA 122.494 0.318 . . . . 73.230000000000004 111.446 176.627 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 88.5 tttt -46.42 -47.02 19.05 Favored 'General case' 0 CA--C 1.545 0.782 0 N-CA-C 112.755 0.65 . . . . 71.030000000000001 112.755 -175.903 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 50' ' ' THR . . . . . . . . . . . . . 56.7 m -64.43 -44.53 90.87 Favored 'General case' 0 N--CA 1.474 0.775 0 CA-C-O 120.714 0.292 . . . . 75.209999999999994 111.243 178.752 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 23.4 mm-40 -55.75 -44.64 77.78 Favored 'General case' 0 N--CA 1.473 0.717 0 CA-C-O 121.167 0.508 . . . . 74.109999999999999 111.28 177.101 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 52' ' ' LEU . . . . . 0.603 ' HG ' ' O ' ' A' ' 48' ' ' THR . 28.9 mt -57.63 -51.83 67.89 Favored 'General case' 0 N--CA 1.469 0.491 0 CA-C-N 115.773 -0.649 . . . . 70.329999999999998 111.607 -177.771 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 53' ' ' ILE . . . . . 0.402 ' O ' ' HG3' ' A' ' 57' ' ' ARG . 68.2 mt -60.47 -52.54 60.29 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.457 0 CA-C-N 116.352 -0.385 . . . . 75.150000000000006 111.772 179.887 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 33.7 mt-10 -60.73 -34.01 73.77 Favored 'General case' 0 N--CA 1.471 0.586 0 CA-C-O 120.931 0.396 . . . . 63.140000000000001 111.595 -178.949 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -64.82 -42.87 94.62 Favored 'General case' 0 CA--C 1.54 0.573 0 CA-C-O 121.221 0.534 . . . . 75.140000000000001 110.408 177.87 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 56' ' ' LEU . . . . . 0.417 HD23 HH21 ' A' ' 41' ' ' ARG . 97.3 mt -61.45 -46.13 91.37 Favored 'General case' 0 N--CA 1.47 0.53 0 CA-C-N 115.988 -0.551 . . . . 74.310000000000002 111.001 174.214 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 57' ' ' ARG . . . . . 0.402 ' HG3' ' O ' ' A' ' 53' ' ' ILE . 66.8 mtp180 -60.67 -36.04 77.73 Favored 'General case' 0 CA--C 1.544 0.73 0 CA-C-N 116.382 -0.372 . . . . 75.430000000000007 111.707 179.563 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -67.76 -39.02 84.19 Favored 'General case' 0 N--CA 1.472 0.654 0 CA-C-O 121.1 0.476 . . . . 65.299999999999997 111.12 175.797 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 59' ' ' TYR . . . . . . . . . . . . . 75.2 t80 -62.74 -44.82 95.22 Favored 'General case' 0 CA--C 1.542 0.661 0 CA-C-N 116.215 -0.448 . . . . 74.129999999999995 111.154 175.772 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 60' ' ' GLN . . . . . . . . . . . . . 15.5 mm100 -65.18 -45.78 83.45 Favored 'General case' 0 N--CA 1.471 0.584 0 CA-C-O 121.12 0.486 . . . . 74.25 111.501 177.494 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 61' ' ' ASP . . . . . . . . . . . . . 27.1 t70 -47.13 -38.83 12.26 Favored 'General case' 0 CA--C 1.543 0.704 0 CA-C-N 115.565 -0.743 . . . . 74.439999999999998 112.892 -178.231 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 62' ' ' GLN . . . . . . . . . . . . . 9.6 pt20 -87.05 -26.99 23.43 Favored 'General case' 0 CA--C 1.544 0.725 0 N-CA-C 112.954 0.724 . . . . 74.129999999999995 112.954 -175.612 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 63' ' ' ILE . . . . . . . . . . . . . 36.4 pt -97.09 -20.28 5.74 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.828 0 N-CA-C 112.576 0.584 . . . . 72.340000000000003 112.576 -176.212 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 26.0 t -70.48 141.7 88.37 Favored Pre-proline 0 N--CA 1.473 0.676 0 N-CA-C 111.689 0.255 . . . . 73.109999999999999 111.689 -177.113 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 65' ' ' PRO . . . . . . . . . . . . . 56.4 Cg_endo -69.19 78.51 0.81 Allowed 'Trans proline' 0 CA--C 1.542 0.896 0 C-N-CA 122.531 2.154 . . . . 72.150000000000006 113.254 -179.702 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 66' ' ' VAL . . . . . . . . . . . . . 23.9 m -94.91 146.98 32.32 Favored Pre-proline 0 CA--C 1.545 0.788 0 CA-C-N 116.039 -0.528 . . . . 73.400000000000006 111.786 178.554 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 67' ' ' PRO . . . . . . . . . . . . . 45.5 Cg_exo -57.91 -52.12 6.6 Favored 'Trans proline' 0 CA--C 1.544 0.983 0 C-N-CA 123.0 2.467 . . . . 71.420000000000002 114.322 -176.89 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . -69.91 -43.9 64.02 Favored Glycine 0 CA--C 1.529 0.937 0 C-N-CA 121.067 -0.587 . . . . 54.240000000000002 113.533 -178.943 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . 68.32 115.77 0.03 OUTLIER Pre-proline 0 N--CA 1.472 0.669 0 C-N-CA 123.185 0.594 . . . . 63.200000000000003 112.261 178.963 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 70' ' ' PRO . . . . . . . . . . . . . 72.0 Cg_exo -50.93 134.96 43.18 Favored 'Trans proline' 0 CA--C 1.542 0.901 0 C-N-CA 122.767 2.312 . . . . 72.239999999999995 113.039 178.326 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 18.7 ptpt -61.18 -19.05 61.14 Favored 'General case' 0 N--CA 1.471 0.611 0 N-CA-C 112.931 0.715 . . . . 70.200000000000003 112.931 -175.868 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -120.06 81.31 27.84 Favored Pre-proline 0 N--CA 1.472 0.636 0 CA-C-O 120.867 0.365 . . . . 75.540000000000006 111.482 177.941 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 73' ' ' PRO . . . . . . . . . . . . . 42.4 Cg_endo -96.37 -170.5 0.16 Allowed 'Trans proline' 0 CA--C 1.54 0.821 0 C-N-CA 123.344 2.696 . . . . 75.209999999999994 113.416 179.478 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -101.1 138.11 38.57 Favored 'General case' 0 CA--C 1.54 0.579 0 CA-C-N 116.237 -0.438 . . . . 63.539999999999999 111.271 176.249 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.252 1.229 0 CA-C-O 118.622 -0.704 . . . . 73.340000000000003 111.85 -179.875 . . . . . . . . 0 0 . 1 . 014 nuclear orig full ' A' A ' 1' ' ' MET . . . . . 0.541 ' N ' ' SD ' ' A' ' 1' ' ' MET . 0.0 OUTLIER . . . . . 0 N--CA 1.487 1.41 0 CA-C-O 120.762 0.315 . . . . 71.549999999999997 111.251 . . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . -154.4 157.76 27.75 Favored Glycine 0 CA--C 1.526 0.727 0 C-N-CA 120.974 -0.632 . . . . 38.079999999999998 113.404 -178.889 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 3' ' ' HIS . . . . . . . . . . . . . 59.4 t-80 -84.79 121.48 27.76 Favored 'General case' 0 CA--C 1.54 0.57 0 CA-C-O 120.672 0.273 . . . . 64.230000000000004 111.343 -179.377 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 4' ' ' HIS . . . . . . . . . . . . . 50.1 t60 -102.67 104.12 14.44 Favored 'General case' 0 N--CA 1.473 0.685 0 CA-C-O 120.847 0.356 . . . . 72.209999999999994 111.143 178.84 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 5' ' ' HIS . . . . . . . . . . . . . 51.7 t-80 -93.76 104.79 16.86 Favored 'General case' 0 CA--C 1.541 0.598 0 CA-C-O 120.939 0.399 . . . . 71.400000000000006 111.436 -179.562 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 6.6 p-80 -75.92 146.29 39.8 Favored 'General case' 0 N--CA 1.474 0.742 0 N-CA-C 112.26 0.467 . . . . 73.219999999999999 112.26 -178.003 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 25.7 p80 -164.52 163.48 21.99 Favored 'General case' 0 N--CA 1.472 0.644 0 CA-C-N 116.219 -0.446 . . . . 75.219999999999999 112.039 -179.464 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 8' ' ' HIS . . . . . . . . . . . . . 54.4 p-80 -144.5 160.96 40.23 Favored 'General case' 0 CA--C 1.543 0.679 0 CA-C-N 116.42 -0.355 . . . . 75.319999999999993 110.975 174.939 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 92.3 p -141.14 -176.51 4.72 Favored 'General case' 0 N--CA 1.477 0.911 0 CA-C-O 120.96 0.41 . . . . 73.530000000000001 111.664 -177.828 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 45.2 m80 -113.47 160.84 18.04 Favored 'General case' 0 N--CA 1.471 0.616 0 CA-C-O 120.923 0.392 . . . . 64.540000000000006 111.477 179.205 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 11' ' ' MET . . . . . . . . . . . . . 52.0 ttm -141.41 104.45 4.59 Favored 'General case' 0 CA--C 1.54 0.566 0 CA-C-O 120.92 0.391 . . . . 74.030000000000001 110.977 176.14 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 66.1 p -86.22 138.12 32.11 Favored 'General case' 0 N--CA 1.472 0.64 0 CA-C-O 121.057 0.456 . . . . 75.019999999999996 111.838 -178.762 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 13' ' ' THR . . . . . . . . . . . . . 81.1 p -100.62 154.77 36.99 Favored Pre-proline 0 N--CA 1.473 0.689 0 CA-C-N 116.168 -0.469 . . . . 75.219999999999999 111.239 179.396 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 14' ' ' PRO . . . . . . . . . . . . . 98.4 Cg_endo -80.07 158.85 23.79 Favored 'Trans proline' 0 CA--C 1.544 1.011 0 C-N-CA 122.513 2.142 . . . . 64.150000000000006 113.99 -176.831 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 2.3 pt? -73.49 166.32 23.44 Favored 'General case' 0 CA--C 1.541 0.6 0 CA-C-N 116.04 -0.527 . . . . 74.400000000000006 111.098 173.915 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 16' ' ' THR . . . . . . . . . . . . . 90.9 m -147.08 138.93 24.33 Favored 'General case' 0 N--CA 1.472 0.651 0 CA-C-O 120.908 0.385 . . . . 70.510000000000005 111.905 -179.347 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . -93.29 103.52 3.05 Favored Glycine 0 CA--C 1.528 0.859 0 CA-C-N 116.312 -0.404 . . . . 38.079999999999998 112.168 175.499 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 45.7 mtmt -55.76 116.75 12.92 Favored Pre-proline 0 CA--C 1.544 0.727 0 N-CA-C 112.31 0.485 . . . . 72.450000000000003 112.31 -175.767 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 87.9 Cg_endo -83.84 131.52 5.31 Favored 'Trans proline' 0 CA--C 1.541 0.826 0 C-N-CA 122.594 2.196 . . . . 74.209999999999994 113.161 178.488 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . -129.84 -54.61 0.1 Allowed Glycine 0 N--CA 1.465 0.589 0 CA-C-N 116.308 -0.405 . . . . 71.400000000000006 112.117 175.633 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -124.4 134.95 52.96 Favored 'General case' 0 CA--C 1.535 0.397 0 CA-C-O 120.825 0.345 . . . . 70.340000000000003 110.811 176.65 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 22' ' ' LEU . . . . . 0.538 ' HG ' ' HG3' ' A' ' 60' ' ' GLN . 94.3 mt -78.3 149.18 75.46 Favored Pre-proline 0 N--CA 1.47 0.568 0 N-CA-C 111.955 0.354 . . . . 72.420000000000002 111.955 -177.533 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 23' ' ' PRO . . . . . 0.608 ' O ' ' HG ' ' A' ' 26' ' ' LEU . 22.9 Cg_exo -64.85 125.51 14.9 Favored 'Trans proline' 0 CA--C 1.538 0.701 0 C-N-CA 122.626 2.217 . . . . 71.530000000000001 111.773 173.269 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -56.27 -23.96 39.82 Favored 'General case' 0 CA--C 1.542 0.656 0 N-CA-C 112.934 0.716 . . . . 74.430000000000007 112.934 -176.339 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 3.7 m-20 -82.23 19.21 1.23 Allowed 'General case' 0 CA--C 1.545 0.772 0 N-CA-C 113.314 0.857 . . . . 72.239999999999995 113.314 -177.063 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 26' ' ' LEU . . . . . 0.608 ' HG ' ' O ' ' A' ' 23' ' ' PRO . 77.8 mt -50.32 -47.77 55.61 Favored 'General case' 0 N--CA 1.479 0.996 0 O-C-N 121.946 -0.471 . . . . 74.239999999999995 111.771 176.86 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 27' ' ' ASP . . . . . 0.419 ' HB3' HD13 ' A' ' 53' ' ' ILE . 1.0 OUTLIER -71.59 -28.7 64.0 Favored 'General case' 0 CA--C 1.539 0.551 0 N-CA-C 112.246 0.461 . . . . 70.299999999999997 112.246 179.055 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 34.6 t70 -77.31 -24.15 50.94 Favored 'General case' 0 CA--C 1.544 0.745 0 N-CA-C 111.725 0.268 . . . . 63.25 111.725 -179.784 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 29' ' ' MET . . . . . . . . . . . . . 68.8 mtm -79.07 -178.26 6.04 Favored 'General case' 0 CA--C 1.539 0.55 0 CA-C-O 121.296 0.569 . . . . 70.430000000000007 111.95 178.484 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 28.2 mtpp -87.37 165.23 15.75 Favored 'General case' 0 CA--C 1.539 0.523 0 CA-C-O 121.225 0.536 . . . . 71.140000000000001 112.094 -177.206 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 42.3 t -62.16 -42.63 95.88 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.556 0 CA-C-N 116.215 -0.448 . . . . 71.230000000000004 111.218 179.574 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -54.98 -39.03 68.55 Favored 'General case' 0 CA--C 1.539 0.542 0 CA-C-N 116.163 -0.471 . . . . 73.0 112.193 179.004 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 22.5 mm-40 -60.34 -48.43 81.76 Favored 'General case' 0 N--CA 1.469 0.507 0 CA-C-O 120.933 0.397 . . . . 72.030000000000001 111.177 177.954 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 34' ' ' LEU . . . . . 0.42 ' O ' ' HG ' ' A' ' 38' ' ' LEU . 67.8 mt -58.89 -47.04 86.36 Favored 'General case' 0 N--CA 1.468 0.438 0 CA-C-O 121.174 0.511 . . . . 73.519999999999996 111.169 178.289 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 35' ' ' LYS . . . . . 0.643 ' HB3' ' HZ1' ' A' ' 35' ' ' LYS . 7.4 mtpm? -58.02 -37.75 74.91 Favored 'General case' 0 CA--C 1.541 0.619 0 CA-C-N 115.969 -0.559 . . . . 72.519999999999996 111.258 177.745 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 19.6 tm0? -68.88 -42.73 76.58 Favored 'General case' 0 CA--C 1.544 0.731 0 CA-C-O 120.957 0.408 . . . . 73.239999999999995 110.209 177.053 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 37' ' ' GLU . . . . . 0.46 ' HB3' HH21 ' A' ' 41' ' ' ARG . 36.9 mm-40 -58.57 -29.88 66.73 Favored 'General case' 0 N--CA 1.474 0.738 0 CA-C-N 116.287 -0.415 . . . . 64.140000000000001 111.937 176.166 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 38' ' ' LEU . . . . . 0.528 HD12 HD22 ' A' ' 52' ' ' LEU . 78.7 mt -73.95 -54.85 7.02 Favored 'General case' 0 CA--C 1.541 0.62 0 CA-C-N 116.137 -0.483 . . . . 74.329999999999998 112.126 -179.051 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 39' ' ' LYS . . . . . 0.484 ' HB3' ' HZ3' ' A' ' 39' ' ' LYS . 0.6 OUTLIER -57.04 -31.16 64.87 Favored 'General case' 0 N--CA 1.476 0.854 0 N-CA-C 112.423 0.527 . . . . 74.510000000000005 112.423 -176.57 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 98.6 mt -61.34 -36.16 79.4 Favored 'General case' 0 N--CA 1.471 0.608 0 CA-C-O 121.235 0.54 . . . . 74.140000000000001 111.427 177.366 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 41' ' ' ARG . . . . . 0.46 HH21 ' HB3' ' A' ' 37' ' ' GLU . 13.9 mtm180 -109.03 27.24 9.71 Favored 'General case' 0 CA--C 1.542 0.649 0 CA-C-N 116.002 -0.545 . . . . 73.019999999999996 112.307 -175.949 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 38.3 t 68.98 12.63 8.67 Favored 'General case' 0 N--CA 1.48 1.059 0 N-CA-C 112.578 0.585 . . . . 72.099999999999994 112.578 173.566 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 71.9 mt -87.47 148.11 43.53 Favored Pre-proline 0 CA--C 1.542 0.661 0 O-C-N 122.333 -0.23 . . . . 72.420000000000002 111.137 -179.971 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 44' ' ' PRO . . . . . 0.426 ' O ' HD13 ' A' ' 38' ' ' LEU . 67.9 Cg_endo -70.73 125.35 11.55 Favored 'Trans proline' 0 C--N 1.352 0.752 0 C-N-CA 122.284 1.989 . . . . 74.319999999999993 112.637 -177.895 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 45' ' ' VAL . . . . . 0.451 ' O ' ' HE2' ' A' ' 35' ' ' LYS . 30.5 m -76.72 27.42 0.04 OUTLIER 'Isoleucine or valine' 0 CA--C 1.546 0.808 0 N-CA-C 112.936 0.717 . . . . 75.439999999999998 112.936 -176.108 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 68.7 m -123.65 130.51 52.77 Favored 'General case' 0 N--CA 1.471 0.595 0 CA-C-O 121.231 0.539 . . . . 75.239999999999995 111.777 -178.428 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 152.29 164.12 12.1 Favored Glycine 0 CA--C 1.528 0.906 0 CA-C-N 115.363 -0.835 . . . . 73.540000000000006 112.045 -179.182 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 48' ' ' THR . . . . . 0.413 ' O ' ' HG ' ' A' ' 52' ' ' LEU . 44.1 p -77.09 162.16 27.7 Favored 'General case' 0 N--CA 1.475 0.806 0 CA-C-N 117.629 0.714 . . . . 73.0 111.786 -179.8 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 49' ' ' LYS . . . . . 0.507 ' O ' HG13 ' A' ' 53' ' ' ILE . 24.2 tptm -44.26 -61.57 1.46 Allowed 'General case' 0 N--CA 1.472 0.651 0 CA-C-N 116.032 -0.531 . . . . 74.319999999999993 112.154 -178.883 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 50' ' ' THR . . . . . 0.444 ' HA ' HD11 ' A' ' 53' ' ' ILE . 34.6 m -56.59 -45.48 81.37 Favored 'General case' 0 N--CA 1.472 0.643 0 N-CA-C 112.129 0.418 . . . . 73.209999999999994 112.129 -176.718 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 48.0 mt-10 -66.09 -41.0 91.24 Favored 'General case' 0 CA--C 1.536 0.433 0 N-CA-C 112.248 0.462 . . . . 75.310000000000002 112.248 -176.441 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 52' ' ' LEU . . . . . 0.528 HD22 HD12 ' A' ' 38' ' ' LEU . 62.6 mt -62.8 -42.02 99.54 Favored 'General case' 0 N--CA 1.469 0.517 0 CA-C-O 121.046 0.45 . . . . 70.239999999999995 111.24 179.024 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 53' ' ' ILE . . . . . 0.507 HG13 ' O ' ' A' ' 49' ' ' LYS . 35.1 mt -58.02 -54.64 29.38 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.435 0 CA-C-O 121.365 0.603 . . . . 72.109999999999999 110.914 176.68 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 54.1 mm-40 -67.23 -24.64 65.84 Favored 'General case' 0 CA--C 1.535 0.39 0 CA-C-N 115.935 -0.575 . . . . 73.319999999999993 111.876 179.363 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 37.1 ttm180 -67.06 -45.83 76.2 Favored 'General case' 0 N--CA 1.467 0.419 0 CA-C-O 120.991 0.424 . . . . 73.439999999999998 110.408 175.637 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 83.0 mt -60.72 -48.65 80.85 Favored 'General case' 0 CA--C 1.539 0.522 0 CA-C-O 121.125 0.488 . . . . 74.439999999999998 111.079 174.925 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 65.7 mtt180 -62.03 -38.25 87.99 Favored 'General case' 0 N--CA 1.469 0.5 0 CA-C-N 116.194 -0.457 . . . . 75.219999999999999 111.555 178.246 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -66.08 -40.56 90.94 Favored 'General case' 0 CA--C 1.534 0.328 0 CA-C-O 120.884 0.373 . . . . 74.549999999999997 111.068 177.352 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 59' ' ' TYR . . . . . 0.413 ' O ' ' HG2' ' A' ' 62' ' ' GLN . 71.1 t80 -58.91 -48.42 81.53 Favored 'General case' 0 CA--C 1.538 0.494 0 CA-C-N 116.144 -0.48 . . . . 75.430000000000007 110.987 177.457 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 60' ' ' GLN . . . . . 0.538 ' HG3' ' HG ' ' A' ' 22' ' ' LEU . 14.3 mm100 -63.35 -42.54 98.93 Favored 'General case' 0 CA--C 1.539 0.537 0 CA-C-O 120.747 0.308 . . . . 71.25 111.275 175.861 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 61' ' ' ASP . . . . . . . . . . . . . 27.0 t70 -56.81 -47.69 79.68 Favored 'General case' 0 CA--C 1.541 0.6 0 N-CA-C 112.022 0.379 . . . . 74.530000000000001 112.022 179.498 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 62' ' ' GLN . . . . . 0.413 ' HG2' ' O ' ' A' ' 59' ' ' TYR . 3.4 pt20 -69.38 -31.21 69.45 Favored 'General case' 0 CA--C 1.539 0.544 0 N-CA-C 112.026 0.38 . . . . 75.219999999999999 112.026 -177.343 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 63' ' ' ILE . . . . . . . . . . . . . 26.0 pt -95.34 5.19 8.34 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.77 0 N-CA-C 111.833 0.308 . . . . 74.219999999999999 111.833 178.922 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 46.9 t 71.98 105.2 0.03 OUTLIER Pre-proline 0 N--CA 1.475 0.791 0 C-N-CA 123.327 0.651 . . . . 72.319999999999993 111.797 -178.588 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 65' ' ' PRO . . . . . . . . . . . . . 14.4 Cg_exo -68.34 112.4 2.78 Favored 'Trans proline' 0 CA--C 1.537 0.646 0 C-N-CA 122.664 2.242 . . . . 75.420000000000002 112.157 179.454 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 66' ' ' VAL . . . . . . . . . . . . . 27.0 m -103.6 132.33 21.17 Favored Pre-proline 0 CA--C 1.542 0.64 0 CA-C-O 120.99 0.424 . . . . 71.400000000000006 111.928 -178.506 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 67' ' ' PRO . . . . . . . . . . . . . 85.9 Cg_endo -77.55 0.22 10.0 Favored 'Trans proline' 0 CA--C 1.54 0.818 0 C-N-CA 122.565 2.177 . . . . 74.209999999999994 112.591 178.038 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 123.41 -25.64 6.23 Favored Glycine 0 CA--C 1.523 0.56 0 CA-C-N 116.281 -0.418 . . . . 61.200000000000003 112.394 -177.022 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 69' ' ' ALA . . . . . 0.423 ' C ' ' H ' ' A' ' 71' ' ' LYS . . . 68.48 159.1 0.15 Allowed Pre-proline 0 CA--C 1.545 0.75 0 C-N-CA 122.977 0.511 . . . . 61.340000000000003 112.056 178.906 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 70' ' ' PRO . . . . . 0.406 ' HD2' ' HB1' ' A' ' 69' ' ' ALA . 56.8 Cg_endo -70.43 30.25 0.2 Allowed 'Trans proline' 0 CA--C 1.548 1.215 0 C-N-CA 122.554 2.17 . . . . 71.329999999999998 113.563 177.818 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 71' ' ' LYS . . . . . 0.605 ' HB3' ' HZ3' ' A' ' 71' ' ' LYS . 7.0 mtpm? -80.14 82.13 6.26 Favored 'General case' 0 CA--C 1.537 0.477 0 CA-C-O 121.034 0.445 . . . . 75.450000000000003 110.764 177.839 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -105.06 108.16 60.61 Favored Pre-proline 0 CA--C 1.539 0.551 0 N-CA-C 112.511 0.56 . . . . 52.509999999999998 112.511 -175.982 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 73' ' ' PRO . . . . . . . . . . . . . 73.8 Cg_endo -86.27 12.32 3.05 Favored 'Trans proline' 0 CA--C 1.542 0.887 0 C-N-CA 122.842 2.361 . . . . 70.450000000000003 112.842 174.643 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -96.72 -166.45 1.41 Allowed 'General case' 0 CA--C 1.543 0.699 0 CA-C-N 116.358 -0.383 . . . . 73.019999999999996 111.798 -179.121 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.253 1.24 0 CA-C-O 118.996 -0.526 . . . . 75.150000000000006 111.826 178.379 . . . . . . . . 0 0 . 1 . 015 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 86.5 mtp . . . . . 0 N--CA 1.491 1.596 0 CA-C-O 120.814 0.34 . . . . 71.010000000000005 111.235 . . . . . . . . . 0 0 . 1 . 015 nuclear orig full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . 118.68 167.9 14.03 Favored Glycine 0 CA--C 1.521 0.416 0 C-N-CA 121.19 -0.528 . . . . 73.150000000000006 111.982 -178.223 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 3' ' ' HIS . . . . . . . . . . . . . 97.1 m-70 -133.05 160.07 38.24 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-O 121.25 0.548 . . . . 74.420000000000002 111.776 -178.775 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 4' ' ' HIS . . . . . . . . . . . . . 12.2 p80 -120.28 129.75 54.17 Favored 'General case' 0 CA--C 1.534 0.349 0 CA-C-N 115.947 -0.57 . . . . 72.129999999999995 111.205 -177.969 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 5' ' ' HIS . . . . . . . . . . . . . 49.4 t-80 -131.13 130.89 43.66 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-O 120.744 0.307 . . . . 72.230000000000004 111.147 -178.509 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 72.5 m80 -108.96 159.21 17.0 Favored 'General case' 0 N--CA 1.468 0.431 0 CA-C-O 121.252 0.548 . . . . 73.409999999999997 111.816 179.199 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 20.6 t-80 -147.91 113.27 5.59 Favored 'General case' 0 CA--C 1.537 0.478 0 CA-C-N 115.78 -0.646 . . . . 74.030000000000001 110.437 176.931 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 8' ' ' HIS . . . . . . . . . . . . . 61.9 t60 -105.59 108.04 19.35 Favored 'General case' 0 CA--C 1.54 0.564 0 CA-C-N 116.116 -0.493 . . . . 71.099999999999994 111.559 -174.695 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 75.7 m -106.73 101.42 10.87 Favored 'General case' 0 N--CA 1.471 0.605 0 CA-C-O 120.832 0.349 . . . . 73.019999999999996 111.288 178.01 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 51.4 t-80 -75.22 94.83 3.03 Favored 'General case' 0 CA--C 1.538 0.492 0 CA-C-O 121.067 0.46 . . . . 73.349999999999994 110.656 178.493 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 11' ' ' MET . . . . . . . . . . . . . 11.0 ptt? -99.24 157.95 16.03 Favored 'General case' 0 N--CA 1.467 0.42 0 CA-C-N 116.119 -0.491 . . . . 74.25 111.371 -179.694 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 34.8 m -89.22 172.75 8.83 Favored 'General case' 0 N--CA 1.471 0.599 0 CA-C-O 121.575 0.702 . . . . 74.040000000000006 112.824 -172.026 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 13' ' ' THR . . . . . . . . . . . . . 67.4 p -118.23 118.04 34.47 Favored Pre-proline 0 N--CA 1.47 0.568 0 CA-C-N 115.539 -0.755 . . . . 75.439999999999998 110.987 179.865 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 14' ' ' PRO . . . . . . . . . . . . . 62.1 Cg_endo -72.98 122.59 8.24 Favored 'Trans proline' 0 CA--C 1.54 0.805 0 C-N-CA 122.219 1.946 . . . . 75.25 112.873 178.496 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 15' ' ' LEU . . . . . 0.437 ' O ' HD11 ' A' ' 15' ' ' LEU . 3.0 pp -66.88 150.24 49.46 Favored 'General case' 0 CA--C 1.541 0.599 0 CA-C-O 121.16 0.505 . . . . 71.040000000000006 111.403 178.741 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 16' ' ' THR . . . . . . . . . . . . . 59.1 m -116.14 110.21 18.53 Favored 'General case' 0 N--CA 1.468 0.428 0 CA-C-O 121.16 0.505 . . . . 71.510000000000005 112.066 -176.362 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . -81.91 171.47 52.36 Favored Glycine 0 CA--C 1.526 0.762 0 CA-C-N 115.9 -0.591 . . . . 54.030000000000001 112.421 175.452 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 57.4 pttt -86.3 120.95 72.59 Favored Pre-proline 0 CA--C 1.54 0.56 0 CA-C-O 121.011 0.434 . . . . 74.219999999999999 111.899 -179.372 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 52.3 Cg_endo -96.4 27.53 0.22 Allowed 'Trans proline' 0 CA--C 1.541 0.851 0 C-N-CA 123.314 2.676 . . . . 73.420000000000002 112.913 176.294 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . -78.4 56.87 4.11 Favored Glycine 0 CA--C 1.531 1.042 0 N-CA-C 114.01 0.364 . . . . 63.549999999999997 114.01 -175.475 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -178.27 126.35 0.12 Allowed 'General case' 0 N--CA 1.472 0.645 0 C-N-CA 122.823 0.449 . . . . 74.129999999999995 111.011 177.184 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 22' ' ' LEU . . . . . 0.419 ' HA ' ' HD3' ' A' ' 23' ' ' PRO . 99.4 mt -92.86 140.61 23.62 Favored Pre-proline 0 CA--C 1.536 0.436 0 N-CA-C 111.943 0.349 . . . . 73.230000000000004 111.943 -178.49 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 23' ' ' PRO . . . . . 0.532 ' O ' ' HG ' ' A' ' 26' ' ' LEU . 11.4 Cg_exo -73.69 152.34 47.69 Favored 'Trans proline' 0 CA--C 1.543 0.937 0 C-N-CA 122.985 2.456 . . . . 72.209999999999994 112.681 173.685 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -73.81 -19.44 60.75 Favored 'General case' 0 N--CA 1.471 0.619 0 CA-C-O 121.279 0.562 . . . . 72.540000000000006 111.088 175.567 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 15.3 m120 -84.41 24.12 1.02 Allowed 'General case' 0 CA--C 1.541 0.625 0 N-CA-C 112.986 0.736 . . . . 72.150000000000006 112.986 -179.486 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 26' ' ' LEU . . . . . 0.532 ' HG ' ' O ' ' A' ' 23' ' ' PRO . 67.2 mt -52.88 -37.4 60.44 Favored 'General case' 0 N--CA 1.479 1.018 0 CA-C-N 118.327 0.512 . . . . 72.420000000000002 111.615 179.221 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 4.3 m-20 -68.55 -36.31 78.62 Favored 'General case' 0 CA--C 1.544 0.722 0 CA-C-O 121.278 0.561 . . . . 74.439999999999998 111.544 177.707 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 9.1 m-20 -76.32 -37.47 57.35 Favored 'General case' 0 CA--C 1.538 0.509 0 CA-C-N 116.165 -0.471 . . . . 75.230000000000004 111.681 179.202 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 29' ' ' MET . . . . . . . . . . . . . 81.4 mtp -59.68 141.78 54.38 Favored 'General case' 0 N--CA 1.466 0.373 0 CA-C-N 115.871 -0.604 . . . . 74.219999999999999 112.546 -175.07 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 30' ' ' LYS . . . . . 0.541 ' HB2' ' HG2' ' A' ' 33' ' ' GLU . 48.3 mtmt -68.94 149.38 48.91 Favored 'General case' 0 CA--C 1.539 0.52 0 CA-C-N 115.545 -0.752 . . . . 71.329999999999998 111.992 -179.725 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 90.0 t -48.24 -44.47 12.67 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.724 0 CA-C-N 115.868 -0.606 . . . . 72.340000000000003 112.194 -179.797 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -61.25 -39.67 91.21 Favored 'General case' 0 N--CA 1.469 0.523 0 N-CA-C 112.12 0.415 . . . . 74.099999999999994 112.12 179.252 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 33' ' ' GLU . . . . . 0.541 ' HG2' ' HB2' ' A' ' 30' ' ' LYS . 16.3 mm-40 -68.23 -37.32 80.7 Favored 'General case' 0 N--CA 1.467 0.424 0 CA-C-O 120.971 0.415 . . . . 74.430000000000007 111.23 -178.779 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 83.2 mt -61.49 -45.99 91.88 Favored 'General case' 0 CA--C 1.538 0.481 0 CA-C-O 121.23 0.538 . . . . 75.430000000000007 110.5 175.56 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 35' ' ' LYS . . . . . 0.456 ' HA ' HD12 ' A' ' 38' ' ' LEU . 96.6 mttt -64.82 -29.13 70.08 Favored 'General case' 0 CA--C 1.539 0.532 0 CA-C-N 116.293 -0.412 . . . . 71.299999999999997 111.398 176.684 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 36' ' ' GLN . . . . . 0.515 ' HA ' ' HE3' ' A' ' 39' ' ' LYS . 55.9 tp60 -61.95 -37.39 84.55 Favored 'General case' 0 CA--C 1.539 0.552 0 CA-C-N 116.334 -0.394 . . . . 71.099999999999994 111.297 178.256 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 36.6 mt-10 -81.49 -30.2 33.38 Favored 'General case' 0 CA--C 1.539 0.531 0 O-C-N 122.166 -0.334 . . . . 72.129999999999995 111.698 176.06 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 38' ' ' LEU . . . . . 0.456 HD12 ' HA ' ' A' ' 35' ' ' LYS . 89.2 mt -58.71 -54.35 48.05 Favored 'General case' 0 N--CA 1.472 0.655 0 CA-C-O 120.741 0.305 . . . . 74.530000000000001 111.377 174.94 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 39' ' ' LYS . . . . . 0.515 ' HE3' ' HA ' ' A' ' 36' ' ' GLN . 17.5 ptpt -55.36 -37.13 67.12 Favored 'General case' 0 CA--C 1.543 0.687 0 CA-C-N 116.463 -0.335 . . . . 70.409999999999997 111.553 -179.781 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 40' ' ' LEU . . . . . 0.42 ' HG ' ' O ' ' A' ' 36' ' ' GLN . 94.2 mt -69.03 -29.39 67.54 Favored 'General case' 0 CA--C 1.538 0.49 0 N-CA-C 112.002 0.371 . . . . 75.299999999999997 112.002 -179.086 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 41' ' ' ARG . . . . . 0.587 HH21 HD22 ' A' ' 56' ' ' LEU . 61.5 mtm180 -105.92 22.82 14.98 Favored 'General case' 0 CA--C 1.542 0.659 0 N-CA-C 112.118 0.414 . . . . 71.439999999999998 112.118 -177.78 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 31.1 t 62.69 28.96 16.79 Favored 'General case' 0 N--CA 1.482 1.156 0 CA-C-O 121.33 0.586 . . . . 71.219999999999999 112.046 176.133 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 65.3 mt -100.6 148.63 35.24 Favored Pre-proline 0 CA--C 1.543 0.692 0 CA-C-N 116.056 -0.52 . . . . 74.400000000000006 111.182 179.125 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 44' ' ' PRO . . . . . . . . . . . . . 56.8 Cg_endo -69.36 130.27 19.53 Favored 'Trans proline' 0 CA--C 1.541 0.852 0 C-N-CA 122.364 2.043 . . . . 55.329999999999998 113.094 179.644 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 34.8 m -76.06 -21.77 15.63 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.533 0 CA-C-N 116.153 -0.476 . . . . 62.32 111.618 179.339 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 31.5 t -62.22 101.57 0.23 Allowed 'General case' 0 N--CA 1.473 0.721 0 CA-C-N 116.36 -0.382 . . . . 72.099999999999994 111.902 178.501 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 176.89 154.03 11.47 Favored Glycine 0 CA--C 1.532 1.119 0 C-N-CA 120.854 -0.689 . . . . 55.43 114.063 177.516 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 48' ' ' THR . . . . . 0.563 ' O ' ' HG ' ' A' ' 52' ' ' LEU . 44.0 p -76.82 174.06 10.96 Favored 'General case' 0 N--CA 1.476 0.871 0 O-C-N 122.633 -0.333 . . . . 72.129999999999995 110.87 174.133 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 24.5 tptm -49.85 -49.59 48.64 Favored 'General case' 0 N--CA 1.474 0.745 0 CA-C-O 120.84 0.353 . . . . 75.349999999999994 111.357 -179.566 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 50' ' ' THR . . . . . . . . . . . . . 82.7 m -58.27 -50.33 73.98 Favored 'General case' 0 N--CA 1.475 0.783 0 CA-C-O 120.954 0.407 . . . . 70.409999999999997 111.317 176.832 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 15.6 mm-40 -54.1 -46.76 72.19 Favored 'General case' 0 N--CA 1.469 0.484 0 CA-C-N 115.846 -0.615 . . . . 71.219999999999999 111.803 -179.71 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 52' ' ' LEU . . . . . 0.563 ' HG ' ' O ' ' A' ' 48' ' ' THR . 50.9 mt -63.03 -48.63 77.93 Favored 'General case' 0 CA--C 1.537 0.476 0 CA-C-N 116.304 -0.407 . . . . 73.319999999999993 111.309 -178.167 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 53' ' ' ILE . . . . . . . . . . . . . 74.3 mt -59.13 -48.07 88.03 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.568 0 N-CA-C 111.998 0.37 . . . . 72.010000000000005 111.998 -179.609 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 54' ' ' GLU . . . . . 0.724 ' HG2' HH21 ' A' ' 57' ' ' ARG . 27.2 mt-10 -68.87 -38.4 79.67 Favored 'General case' 0 CA--C 1.537 0.455 0 O-C-N 122.243 -0.286 . . . . 75.439999999999998 111.341 179.49 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 39.7 ttm180 -62.41 -43.83 97.89 Favored 'General case' 0 CA--C 1.539 0.554 0 CA-C-O 120.98 0.419 . . . . 73.329999999999998 111.14 177.591 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 56' ' ' LEU . . . . . 0.587 HD22 HH21 ' A' ' 41' ' ' ARG . 48.7 mt -58.76 -51.55 69.51 Favored 'General case' 0 C--O 1.237 0.415 0 CA-C-N 116.206 -0.452 . . . . 75.409999999999997 111.057 174.029 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 57' ' ' ARG . . . . . 0.724 HH21 ' HG2' ' A' ' 54' ' ' GLU . 79.0 mtm180 -60.62 -47.59 85.56 Favored 'General case' 0 CA--C 1.538 0.513 0 N-CA-C 112.205 0.446 . . . . 75.310000000000002 112.205 -178.761 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -55.12 -51.3 66.88 Favored 'General case' 0 N--CA 1.472 0.646 0 CA-C-O 120.863 0.363 . . . . 71.439999999999998 111.936 -178.348 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 59' ' ' TYR . . . . . . . . . . . . . 76.9 t80 -57.56 -41.34 80.84 Favored 'General case' 0 CA--C 1.54 0.596 0 CA-C-O 121.183 0.516 . . . . 62.439999999999998 111.59 179.222 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 60' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -74.61 -30.57 61.72 Favored 'General case' 0 N--CA 1.472 0.635 0 CA-C-O 121.381 0.61 . . . . 64.510000000000005 110.573 178.857 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 61' ' ' ASP . . . . . . . . . . . . . 8.0 t70 -64.62 -37.16 86.61 Favored 'General case' 0 CA--C 1.541 0.625 0 CA-C-N 115.891 -0.595 . . . . 75.040000000000006 111.491 -176.338 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 62' ' ' GLN . . . . . . . . . . . . . 51.5 mt-30 -63.52 -33.97 76.76 Favored 'General case' 0 CA--C 1.541 0.604 0 N-CA-C 112.129 0.418 . . . . 55.229999999999997 112.129 178.872 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 63' ' ' ILE . . . . . . . . . . . . . 28.9 pt -103.4 9.88 8.88 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.76 0 N-CA-C 112.524 0.565 . . . . 71.420000000000002 112.524 -176.424 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 30.0 t -128.41 130.11 23.55 Favored Pre-proline 0 N--CA 1.475 0.815 0 C-N-CA 122.511 0.324 . . . . 75.430000000000007 110.994 -179.886 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 65' ' ' PRO . . . . . . . . . . . . . 10.8 Cg_endo -53.25 114.34 1.7 Allowed 'Trans proline' 0 CA--C 1.541 0.869 0 C-N-CA 122.777 2.318 . . . . 63.130000000000003 113.24 -177.482 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 66' ' ' VAL . . . . . . . . . . . . . 35.3 m -88.98 138.62 29.12 Favored Pre-proline 0 CA--C 1.542 0.667 0 N-CA-C 112.584 0.587 . . . . 73.299999999999997 112.584 -174.528 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 67' ' ' PRO . . . . . . . . . . . . . 95.7 Cg_endo -87.68 104.1 0.54 Allowed 'Trans proline' 0 CA--C 1.545 1.036 0 C-N-CA 122.979 2.452 . . . . 65.219999999999999 112.859 177.026 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 79.87 -69.44 3.06 Favored Glycine 0 CA--C 1.53 1.009 0 C-N-CA 121.225 -0.512 . . . . 60.539999999999999 113.233 -179.762 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . 68.2 153.92 0.14 Allowed Pre-proline 0 N--CA 1.478 0.939 0 C-N-CA 123.369 0.668 . . . . 55.109999999999999 112.797 178.061 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 70' ' ' PRO . . . . . . . . . . . . . 67.7 Cg_endo -72.63 158.22 51.08 Favored 'Trans proline' 0 CA--C 1.54 0.795 0 C-N-CA 122.439 2.093 . . . . 64.439999999999998 112.894 177.327 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 85.0 tttt -98.63 107.52 19.99 Favored 'General case' 0 N--CA 1.467 0.418 0 CA-C-O 120.801 0.334 . . . . 72.239999999999995 111.212 -179.055 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -150.13 102.18 3.17 Favored Pre-proline 0 CA--C 1.537 0.46 0 CA-C-O 120.614 0.245 . . . . 71.439999999999998 111.58 -179.214 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 73' ' ' PRO . . . . . . . . . . . . . 59.0 Cg_endo -71.35 148.62 55.3 Favored 'Trans proline' 0 CA--C 1.539 0.751 0 C-N-CA 122.467 2.112 . . . . 75.510000000000005 112.548 177.859 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -92.53 165.32 13.07 Favored 'General case' 0 CA--C 1.538 0.483 0 CA-C-O 120.919 0.39 . . . . 64.319999999999993 111.558 178.698 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.253 1.277 0 CA-C-O 118.667 -0.682 . . . . 73.019999999999996 111.507 179.166 . . . . . . . . 0 0 . 1 . 016 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 65.0 mtt . . . . . 0 N--CA 1.494 1.729 0 CA-C-O 120.704 0.288 . . . . 75.129999999999995 111.335 . . . . . . . . . 0 0 . 1 . 016 nuclear orig full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . 131.8 73.97 0.11 Allowed Glycine 0 CA--C 1.524 0.645 0 C-N-CA 121.097 -0.573 . . . . 75.129999999999995 113.053 -179.526 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 3' ' ' HIS . . . . . . . . . . . . . 99.5 m-70 -134.78 150.37 50.53 Favored 'General case' 0 N--CA 1.469 0.511 0 CA-C-O 121.017 0.437 . . . . 74.400000000000006 111.441 178.249 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 4' ' ' HIS . . . . . . . . . . . . . 58.3 m-70 -111.12 147.55 34.64 Favored 'General case' 0 N--CA 1.47 0.528 0 CA-C-N 116.287 -0.415 . . . . 72.349999999999994 110.962 177.211 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 5' ' ' HIS . . . . . . . . . . . . . 36.4 m80 -74.22 104.41 4.99 Favored 'General case' 0 N--CA 1.467 0.383 0 CA-C-O 121.415 0.626 . . . . 73.420000000000002 111.933 179.684 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 50.5 m80 -69.38 81.62 0.38 Allowed 'General case' 0 CA--C 1.538 0.484 0 CA-C-N 115.487 -0.779 . . . . 74.439999999999998 111.476 -179.665 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 13.0 p-80 -58.69 135.03 57.31 Favored 'General case' 0 CA--C 1.539 0.554 0 CA-C-N 116.148 -0.478 . . . . 73.420000000000002 111.526 176.799 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 8' ' ' HIS . . . . . . . . . . . . . 83.2 t60 -154.89 133.55 12.05 Favored 'General case' 0 CA--C 1.536 0.412 0 CA-C-N 116.408 -0.36 . . . . 75.319999999999993 111.418 -178.809 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 36.0 t -126.14 136.75 53.24 Favored 'General case' 0 N--CA 1.471 0.624 0 CA-C-N 116.406 -0.361 . . . . 64.340000000000003 110.802 178.262 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 8.1 p80 -68.57 94.85 0.6 Allowed 'General case' 0 CA--C 1.543 0.676 0 CA-C-O 121.583 0.706 . . . . 74.540000000000006 110.807 178.721 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 11' ' ' MET . . . . . . . . . . . . . 28.0 ttt -115.6 109.44 17.77 Favored 'General case' 0 CA--C 1.538 0.485 0 CA-C-N 116.121 -0.491 . . . . 71.25 111.905 -176.695 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 75.4 m -114.2 167.83 10.35 Favored 'General case' 0 N--CA 1.47 0.565 0 CA-C-N 116.094 -0.503 . . . . 72.5 110.669 174.1 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 13' ' ' THR . . . . . . . . . . . . . 68.8 p -100.01 135.94 20.28 Favored Pre-proline 0 N--CA 1.468 0.461 0 CA-C-N 116.641 -0.254 . . . . 74.319999999999993 110.722 176.977 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 14' ' ' PRO . . . . . . . . . . . . . 38.4 Cg_endo -66.06 124.09 12.15 Favored 'Trans proline' 0 CA--C 1.539 0.736 0 C-N-CA 122.436 2.09 . . . . 63.310000000000002 112.825 179.433 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 1.9 pp -70.69 158.31 36.48 Favored 'General case' 0 CA--C 1.541 0.623 0 CA-C-O 121.103 0.478 . . . . 71.239999999999995 111.953 178.064 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 16' ' ' THR . . . . . . . . . . . . . 48.8 m -84.85 -54.87 4.39 Favored 'General case' 0 N--CA 1.473 0.719 0 CA-C-O 120.99 0.424 . . . . 64.099999999999994 112.102 -176.975 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . 80.72 -149.94 30.59 Favored Glycine 0 CA--C 1.53 0.972 0 C-N-CA 121.129 -0.558 . . . . 64.120000000000005 112.357 -174.835 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 37.4 mtmm -112.23 100.32 49.13 Favored Pre-proline 0 CA--C 1.54 0.56 0 O-C-N 122.382 -0.481 . . . . 75.230000000000004 111.552 178.704 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 1.3 Cg_endo -85.66 -160.17 0.11 Allowed 'Trans proline' 0 CA--C 1.536 0.59 0 C-N-CA 122.902 2.401 . . . . 74.219999999999999 112.066 174.246 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . 168.71 -102.59 0.19 Allowed Glycine 0 CA--C 1.523 0.574 0 C-N-CA 120.5 -0.857 . . . . 53.009999999999998 113.045 176.658 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -97.59 179.75 4.74 Favored 'General case' 0 CA--C 1.538 0.507 0 CA-C-O 121.248 0.547 . . . . 71.420000000000002 111.903 -177.005 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 22' ' ' LEU . . . . . 0.438 HD12 ' HB3' ' A' ' 56' ' ' LEU . 94.3 mt -127.0 137.67 31.09 Favored Pre-proline 0 CA--C 1.538 0.501 0 CA-C-N 116.195 -0.457 . . . . 71.439999999999998 110.61 178.983 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 23' ' ' PRO . . . . . 0.469 ' O ' ' HG ' ' A' ' 26' ' ' LEU . 37.8 Cg_endo -64.92 139.22 60.96 Favored 'Trans proline' 0 CA--C 1.54 0.805 0 C-N-CA 122.605 2.204 . . . . 65.140000000000001 113.134 -178.386 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -72.15 -2.83 20.12 Favored 'General case' 0 CA--C 1.543 0.694 0 CA-C-O 121.04 0.448 . . . . 71.510000000000005 111.874 179.124 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 11.2 m120 -82.54 18.73 1.42 Allowed 'General case' 0 CA--C 1.542 0.658 0 N-CA-C 112.183 0.438 . . . . 73.129999999999995 112.183 -178.768 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 26' ' ' LEU . . . . . 0.469 ' HG ' ' O ' ' A' ' 23' ' ' PRO . 90.7 mt -58.18 -40.12 80.67 Favored 'General case' 0 N--CA 1.471 0.612 0 CA-C-O 120.842 0.353 . . . . 73.349999999999994 111.84 -178.632 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 7.3 m-20 -63.28 -34.81 78.49 Favored 'General case' 0 CA--C 1.539 0.534 0 CA-C-O 120.978 0.418 . . . . 71.150000000000006 111.206 175.283 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 36.6 t70 -72.45 -42.55 64.89 Favored 'General case' 0 CA--C 1.542 0.66 0 CA-C-N 116.255 -0.43 . . . . 74.519999999999996 111.533 -178.649 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 29' ' ' MET . . . . . . . . . . . . . 50.2 mtm -68.92 159.81 31.95 Favored 'General case' 0 N--CA 1.471 0.606 0 CA-C-O 121.092 0.472 . . . . 71.230000000000004 111.608 179.279 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 54.5 mtpt -88.9 171.43 9.91 Favored 'General case' 0 CA--C 1.54 0.583 0 N-CA-C 112.689 0.626 . . . . 73.25 112.689 -173.623 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 31' ' ' VAL . . . . . 0.45 HG23 ' HD3' ' A' ' 49' ' ' LYS . 86.5 t -56.66 -47.89 81.59 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.615 0 CA-C-N 115.798 -0.637 . . . . 75.310000000000002 112.372 -176.74 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -58.67 -38.52 78.37 Favored 'General case' 0 CA--C 1.536 0.426 0 CA-C-N 116.448 -0.342 . . . . 53.25 111.871 -179.353 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 37.4 mt-10 -69.73 -41.86 74.73 Favored 'General case' 0 CA--C 1.537 0.469 0 CA-C-O 121.114 0.483 . . . . 73.439999999999998 111.192 179.42 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 34' ' ' LEU . . . . . 0.495 HD11 ' HZ3' ' A' ' 49' ' ' LYS . 95.4 mt -63.34 -47.21 83.11 Favored 'General case' 0 CA--C 1.54 0.559 0 CA-C-N 116.346 -0.388 . . . . 73.019999999999996 111.305 178.171 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 35' ' ' LYS . . . . . 0.468 ' HE2' ' O ' ' A' ' 45' ' ' VAL . 98.5 mttt -61.31 -35.66 77.98 Favored 'General case' 0 CA--C 1.537 0.464 0 CA-C-N 116.577 -0.283 . . . . 73.040000000000006 111.513 177.598 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 36' ' ' GLN . . . . . 0.515 ' NE2' HD11 ' A' ' 40' ' ' LEU . 22.4 tm0? -60.59 -44.52 96.16 Favored 'General case' 0 CA--C 1.539 0.536 0 CA-C-O 120.868 0.366 . . . . 73.319999999999993 110.771 177.38 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 37' ' ' GLU . . . . . 0.594 ' HB3' ' NH2' ' A' ' 41' ' ' ARG . 24.8 mm-40 -64.31 -41.03 97.03 Favored 'General case' 0 CA--C 1.543 0.698 0 CA-C-N 116.329 -0.396 . . . . 74.230000000000004 111.884 175.04 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 38' ' ' LEU . . . . . 0.461 ' HB2' HG11 ' A' ' 45' ' ' VAL . 88.5 mt -62.24 -56.01 22.81 Favored 'General case' 0 N--CA 1.472 0.628 0 N-CA-C 112.164 0.431 . . . . 72.120000000000005 112.164 179.552 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 18.6 ptpt -57.03 -34.75 68.52 Favored 'General case' 0 N--CA 1.473 0.683 0 N-CA-C 112.582 0.586 . . . . 75.109999999999999 112.582 -174.475 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 40' ' ' LEU . . . . . 0.515 HD11 ' NE2' ' A' ' 36' ' ' GLN . 92.7 mt -63.55 -33.5 75.72 Favored 'General case' 0 N--CA 1.473 0.679 0 CA-C-O 120.904 0.383 . . . . 70.530000000000001 111.694 177.91 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 41' ' ' ARG . . . . . 0.735 HH21 HD22 ' A' ' 56' ' ' LEU . 70.0 mtm-85 -105.69 23.11 14.4 Favored 'General case' 0 CA--C 1.54 0.565 0 CA-C-N 116.44 -0.346 . . . . 71.420000000000002 111.923 -178.013 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 23.2 t 64.48 22.81 12.79 Favored 'General case' 0 N--CA 1.478 0.959 0 N-CA-C 112.317 0.488 . . . . 64.219999999999999 112.317 173.134 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 72.5 mt -92.12 134.39 28.65 Favored Pre-proline 0 CA--C 1.546 0.805 0 CA-C-N 116.626 -0.261 . . . . 74.450000000000003 111.611 -178.482 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 44' ' ' PRO . . . . . 0.525 ' HD2' ' HD3' ' A' ' 55' ' ' ARG . 77.8 Cg_exo -52.06 115.37 2.12 Favored 'Trans proline' 0 C--N 1.356 0.949 0 C-N-CA 122.994 2.463 . . . . 74.310000000000002 113.71 178.638 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 45' ' ' VAL . . . . . 0.468 ' O ' ' HE2' ' A' ' 35' ' ' LYS . 33.0 m -85.5 -10.77 11.4 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.608 0 N-CA-C 112.523 0.564 . . . . 74.219999999999999 112.523 -178.955 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 33.2 t -80.9 32.3 0.32 Allowed 'General case' 0 N--CA 1.481 1.1 0 N-CA-C 113.064 0.764 . . . . 72.319999999999993 113.064 -173.424 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . -107.8 176.45 20.67 Favored Glycine 0 CA--C 1.527 0.833 0 C-N-CA 121.028 -0.606 . . . . 72.239999999999995 113.471 179.459 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 48' ' ' THR . . . . . 0.544 ' O ' ' HG ' ' A' ' 52' ' ' LEU . 72.3 p -76.31 163.14 27.3 Favored 'General case' 0 N--CA 1.475 0.812 0 O-C-N 122.668 -0.313 . . . . 72.439999999999998 111.372 176.829 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 49' ' ' LYS . . . . . 0.495 ' HZ3' HD11 ' A' ' 34' ' ' LEU . 29.6 tptp -44.37 -44.24 8.14 Favored 'General case' 0 N--CA 1.473 0.721 0 CA-C-O 120.962 0.41 . . . . 72.120000000000005 111.795 178.169 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 50' ' ' THR . . . . . . . . . . . . . 30.5 m -68.2 -44.79 75.06 Favored 'General case' 0 CA--C 1.538 0.504 0 CA-C-N 116.213 -0.449 . . . . 72.310000000000002 111.675 179.037 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 44.0 mt-10 -60.7 -42.47 97.24 Favored 'General case' 0 N--CA 1.471 0.611 0 N-CA-C 111.952 0.352 . . . . 72.209999999999994 111.952 179.446 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 52' ' ' LEU . . . . . 0.544 ' HG ' ' O ' ' A' ' 48' ' ' THR . 46.7 mt -54.81 -39.2 68.26 Favored 'General case' 0 N--CA 1.469 0.523 0 CA-C-O 121.504 0.669 . . . . 75.230000000000004 110.325 178.457 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 53' ' ' ILE . . . . . . . . . . . . . 88.5 mt -70.25 -58.09 6.34 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.517 0 CA-C-N 115.184 -0.916 . . . . 70.439999999999998 111.911 179.287 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 40.6 mt-10 -61.29 -31.7 71.53 Favored 'General case' 0 N--CA 1.468 0.469 0 N-CA-C 111.897 0.332 . . . . 71.340000000000003 111.897 -178.019 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 55' ' ' ARG . . . . . 0.525 ' HD3' ' HD2' ' A' ' 44' ' ' PRO . 35.2 ttm180 -65.53 -41.22 93.3 Favored 'General case' 0 CA--C 1.538 0.486 0 CA-C-O 120.76 0.314 . . . . 74.439999999999998 111.258 177.187 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 56' ' ' LEU . . . . . 0.735 HD22 HH21 ' A' ' 41' ' ' ARG . 79.6 mt -63.72 -47.7 80.07 Favored 'General case' 0 CA--C 1.537 0.46 0 CA-C-O 121.023 0.44 . . . . 63.530000000000001 111.043 174.015 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 74.6 mtp180 -61.67 -43.12 99.45 Favored 'General case' 0 CA--C 1.54 0.583 0 CA-C-N 116.098 -0.501 . . . . 75.030000000000001 111.466 179.328 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -64.8 -39.51 93.71 Favored 'General case' 0 N--CA 1.469 0.507 0 CA-C-N 116.419 -0.355 . . . . 63.109999999999999 111.673 179.456 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 59' ' ' TYR . . . . . . . . . . . . . 84.8 t80 -64.56 -47.29 79.28 Favored 'General case' 0 CA--C 1.537 0.468 0 CA-C-O 120.977 0.418 . . . . 71.319999999999993 110.677 176.371 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 60' ' ' GLN . . . . . . . . . . . . . 8.4 tp-100 -60.15 -41.35 92.56 Favored 'General case' 0 CA--C 1.54 0.564 0 CA-C-O 121.092 0.472 . . . . 73.409999999999997 110.914 176.664 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 61' ' ' ASP . . . . . . . . . . . . . 26.9 t70 -59.86 -49.4 77.87 Favored 'General case' 0 CA--C 1.543 0.704 0 CA-C-N 115.895 -0.593 . . . . 65.439999999999998 111.959 179.863 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 62' ' ' GLN . . . . . . . . . . . . . 10.8 pt20 -70.82 -25.82 63.02 Favored 'General case' 0 CA--C 1.542 0.64 0 N-CA-C 112.681 0.623 . . . . 65.200000000000003 112.681 -176.573 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 63' ' ' ILE . . . . . . . . . . . . . 32.5 pt -90.26 -18.01 7.76 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.771 0 O-C-N 121.917 -0.489 . . . . 75.510000000000005 111.872 179.124 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 38.1 t -90.13 129.13 46.95 Favored Pre-proline 0 N--CA 1.471 0.614 0 CA-C-O 120.546 0.212 . . . . 73.519999999999996 111.229 178.842 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 65' ' ' PRO . . . . . . . . . . . . . 24.6 Cg_exo -63.42 88.08 0.13 Allowed 'Trans proline' 0 CA--C 1.539 0.761 0 C-N-CA 122.4 2.066 . . . . 64.140000000000001 112.654 178.652 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 66' ' ' VAL . . . . . . . . . . . . . 27.0 m -116.92 146.64 38.34 Favored Pre-proline 0 CA--C 1.541 0.599 0 CA-C-N 116.513 -0.312 . . . . 74.129999999999995 111.585 -179.351 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 67' ' ' PRO . . . . . . . . . . . . . 52.8 Cg_exo -53.51 -48.24 22.99 Favored 'Trans proline' 0 C--N 1.354 0.822 0 C-N-CA 122.617 2.211 . . . . 74.519999999999996 112.554 178.512 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . -84.46 35.66 3.0 Favored Glycine 0 CA--C 1.527 0.815 0 C-N-CA 121.379 -0.439 . . . . 71.450000000000003 113.467 179.445 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . -58.43 153.24 39.77 Favored Pre-proline 0 CA--C 1.541 0.612 0 O-C-N 122.751 -0.264 . . . . 54.329999999999998 111.557 177.669 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 70' ' ' PRO . . . . . . . . . . . . . 19.6 Cg_endo -57.14 151.28 51.93 Favored 'Trans proline' 0 CA--C 1.54 0.79 0 C-N-CA 122.404 2.069 . . . . 71.019999999999996 112.74 179.454 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 26.4 ttpp -70.67 -19.82 62.75 Favored 'General case' 0 CA--C 1.541 0.597 0 CA-C-O 121.156 0.503 . . . . 75.329999999999998 111.029 178.895 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 72' ' ' ALA . . . . . 0.447 ' HA ' ' HD3' ' A' ' 73' ' ' PRO . . . -71.1 126.91 92.04 Favored Pre-proline 0 CA--C 1.543 0.691 0 CA-C-N 116.229 -0.441 . . . . 64.420000000000002 111.378 175.634 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 73' ' ' PRO . . . . . 0.447 ' HD3' ' HA ' ' A' ' 72' ' ' ALA . 15.8 Cg_exo -69.07 174.37 9.01 Favored 'Trans proline' 0 CA--C 1.542 0.904 0 C-N-CA 122.698 2.265 . . . . 55.520000000000003 113.395 -179.478 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -61.86 137.77 58.28 Favored 'General case' 0 CA--C 1.538 0.492 0 CA-C-O 120.915 0.388 . . . . 36.020000000000003 111.834 178.919 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.255 1.374 0 CA-C-O 118.999 -0.525 . . . . 73.420000000000002 111.782 -179.102 . . . . . . . . 0 0 . 1 . 017 nuclear orig full ' A' A ' 1' ' ' MET . . . . . 0.461 ' C ' ' SD ' ' A' ' 1' ' ' MET . 0.0 OUTLIER . . . . . 0 N--CA 1.49 1.567 0 CA-C-O 120.983 0.421 . . . . 61.210000000000001 111.788 . . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . 103.78 -172.94 21.37 Favored Glycine 0 CA--C 1.527 0.793 0 C-N-CA 121.241 -0.504 . . . . 73.439999999999998 113.085 -177.712 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 3' ' ' HIS . . . . . . . . . . . . . 79.6 t60 -154.21 -50.87 0.09 Allowed 'General case' 0 N--CA 1.467 0.379 0 CA-C-O 121.13 0.49 . . . . 75.540000000000006 110.726 179.19 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 4' ' ' HIS . . . . . . . . . . . . . 78.2 t60 -146.38 114.9 6.76 Favored 'General case' 0 CA--C 1.538 0.486 0 CA-C-N 116.143 -0.48 . . . . 74.439999999999998 110.535 177.417 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 5' ' ' HIS . . . . . . . . . . . . . 42.8 m80 -73.83 100.31 3.43 Favored 'General case' 0 CA--C 1.538 0.481 0 CA-C-O 121.042 0.448 . . . . 73.010000000000005 111.684 -175.368 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 83.5 t60 -75.34 103.63 5.57 Favored 'General case' 0 CA--C 1.538 0.513 0 CA-C-O 121.001 0.429 . . . . 71.040000000000006 110.409 176.963 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 72.2 m80 -67.66 140.4 56.82 Favored 'General case' 0 CA--C 1.538 0.498 0 CA-C-N 116.237 -0.438 . . . . 73.129999999999995 111.901 -176.686 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 8' ' ' HIS . . . . . . . . . . . . . 57.0 m-70 -71.55 93.65 1.23 Allowed 'General case' 0 N--CA 1.471 0.595 0 CA-C-O 121.29 0.566 . . . . 73.129999999999995 111.859 -179.566 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 21.1 m -97.94 149.42 22.44 Favored 'General case' 0 N--CA 1.469 0.484 0 CA-C-N 115.869 -0.605 . . . . 73.049999999999997 110.919 178.228 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 32.2 p-80 -110.97 143.1 42.17 Favored 'General case' 0 N--CA 1.472 0.654 0 CA-C-O 120.481 0.181 . . . . 71.230000000000004 111.231 179.553 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 11' ' ' MET . . . . . . . . . . . . . 21.5 ptp -167.68 170.79 10.69 Favored 'General case' 0 N--CA 1.47 0.575 0 N-CA-C 112.449 0.537 . . . . 73.430000000000007 112.449 -177.238 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 94.1 p 54.63 26.58 7.56 Favored 'General case' 0 N--CA 1.478 0.939 0 N-CA-C 113.402 0.89 . . . . 71.299999999999997 113.402 176.233 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 13' ' ' THR . . . . . 0.469 ' HA ' ' HD3' ' A' ' 14' ' ' PRO . 80.8 p -73.93 130.01 83.86 Favored Pre-proline 0 N--CA 1.473 0.712 0 O-C-N 122.037 -0.414 . . . . 73.439999999999998 111.32 179.186 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 14' ' ' PRO . . . . . 0.469 ' HD3' ' HA ' ' A' ' 13' ' ' THR . 9.2 Cg_exo -73.29 24.4 0.31 Allowed 'Trans proline' 0 CA--C 1.549 1.241 0 C-N-CA 123.472 2.781 . . . . 72.310000000000002 114.958 -174.766 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 7.1 mp 59.33 -175.65 0.1 Allowed 'General case' 0 CA--C 1.546 0.825 0 CA-C-O 121.636 0.731 . . . . 75.030000000000001 112.928 177.362 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 16' ' ' THR . . . . . . . . . . . . . 44.4 p -127.03 106.93 9.61 Favored 'General case' 0 N--CA 1.472 0.675 0 CA-C-N 115.641 -0.709 . . . . 71.310000000000002 110.992 178.322 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . -105.19 -175.22 24.36 Favored Glycine 0 CA--C 1.528 0.874 0 C-N-CA 121.15 -0.548 . . . . 73.420000000000002 113.606 -177.214 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 6.2 ptpp? -130.71 153.64 81.61 Favored Pre-proline 0 CA--C 1.542 0.642 0 O-C-N 122.653 -0.322 . . . . 74.400000000000006 111.577 179.564 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 90.9 Cg_endo -91.32 127.66 1.13 Allowed 'Trans proline' 0 CA--C 1.543 0.961 0 C-N-CA 122.831 2.354 . . . . 74.099999999999994 112.315 170.556 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . -79.33 48.01 3.31 Favored Glycine 0 CA--C 1.53 0.998 0 C-N-CA 121.152 -0.547 . . . . 75.140000000000001 113.904 -178.832 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -177.06 173.33 1.84 Allowed 'General case' 0 N--CA 1.469 0.512 0 C-N-CA 122.738 0.415 . . . . 74.430000000000007 110.843 -179.376 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 22' ' ' LEU . . . . . 0.477 ' HB3' HD11 ' A' ' 26' ' ' LEU . 59.0 mt -92.16 137.9 24.72 Favored Pre-proline 0 N--CA 1.469 0.486 0 CA-C-O 120.685 0.279 . . . . 73.450000000000003 111.714 178.046 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 23' ' ' PRO . . . . . 0.47 ' O ' ' HG ' ' A' ' 26' ' ' LEU . 53.6 Cg_exo -54.74 143.3 70.71 Favored 'Trans proline' 0 CA--C 1.541 0.833 0 C-N-CA 122.68 2.253 . . . . 74.230000000000004 112.523 173.899 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -72.02 -23.47 61.4 Favored 'General case' 0 CA--C 1.538 0.51 0 N-CA-C 112.36 0.504 . . . . 73.530000000000001 112.36 -177.547 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 25' ' ' ASN . . . . . 0.547 ' HB3' ' HB3' ' A' ' 28' ' ' ASP . 47.8 m-80 -102.13 27.13 6.91 Favored 'General case' 0 CA--C 1.543 0.702 0 N-CA-C 113.063 0.764 . . . . 75.150000000000006 113.063 -175.964 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 26' ' ' LEU . . . . . 0.477 HD11 ' HB3' ' A' ' 22' ' ' LEU . 71.5 mt -49.83 -42.37 47.13 Favored 'General case' 0 N--CA 1.479 1.017 0 CA-C-O 120.976 0.417 . . . . 73.319999999999993 111.973 177.738 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 3.7 m-20 -66.81 -35.11 79.31 Favored 'General case' 0 CA--C 1.543 0.676 0 CA-C-O 121.13 0.49 . . . . 75.219999999999999 111.286 178.402 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 28' ' ' ASP . . . . . 0.547 ' HB3' ' HB3' ' A' ' 25' ' ' ASN . 21.5 t70 -73.07 -31.49 64.42 Favored 'General case' 0 CA--C 1.542 0.649 0 CA-C-N 116.18 -0.464 . . . . 64.230000000000004 111.239 -179.732 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 29' ' ' MET . . . . . 0.459 ' HG3' ' O ' ' A' ' 25' ' ' ASN . 86.9 mtp -63.84 156.31 27.85 Favored 'General case' 0 CA--C 1.541 0.604 0 CA-C-O 121.434 0.635 . . . . 61.409999999999997 112.288 -177.531 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 30' ' ' LYS . . . . . 0.451 ' HB2' ' HG3' ' A' ' 33' ' ' GLU . 55.3 mtpt -80.82 157.78 25.62 Favored 'General case' 0 CA--C 1.538 0.515 0 CA-C-N 116.012 -0.54 . . . . 74.140000000000001 111.836 -178.643 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 31' ' ' VAL . . . . . 0.549 HG23 ' HB2' ' A' ' 49' ' ' LYS . 16.0 t -52.14 -50.77 34.61 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.614 0 CA-C-N 115.961 -0.563 . . . . 74.140000000000001 112.188 -176.61 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -64.1 -27.69 69.26 Favored 'General case' 0 CA--C 1.539 0.546 0 N-CA-C 112.435 0.532 . . . . 75.420000000000002 112.435 -179.714 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 33' ' ' GLU . . . . . 0.451 ' HG3' ' HB2' ' A' ' 30' ' ' LYS . 40.6 mt-10 -72.92 -42.36 63.6 Favored 'General case' 0 N--CA 1.469 0.51 0 CA-C-O 120.899 0.381 . . . . 74.439999999999998 110.809 179.248 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 84.8 mt -59.94 -35.22 74.46 Favored 'General case' 0 N--CA 1.469 0.522 0 CA-C-O 121.308 0.575 . . . . 70.209999999999994 110.805 174.898 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 35' ' ' LYS . . . . . 0.496 ' HE3' HG11 ' A' ' 31' ' ' VAL . 99.3 mttt -64.89 -30.14 71.12 Favored 'General case' 0 CA--C 1.537 0.473 0 CA-C-N 115.998 -0.546 . . . . 74.409999999999997 111.668 176.262 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 57.2 tp60 -66.73 -44.15 82.32 Favored 'General case' 0 CA--C 1.539 0.545 0 CA-C-O 120.934 0.397 . . . . 72.400000000000006 110.402 173.954 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 14.1 mm-40 -54.8 -51.9 64.34 Favored 'General case' 0 N--CA 1.471 0.575 0 CA-C-O 121.425 0.631 . . . . 65.310000000000002 110.895 173.887 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 38' ' ' LEU . . . . . 0.433 ' CD1' HD22 ' A' ' 52' ' ' LEU . 90.6 mt -58.74 -53.46 58.08 Favored 'General case' 0 CA--C 1.541 0.628 0 N-CA-C 113.207 0.817 . . . . 73.329999999999998 113.207 -176.773 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 18.2 ptpt -59.09 -33.67 71.1 Favored 'General case' 0 N--CA 1.474 0.768 0 N-CA-C 112.511 0.559 . . . . 72.109999999999999 112.511 -174.462 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 97.4 mt -67.8 -10.83 56.16 Favored 'General case' 0 N--CA 1.471 0.603 0 CA-C-O 121.072 0.463 . . . . 75.219999999999999 111.532 178.264 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 41' ' ' ARG . . . . . . . . . . . . . 33.8 mtt180 -123.1 15.77 9.91 Favored 'General case' 0 CA--C 1.54 0.564 0 CA-C-N 116.182 -0.463 . . . . 75.540000000000006 111.121 -177.058 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 69.8 m 60.85 31.56 20.04 Favored 'General case' 0 N--CA 1.476 0.862 0 CA-C-N 116.192 -0.458 . . . . 63.030000000000001 111.868 -179.224 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 83.7 mt -98.6 137.2 20.61 Favored Pre-proline 0 CA--C 1.543 0.676 0 CA-C-N 116.488 -0.324 . . . . 74.420000000000002 111.378 179.443 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 44' ' ' PRO . . . . . . . . . . . . . 32.0 Cg_endo -64.06 130.12 26.42 Favored 'Trans proline' 0 CA--C 1.543 0.971 0 C-N-CA 122.941 2.427 . . . . 72.409999999999997 113.122 -178.746 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 23.0 m -102.34 15.04 5.69 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.725 0 CA-C-N 115.953 -0.567 . . . . 72.409999999999997 112.027 -176.154 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 29.6 t -68.47 -43.12 77.68 Favored 'General case' 0 N--CA 1.474 0.733 0 N-CA-C 113.479 0.918 . . . . 73.510000000000005 113.479 -174.053 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . -71.52 179.97 32.41 Favored Glycine 0 CA--C 1.528 0.903 0 N-CA-C 115.393 0.917 . . . . 43.140000000000001 115.393 -170.898 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 48' ' ' THR . . . . . 0.563 ' O ' ' HG ' ' A' ' 52' ' ' LEU . 69.4 p -77.05 170.6 16.24 Favored 'General case' 0 N--CA 1.471 0.582 0 C-N-CA 122.86 0.464 . . . . 74.430000000000007 111.647 178.365 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 49' ' ' LYS . . . . . 0.549 ' HB2' HG23 ' A' ' 31' ' ' VAL . 88.2 tttt -50.53 -51.82 44.25 Favored 'General case' 0 N--CA 1.47 0.563 0 N-CA-C 112.41 0.522 . . . . 75.430000000000007 112.41 -176.794 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 50' ' ' THR . . . . . . . . . . . . . 91.5 m -54.9 -44.77 74.43 Favored 'General case' 0 N--CA 1.471 0.6 0 CA-C-O 120.79 0.329 . . . . 71.129999999999995 111.141 178.157 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 49.3 mt-10 -59.38 -42.25 91.25 Favored 'General case' 0 N--CA 1.47 0.554 0 CA-C-O 120.973 0.416 . . . . 74.510000000000005 111.319 177.066 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 52' ' ' LEU . . . . . 0.563 ' HG ' ' O ' ' A' ' 48' ' ' THR . 32.9 mt -65.38 -47.04 77.73 Favored 'General case' 0 CA--C 1.539 0.545 0 CA-C-N 116.312 -0.404 . . . . 65.530000000000001 111.141 -179.655 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 53' ' ' ILE . . . . . . . . . . . . . 66.9 mt -58.14 -50.46 78.16 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.545 0 CA-C-O 120.84 0.352 . . . . 74.150000000000006 111.117 178.235 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 47.3 mt-10 -58.35 -41.81 85.52 Favored 'General case' 0 CA--C 1.536 0.413 0 CA-C-N 116.347 -0.388 . . . . 73.329999999999998 111.181 177.702 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 41.7 ttm180 -63.3 -40.19 96.67 Favored 'General case' 0 CA--C 1.543 0.703 0 CA-C-N 116.586 -0.279 . . . . 64.439999999999998 111.471 178.592 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 78.9 mt -62.13 -51.27 68.54 Favored 'General case' 0 N--CA 1.47 0.544 0 CA-C-O 121.098 0.475 . . . . 73.340000000000003 111.366 175.113 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 55.1 mtt180 -74.4 -18.42 60.66 Favored 'General case' 0 CA--C 1.542 0.639 0 CA-C-N 116.268 -0.424 . . . . 70.239999999999995 111.999 -178.267 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -76.03 -42.68 47.12 Favored 'General case' 0 N--CA 1.468 0.464 0 CA-C-O 121.162 0.505 . . . . 74.340000000000003 110.333 170.596 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 59' ' ' TYR . . . . . . . . . . . . . 48.6 t80 -62.91 -27.35 69.31 Favored 'General case' 0 CA--C 1.54 0.577 0 CA-C-N 115.932 -0.576 . . . . 72.120000000000005 110.452 175.32 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 60' ' ' GLN . . . . . 0.471 ' HB2' HD12 ' A' ' 22' ' ' LEU . 8.4 tp-100 -76.45 -40.43 50.53 Favored 'General case' 0 CA--C 1.542 0.635 0 CA-C-N 115.919 -0.582 . . . . 74.019999999999996 111.664 177.009 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 61' ' ' ASP . . . . . . . . . . . . . 26.8 t70 -56.44 -26.66 54.38 Favored 'General case' 0 CA--C 1.547 0.837 0 N-CA-C 112.211 0.448 . . . . 64.140000000000001 112.211 -176.888 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 62' ' ' GLN . . . . . . . . . . . . . 14.1 pt20 -91.8 -0.3 57.52 Favored 'General case' 0 CA--C 1.546 0.797 0 N-CA-C 112.345 0.498 . . . . 74.219999999999999 112.345 -178.791 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 63' ' ' ILE . . . . . . . . . . . . . 32.3 pt -135.92 -0.14 0.97 Allowed 'Isoleucine or valine' 0 N--CA 1.476 0.856 0 N-CA-C 112.352 0.501 . . . . 75.439999999999998 112.352 178.631 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 64' ' ' SER . . . . . 0.457 ' HB2' ' HG3' ' A' ' 60' ' ' GLN . 47.8 t -85.49 137.81 36.36 Favored Pre-proline 0 N--CA 1.474 0.744 0 N-CA-C 112.175 0.435 . . . . 74.430000000000007 112.175 -175.877 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 65' ' ' PRO . . . . . . . . . . . . . 60.6 Cg_endo -73.73 90.83 0.92 Allowed 'Trans proline' 0 CA--C 1.54 0.79 0 C-N-CA 122.29 1.993 . . . . 72.409999999999997 112.071 173.165 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 66' ' ' VAL . . . . . . . . . . . . . 34.3 m -72.03 145.54 88.97 Favored Pre-proline 0 CA--C 1.545 0.753 0 N-CA-C 112.31 0.485 . . . . 74.150000000000006 112.31 -177.128 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 67' ' ' PRO . . . . . . . . . . . . . 33.3 Cg_exo -60.33 -57.93 0.63 Allowed 'Trans proline' 0 CA--C 1.541 0.873 0 C-N-CA 122.739 2.292 . . . . 74.349999999999994 112.921 174.817 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . -138.32 -41.14 0.1 OUTLIER Glycine 0 CA--C 1.526 0.757 0 C-N-CA 121.117 -0.563 . . . . 70.219999999999999 113.594 -178.949 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . 68.23 151.64 0.13 Allowed Pre-proline 0 CA--C 1.544 0.739 0 C-N-CA 122.75 0.42 . . . . 52.420000000000002 111.828 -178.055 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 70' ' ' PRO . . . . . 0.456 ' HB2' ' HG3' ' A' ' 73' ' ' PRO . 87.8 Cg_exo -48.43 110.73 0.36 Allowed 'Trans proline' 0 CA--C 1.542 0.923 0 C-N-CA 122.73 2.287 . . . . 74.310000000000002 113.625 179.902 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 71' ' ' LYS . . . . . 0.476 ' NZ ' ' HB2' ' A' ' 71' ' ' LYS . 2.7 ttmp? -72.65 105.38 4.24 Favored 'General case' 0 CA--C 1.537 0.46 0 CA-C-N 116.379 -0.373 . . . . 74.010000000000005 110.598 177.173 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . 55.9 76.23 0.52 Allowed Pre-proline 0 CA--C 1.543 0.704 0 CA-C-N 116.151 -0.477 . . . . 75.329999999999998 111.231 -174.009 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 73' ' ' PRO . . . . . 0.456 ' HG3' ' HB2' ' A' ' 70' ' ' PRO . 51.9 Cg_exo -54.26 80.43 0.03 OUTLIER 'Trans proline' 0 CA--C 1.543 0.931 0 C-N-CA 123.402 2.735 . . . . 72.329999999999998 114.272 -172.993 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . 50.76 27.56 3.12 Favored 'General case' 0 CA--C 1.541 0.603 0 C-N-CA 123.22 0.608 . . . . 72.430000000000007 112.576 177.349 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.252 1.222 0 CA-C-O 118.922 -0.561 . . . . 54.009999999999998 112.276 -178.465 . . . . . . . . 0 0 . 1 . 018 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 44.0 tpp . . . . . 0 N--CA 1.487 1.425 0 CA-C-O 120.919 0.39 . . . . 73.019999999999996 111.52 . . . . . . . . . 0 0 . 1 . 018 nuclear orig full ' A' A ' 2' ' ' GLY . . . . . 0.475 ' HA3' ' HE1' ' A' ' 5' ' ' HIS . . . 82.24 56.92 2.74 Favored Glycine 0 CA--C 1.53 1.002 0 C-N-CA 121.069 -0.586 . . . . 60.509999999999998 114.448 174.641 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 3' ' ' HIS . . . . . . . . . . . . . 10.3 p80 42.31 -75.59 0.0 OUTLIER 'General case' 0 N--CA 1.487 1.41 0 N-CA-C 115.27 1.581 . . . . 74.209999999999994 115.27 172.205 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 4' ' ' HIS . . . . . 0.463 ' N ' ' O ' ' A' ' 2' ' ' GLY . 67.4 t60 -131.86 121.24 23.75 Favored 'General case' 0 N--CA 1.472 0.664 0 O-C-N 121.94 -0.475 . . . . 74.519999999999996 111.58 -172.534 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 5' ' ' HIS . . . . . 0.475 ' HE1' ' HA3' ' A' ' 2' ' ' GLY . 31.9 m80 -142.06 74.66 1.46 Allowed 'General case' 0 N--CA 1.476 0.838 0 N-CA-C 112.288 0.477 . . . . 64.219999999999999 112.288 177.913 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 2.9 p80 177.48 115.42 0.03 OUTLIER 'General case' 0 N--CA 1.476 0.873 0 C-N-CA 123.394 0.677 . . . . 61.329999999999998 110.315 173.957 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 7.5 p-80 -109.21 -175.48 2.77 Favored 'General case' 0 N--CA 1.472 0.656 0 CA-C-O 121.09 0.471 . . . . 63.130000000000003 112.138 -176.787 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 8' ' ' HIS . . . . . . . . . . . . . 13.9 p80 -137.79 114.51 10.53 Favored 'General case' 0 N--CA 1.471 0.581 0 CA-C-N 116.351 -0.386 . . . . 71.099999999999994 111.045 176.745 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 77.4 p -101.56 173.71 6.3 Favored 'General case' 0 N--CA 1.474 0.759 0 CA-C-O 121.114 0.483 . . . . 74.510000000000005 111.834 -176.672 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 26.7 p-80 -135.09 92.84 2.92 Favored 'General case' 0 CA--C 1.543 0.676 0 CA-C-O 120.932 0.396 . . . . 74.430000000000007 111.732 178.786 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 11' ' ' MET . . . . . . . . . . . . . 62.9 mtt -92.17 140.36 29.7 Favored 'General case' 0 N--CA 1.472 0.674 0 CA-C-N 116.568 -0.287 . . . . 65.329999999999998 111.082 177.601 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 40.6 t -90.8 -33.85 15.54 Favored 'General case' 0 N--CA 1.473 0.713 0 N-CA-C 112.021 0.378 . . . . 64.040000000000006 112.021 -179.589 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 13' ' ' THR . . . . . . . . . . . . . 13.3 p 62.96 143.74 0.07 OUTLIER Pre-proline 0 N--CA 1.483 1.221 0 C-N-CA 123.992 0.917 . . . . 74.209999999999994 112.402 -177.627 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 14' ' ' PRO . . . . . . . . . . . . . 52.4 Cg_exo -55.6 164.02 4.7 Favored 'Trans proline' 0 CA--C 1.544 0.979 0 C-N-CA 122.766 2.311 . . . . 72.420000000000002 113.848 -178.928 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 1.1 pt? -120.88 164.09 17.2 Favored 'General case' 0 CA--C 1.536 0.419 0 CA-C-O 120.909 0.385 . . . . 75.319999999999993 111.32 179.596 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 16' ' ' THR . . . . . . . . . . . . . 71.3 p -68.84 113.82 6.62 Favored 'General case' 0 N--CA 1.471 0.619 0 N-CA-C 112.884 0.698 . . . . 70.109999999999999 112.884 -174.175 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . -72.88 125.94 10.21 Favored Glycine 0 CA--C 1.525 0.662 0 N-CA-C 111.562 -0.615 . . . . 74.129999999999995 111.562 172.136 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 19.2 pttm -160.34 146.83 11.9 Favored Pre-proline 0 CA--C 1.538 0.512 0 N-CA-C 112.092 0.404 . . . . 72.140000000000001 112.092 -170.662 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 72.2 Cg_endo -77.38 117.95 4.49 Favored 'Trans proline' 0 CA--C 1.541 0.85 0 C-N-CA 122.347 2.031 . . . . 74.329999999999998 111.923 172.007 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . -53.11 -36.42 51.93 Favored Glycine 0 CA--C 1.527 0.841 0 C-N-CA 121.28 -0.486 . . . . 74.319999999999993 113.045 -179.821 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -145.05 169.96 17.11 Favored 'General case' 0 CA--C 1.536 0.434 0 CA-C-O 120.778 0.323 . . . . 64.219999999999999 110.787 176.389 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 92.1 mt -98.39 152.43 37.94 Favored Pre-proline 0 CA--C 1.541 0.602 0 CA-C-N 116.717 -0.22 . . . . 75.239999999999995 110.989 179.3 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 23' ' ' PRO . . . . . . . . . . . . . 19.2 Cg_endo -59.21 142.24 98.96 Favored 'Trans proline' 0 CA--C 1.54 0.82 0 C-N-CA 122.692 2.261 . . . . 70.019999999999996 112.931 -179.818 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -75.26 -24.41 57.61 Favored 'General case' 0 N--CA 1.469 0.49 0 CA-C-O 120.861 0.363 . . . . 54.200000000000003 111.833 -179.853 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 85.5 m-20 -86.49 36.67 0.71 Allowed 'General case' 0 CA--C 1.544 0.715 0 N-CA-C 112.873 0.694 . . . . 63.420000000000002 112.873 -175.705 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 26' ' ' LEU . . . . . 0.527 HD22 ' SD ' ' A' ' 29' ' ' MET . 87.5 mt -55.74 -29.28 59.29 Favored 'General case' 0 N--CA 1.475 0.795 0 CA-C-O 121.111 0.482 . . . . 65.219999999999999 110.856 175.433 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 3.6 m-20 -64.47 -35.33 80.58 Favored 'General case' 0 CA--C 1.541 0.627 0 CA-C-N 116.073 -0.512 . . . . 65.049999999999997 111.343 176.019 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 31.3 m-20 -81.71 -22.28 37.48 Favored 'General case' 0 CA--C 1.537 0.467 0 CA-C-O 121.062 0.458 . . . . 65.310000000000002 111.306 177.452 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 29' ' ' MET . . . . . 0.527 ' SD ' HD22 ' A' ' 26' ' ' LEU . 85.1 mtp -72.47 124.42 25.15 Favored 'General case' 0 CA--C 1.536 0.436 0 CA-C-O 120.958 0.409 . . . . 75.420000000000002 110.512 175.104 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 61.1 mtpt -72.42 170.53 14.08 Favored 'General case' 0 CA--C 1.537 0.459 0 CA-C-O 120.988 0.423 . . . . 72.219999999999999 111.807 -177.04 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 45.8 t -53.19 -46.76 56.41 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.659 0 CA-C-N 116.039 -0.528 . . . . 72.040000000000006 111.8 -175.475 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -61.45 -40.55 94.89 Favored 'General case' 0 N--CA 1.469 0.507 0 N-CA-C 112.064 0.394 . . . . 72.310000000000002 112.064 179.441 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 39.7 mt-10 -64.28 -46.39 83.87 Favored 'General case' 0 CA--C 1.537 0.471 0 CA-C-O 120.991 0.424 . . . . 73.319999999999993 111.117 179.42 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 92.9 mt -63.81 -49.17 73.93 Favored 'General case' 0 N--CA 1.47 0.53 0 CA-C-N 116.159 -0.473 . . . . 74.540000000000006 111.646 178.18 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 35' ' ' LYS . . . . . 0.425 ' HG2' ' HB ' ' A' ' 45' ' ' VAL . 56.1 mtpt -52.83 -45.18 67.18 Favored 'General case' 0 N--CA 1.473 0.678 0 CA-C-O 121.203 0.525 . . . . 75.099999999999994 111.149 175.252 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 36' ' ' GLN . . . . . 0.538 ' O ' ' HG ' ' A' ' 40' ' ' LEU . 1.0 OUTLIER -57.75 -49.6 76.02 Favored 'General case' 0 CA--C 1.541 0.632 0 CA-C-N 115.761 -0.654 . . . . 65.349999999999994 110.673 177.553 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 37' ' ' GLU . . . . . 0.464 ' HG3' ' HE1' ' A' ' 29' ' ' MET . 55.8 mm-40 -62.47 -35.14 78.39 Favored 'General case' 0 N--CA 1.471 0.578 0 N-CA-C 112.183 0.438 . . . . 73.049999999999997 112.183 178.743 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 38' ' ' LEU . . . . . 0.468 ' HB2' HG12 ' A' ' 45' ' ' VAL . 91.9 mt -66.53 -54.6 21.97 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-O 120.929 0.395 . . . . 74.040000000000006 111.591 177.88 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 17.6 ptmt -63.87 -24.2 67.65 Favored 'General case' 0 CA--C 1.541 0.616 0 N-CA-C 112.337 0.495 . . . . 75.010000000000005 112.337 -174.229 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 40' ' ' LEU . . . . . 0.538 ' HG ' ' O ' ' A' ' 36' ' ' GLN . 78.6 mt -58.03 -38.52 76.39 Favored 'General case' 0 N--CA 1.472 0.661 0 CA-C-O 121.421 0.629 . . . . 75.109999999999999 111.017 172.804 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 41' ' ' ARG . . . . . 0.414 ' NH2' ' HB3' ' A' ' 37' ' ' GLU . 41.6 mtm-85 -108.72 25.27 11.94 Favored 'General case' 0 CA--C 1.539 0.54 0 CA-C-N 115.514 -0.766 . . . . 74.25 111.724 -175.831 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 48.7 m 64.88 15.77 10.1 Favored 'General case' 0 N--CA 1.48 1.045 0 N-CA-C 112.877 0.695 . . . . 53.409999999999997 112.877 175.619 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 75.4 mt -79.57 140.52 55.55 Favored Pre-proline 0 CA--C 1.54 0.579 0 C-N-CA 122.029 0.132 . . . . 74.299999999999997 111.221 178.998 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 44' ' ' PRO . . . . . 0.462 ' HD2' ' HD3' ' A' ' 55' ' ' ARG . 41.4 Cg_endo -66.0 126.1 15.28 Favored 'Trans proline' 0 CA--C 1.538 0.717 0 C-N-CA 122.227 1.951 . . . . 73.200000000000003 112.452 -178.829 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 45' ' ' VAL . . . . . 0.468 HG12 ' HB2' ' A' ' 38' ' ' LEU . 21.5 m -94.04 -8.23 9.92 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.476 0 CA-C-O 121.103 0.478 . . . . 73.109999999999999 111.767 -177.352 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 38.6 m -76.7 74.85 3.37 Favored 'General case' 0 N--CA 1.47 0.534 0 CA-C-O 121.119 0.485 . . . . 72.420000000000002 111.938 -177.615 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . -166.89 177.2 41.71 Favored Glycine 0 CA--C 1.524 0.62 0 C-N-CA 121.298 -0.477 . . . . 71.540000000000006 112.909 176.2 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 48' ' ' THR . . . . . 0.541 ' O ' ' HG ' ' A' ' 52' ' ' LEU . 31.1 p -72.04 159.06 34.83 Favored 'General case' 0 N--CA 1.471 0.614 0 O-C-N 122.535 -0.391 . . . . 73.519999999999996 110.957 179.178 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 49' ' ' LYS . . . . . 0.406 ' HE3' ' O ' ' A' ' 29' ' ' MET . 87.4 tttt -48.84 -35.98 15.82 Favored 'General case' 0 N--CA 1.471 0.585 0 CA-C-O 121.174 0.511 . . . . 73.200000000000003 110.897 176.481 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 50' ' ' THR . . . . . 0.43 ' O ' ' HG3' ' A' ' 54' ' ' GLU . 10.1 m -58.24 -53.87 53.36 Favored 'General case' 0 N--CA 1.467 0.399 0 CA-C-N 115.726 -0.67 . . . . 74.150000000000006 110.979 176.367 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 41.1 mt-10 -58.16 -40.38 81.25 Favored 'General case' 0 N--CA 1.468 0.467 0 CA-C-N 116.076 -0.511 . . . . 72.310000000000002 111.66 178.526 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 52' ' ' LEU . . . . . 0.541 ' HG ' ' O ' ' A' ' 48' ' ' THR . 22.4 mt -60.68 -43.49 97.66 Favored 'General case' 0 CA--C 1.542 0.638 0 CA-C-O 121.155 0.502 . . . . 75.409999999999997 111.123 -179.843 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 53' ' ' ILE . . . . . . . . . . . . . 78.7 mt -65.5 -52.03 56.25 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.686 0 CA-C-N 116.162 -0.472 . . . . 72.040000000000006 111.36 177.065 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 54' ' ' GLU . . . . . 0.43 ' HG3' ' O ' ' A' ' 50' ' ' THR . 45.5 mt-10 -55.88 -42.54 76.09 Favored 'General case' 0 N--CA 1.471 0.622 0 CA-C-O 121.204 0.526 . . . . 65.310000000000002 111.068 178.966 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 55' ' ' ARG . . . . . 0.462 ' HD3' ' HD2' ' A' ' 44' ' ' PRO . 30.0 ttm180 -65.22 -43.89 90.02 Favored 'General case' 0 CA--C 1.539 0.55 0 CA-C-N 115.681 -0.69 . . . . 75.420000000000002 112.187 -177.171 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 51.1 mt -62.35 -47.28 84.91 Favored 'General case' 0 CA--C 1.54 0.561 0 O-C-N 122.249 -0.282 . . . . 75.340000000000003 111.288 175.881 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 98.3 mtt180 -57.92 -51.46 69.52 Favored 'General case' 0 N--CA 1.471 0.577 0 CA-C-O 120.971 0.415 . . . . 75.239999999999995 111.139 176.788 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -61.36 -37.87 84.92 Favored 'General case' 0 N--CA 1.47 0.563 0 CA-C-N 116.143 -0.48 . . . . 70.040000000000006 112.276 -178.854 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 59' ' ' TYR . . . . . . . . . . . . . 69.7 t80 -68.98 -44.34 73.08 Favored 'General case' 0 CA--C 1.538 0.507 0 CA-C-O 120.765 0.317 . . . . 75.349999999999994 111.523 179.069 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 60' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -65.62 -41.92 92.13 Favored 'General case' 0 CA--C 1.542 0.655 0 CA-C-O 121.596 0.712 . . . . 74.109999999999999 109.993 177.403 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 61' ' ' ASP . . . . . . . . . . . . . 21.6 t70 -60.16 -29.91 68.97 Favored 'General case' 0 CA--C 1.543 0.684 0 CA-C-N 115.486 -0.779 . . . . 75.340000000000003 112.189 -178.762 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 62' ' ' GLN . . . . . . . . . . . . . 10.9 pt20 -93.11 1.66 57.09 Favored 'General case' 0 N--CA 1.473 0.723 0 N-CA-C 112.468 0.544 . . . . 65.450000000000003 112.468 -178.33 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 63' ' ' ILE . . . . . . . . . . . . . 33.4 pt -122.73 -3.28 7.51 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.77 0 CA-C-O 121.098 0.475 . . . . 72.530000000000001 111.464 174.959 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 39.9 t -115.02 147.92 39.41 Favored Pre-proline 0 N--CA 1.472 0.655 0 CA-C-N 116.23 -0.441 . . . . 74.129999999999995 111.12 178.736 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 65' ' ' PRO . . . . . . . . . . . . . 29.1 Cg_endo -61.94 140.64 86.0 Favored 'Trans proline' 0 CA--C 1.539 0.771 0 C-N-CA 122.244 1.962 . . . . 74.010000000000005 112.743 177.827 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 66' ' ' VAL . . . . . . . . . . . . . 33.6 m -60.96 155.68 52.51 Favored Pre-proline 0 CA--C 1.544 0.732 0 CA-C-N 116.272 -0.422 . . . . 72.409999999999997 112.035 -178.397 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 67' ' ' PRO . . . . . . . . . . . . . 88.8 Cg_exo -49.1 -34.4 29.99 Favored 'Trans proline' 0 CA--C 1.543 0.95 0 C-N-CA 122.946 2.431 . . . . 71.439999999999998 113.321 177.669 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . -62.68 -20.55 61.87 Favored Glycine 0 CA--C 1.53 0.991 0 C-N-CA 121.386 -0.435 . . . . 74.310000000000002 113.491 178.421 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 69' ' ' ALA . . . . . 0.409 ' HA ' ' HD3' ' A' ' 70' ' ' PRO . . . -87.6 136.87 32.47 Favored Pre-proline 0 CA--C 1.538 0.516 0 O-C-N 122.466 -0.432 . . . . 73.120000000000005 110.929 177.232 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 70' ' ' PRO . . . . . 0.409 ' HD3' ' HA ' ' A' ' 69' ' ' ALA . 22.8 Cg_exo -65.05 92.34 0.21 Allowed 'Trans proline' 0 CA--C 1.541 0.86 0 C-N-CA 122.56 2.174 . . . . 73.219999999999999 113.282 -179.22 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -81.1 111.55 17.65 Favored 'General case' 0 CA--C 1.539 0.528 0 CA-C-O 120.941 0.401 . . . . 74.409999999999997 111.132 177.768 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -70.72 125.31 91.98 Favored Pre-proline 0 CA--C 1.539 0.549 0 CA-C-N 116.379 -0.373 . . . . 74.329999999999998 111.49 178.857 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 73' ' ' PRO . . . . . . . . . . . . . 69.7 Cg_endo -72.17 153.96 56.93 Favored 'Trans proline' 0 CA--C 1.539 0.728 0 C-N-CA 122.621 2.214 . . . . 73.299999999999997 113.231 -178.338 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -92.46 112.56 24.55 Favored 'General case' 0 CA--C 1.537 0.474 0 CA-C-N 116.254 -0.43 . . . . 74.349999999999994 111.438 178.958 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.252 1.206 0 CA-C-O 118.739 -0.648 . . . . 73.209999999999994 111.655 179.559 . . . . . . . . 0 0 . 1 . 019 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 24.6 mmt . . . . . 0 N--CA 1.489 1.496 0 CA-C-O 120.914 0.387 . . . . 74.519999999999996 110.592 . . . . . . . . . 0 0 . 1 . 019 nuclear orig full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . -154.94 98.16 0.18 Allowed Glycine 0 CA--C 1.524 0.626 0 C-N-CA 121.022 -0.609 . . . . 71.200000000000003 113.208 -176.566 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 3' ' ' HIS . . . . . . . . . . . . . 49.2 t-80 -147.21 103.44 3.58 Favored 'General case' 0 CA--C 1.539 0.54 0 CA-C-O 120.752 0.311 . . . . 73.5 110.601 176.369 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 4' ' ' HIS . . . . . . . . . . . . . 92.2 m-70 -133.45 178.83 6.61 Favored 'General case' 0 N--CA 1.471 0.611 0 CA-C-O 121.387 0.613 . . . . 74.209999999999994 112.076 -176.658 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 5' ' ' HIS . . . . . . . . . . . . . 61.1 m80 -122.26 137.83 54.7 Favored 'General case' 0 CA--C 1.536 0.43 0 CA-C-N 115.839 -0.618 . . . . 71.450000000000003 110.752 178.562 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 83.4 t60 -172.08 136.24 0.85 Allowed 'General case' 0 N--CA 1.471 0.599 0 N-CA-C 111.737 0.273 . . . . 74.25 111.737 -178.398 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 22.9 p-80 -158.0 136.31 10.98 Favored 'General case' 0 N--CA 1.471 0.608 0 N-CA-C 111.967 0.358 . . . . 71.329999999999998 111.967 176.128 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 8' ' ' HIS . . . . . . . . . . . . . 60.7 t60 -173.27 115.39 0.25 Allowed 'General case' 0 N--CA 1.47 0.553 0 CA-C-O 120.825 0.345 . . . . 73.329999999999998 110.646 173.827 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 40.0 t -161.38 141.08 10.44 Favored 'General case' 0 N--CA 1.469 0.515 0 CA-C-O 121.373 0.606 . . . . 74.329999999999998 112.168 179.866 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 53.4 m80 -139.43 87.32 2.18 Favored 'General case' 0 N--CA 1.466 0.373 0 CA-C-N 115.805 -0.634 . . . . 70.0 110.076 173.378 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 11' ' ' MET . . . . . . . . . . . . . 65.8 mtt -81.23 134.15 35.56 Favored 'General case' 0 CA--C 1.536 0.418 0 CA-C-N 116.158 -0.474 . . . . 71.099999999999994 111.298 -176.52 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 38.8 t -96.81 160.87 14.12 Favored 'General case' 0 N--CA 1.471 0.606 0 CA-C-O 121.081 0.467 . . . . 74.109999999999999 112.046 -175.644 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 13' ' ' THR . . . . . . . . . . . . . 62.2 p -119.87 126.43 26.9 Favored Pre-proline 0 N--CA 1.471 0.588 0 CA-C-N 115.984 -0.553 . . . . 75.540000000000006 111.218 178.937 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 14' ' ' PRO . . . . . . . . . . . . . 16.7 Cg_exo -67.82 77.81 0.56 Allowed 'Trans proline' 0 CA--C 1.54 0.794 0 C-N-CA 122.696 2.264 . . . . 72.129999999999995 112.759 176.977 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 2.4 pt? -62.83 131.46 48.88 Favored 'General case' 0 CA--C 1.542 0.636 0 CA-C-N 116.443 -0.344 . . . . 73.310000000000002 111.257 177.166 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 16' ' ' THR . . . . . . . . . . . . . 71.5 p -69.32 -68.99 0.36 Allowed 'General case' 0 N--CA 1.469 0.521 0 O-C-N 122.208 -0.308 . . . . 73.120000000000005 111.361 -178.157 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . 42.74 51.45 5.74 Favored Glycine 0 CA--C 1.53 1.017 0 N-CA-C 114.268 0.467 . . . . 64.439999999999998 114.268 175.352 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 22.9 pttp -93.76 147.76 34.14 Favored Pre-proline 0 CA--C 1.541 0.618 0 CA-C-N 117.081 0.441 . . . . 73.530000000000001 111.235 -179.388 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 89.0 Cg_exo -48.18 109.83 0.28 Allowed 'Trans proline' 0 CA--C 1.541 0.84 0 C-N-CA 122.976 2.451 . . . . 74.430000000000007 113.597 -179.441 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . -93.53 -5.3 63.38 Favored Glycine 0 CA--C 1.528 0.853 0 C-N-CA 121.264 -0.493 . . . . 64.25 113.398 -177.792 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -162.39 171.26 17.45 Favored 'General case' 0 N--CA 1.469 0.476 0 CA-C-O 120.928 0.394 . . . . 71.25 111.483 178.659 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 86.9 mt -78.96 135.63 58.71 Favored Pre-proline 0 CA--C 1.536 0.411 0 CA-C-N 116.702 -0.226 . . . . 73.329999999999998 110.957 176.579 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 23' ' ' PRO . . . . . 0.584 ' O ' ' HG ' ' A' ' 26' ' ' LEU . 28.0 Cg_exo -62.03 147.19 95.61 Favored 'Trans proline' 0 CA--C 1.537 0.67 0 C-N-CA 122.213 1.942 . . . . 74.239999999999995 112.109 176.448 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -67.18 -20.16 65.68 Favored 'General case' 0 CA--C 1.538 0.511 0 CA-C-O 121.166 0.507 . . . . 75.549999999999997 111.33 177.563 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 25' ' ' ASN . . . . . 0.443 ' O ' ' HG3' ' A' ' 29' ' ' MET . 8.1 m120 -89.33 23.3 2.57 Favored 'General case' 0 CA--C 1.547 0.85 0 N-CA-C 112.694 0.628 . . . . 74.200000000000003 112.694 -174.875 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 26' ' ' LEU . . . . . 0.584 ' HG ' ' O ' ' A' ' 23' ' ' PRO . 67.7 mt -48.04 -56.61 7.31 Favored 'General case' 0 N--CA 1.478 0.952 0 N-CA-C 112.851 0.686 . . . . 74.129999999999995 112.851 -177.151 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 8.2 p-10 -77.48 -7.91 56.95 Favored 'General case' 0 CA--C 1.541 0.614 0 N-CA-C 112.294 0.479 . . . . 72.109999999999999 112.294 -176.226 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 16.4 m-20 -90.85 -26.87 19.17 Favored 'General case' 0 CA--C 1.542 0.637 0 N-CA-C 111.75 0.278 . . . . 75.030000000000001 111.75 177.604 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 29' ' ' MET . . . . . 0.539 ' HE1' ' HA ' ' A' ' 26' ' ' LEU . 59.1 mtm -70.65 169.26 14.73 Favored 'General case' 0 N--CA 1.472 0.659 0 CA-C-O 121.366 0.603 . . . . 75.030000000000001 112.194 -178.558 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 30' ' ' LYS . . . . . 0.438 ' HB2' ' HG2' ' A' ' 33' ' ' GLU . 52.1 mtpt -76.98 157.66 31.1 Favored 'General case' 0 CA--C 1.536 0.427 0 CA-C-N 115.99 -0.55 . . . . 74.409999999999997 111.441 177.118 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 87.9 t -57.58 -40.17 73.59 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.5 0 CA-C-O 121.024 0.44 . . . . 65.010000000000005 110.643 175.451 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -59.51 -36.19 75.61 Favored 'General case' 0 CA--C 1.539 0.542 0 CA-C-N 116.135 -0.484 . . . . 75.430000000000007 111.775 177.04 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 33' ' ' GLU . . . . . 0.438 ' HG2' ' HB2' ' A' ' 30' ' ' LYS . 16.8 mm-40 -70.72 -40.99 72.47 Favored 'General case' 0 N--CA 1.47 0.536 0 CA-C-O 120.995 0.426 . . . . 63.009999999999998 110.73 178.309 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 34' ' ' LEU . . . . . 0.412 HD13 ' HB2' ' A' ' 52' ' ' LEU . 94.9 mt -59.07 -47.19 86.15 Favored 'General case' 0 CA--C 1.538 0.499 0 CA-C-O 121.021 0.439 . . . . 74.439999999999998 110.578 174.471 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 35' ' ' LYS . . . . . 0.548 ' HA ' HD13 ' A' ' 38' ' ' LEU . 95.5 mttt -59.72 -33.76 72.04 Favored 'General case' 0 N--CA 1.47 0.545 0 CA-C-N 116.295 -0.411 . . . . 74.129999999999995 111.469 176.253 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 36' ' ' GLN . . . . . 0.406 ' O ' ' HG ' ' A' ' 40' ' ' LEU . 22.8 tm0? -60.93 -47.99 83.85 Favored 'General case' 0 CA--C 1.537 0.448 0 CA-C-N 116.385 -0.37 . . . . 73.319999999999993 110.936 178.261 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 37' ' ' GLU . . . . . 0.462 ' HB3' ' NH2' ' A' ' 41' ' ' ARG . 29.5 mt-10 -67.86 -39.39 83.78 Favored 'General case' 0 CA--C 1.54 0.576 0 CA-C-O 120.824 0.345 . . . . 75.209999999999994 111.904 176.616 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 38' ' ' LEU . . . . . 0.548 HD13 ' HA ' ' A' ' 35' ' ' LYS . 83.9 mt -57.42 -55.42 34.99 Favored 'General case' 0 N--CA 1.471 0.606 0 N-CA-C 111.921 0.341 . . . . 75.010000000000005 111.921 179.189 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 17.7 ptpt -57.35 -30.6 64.97 Favored 'General case' 0 CA--C 1.542 0.645 0 N-CA-C 112.251 0.463 . . . . 75.129999999999995 112.251 -176.72 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 40' ' ' LEU . . . . . 0.406 ' HG ' ' O ' ' A' ' 36' ' ' GLN . 89.3 mt -68.2 -38.98 82.55 Favored 'General case' 0 N--CA 1.469 0.524 0 CA-C-O 120.926 0.393 . . . . 75.439999999999998 111.389 177.29 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 41' ' ' ARG . . . . . 0.665 HH21 HD23 ' A' ' 56' ' ' LEU . 0.0 OUTLIER -100.32 22.2 11.93 Favored 'General case' 0 CA--C 1.543 0.696 0 N-CA-C 112.055 0.391 . . . . 74.340000000000003 112.055 -179.211 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 44.1 t 62.32 27.96 16.67 Favored 'General case' 0 N--CA 1.481 1.087 0 N-CA-C 112.462 0.542 . . . . 74.430000000000007 112.462 174.619 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 70.6 mt -93.37 143.41 26.64 Favored Pre-proline 0 CA--C 1.543 0.705 0 CA-C-N 116.385 -0.371 . . . . 75.219999999999999 111.915 -179.312 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 44' ' ' PRO . . . . . 0.499 ' HD2' ' HD3' ' A' ' 55' ' ' ARG . 41.4 Cg_exo -57.07 119.54 6.86 Favored 'Trans proline' 0 CA--C 1.542 0.901 0 C-N-CA 122.743 2.295 . . . . 62.109999999999999 112.954 177.51 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 45' ' ' VAL . . . . . 0.467 ' O ' ' HE2' ' A' ' 35' ' ' LYS . 35.6 m -86.17 -16.73 9.59 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.675 0 N-CA-C 112.574 0.583 . . . . 64.310000000000002 112.574 -178.802 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 52.0 m -77.24 36.01 0.18 Allowed 'General case' 0 N--CA 1.478 0.952 0 N-CA-C 113.628 0.973 . . . . 73.040000000000006 113.628 -173.498 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . -112.15 176.34 17.88 Favored Glycine 0 CA--C 1.528 0.89 0 C-N-CA 120.892 -0.67 . . . . 73.5 112.912 177.71 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 48' ' ' THR . . . . . 0.565 ' O ' ' HG ' ' A' ' 52' ' ' LEU . 59.3 p -82.6 169.74 15.95 Favored 'General case' 0 N--CA 1.473 0.719 0 O-C-N 122.462 -0.434 . . . . 74.230000000000004 111.727 178.039 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 49' ' ' LYS . . . . . 0.436 ' O ' HG13 ' A' ' 53' ' ' ILE . 24.0 tptm -44.21 -59.64 2.27 Favored 'General case' 0 N--CA 1.473 0.713 0 C-N-CA 122.994 0.518 . . . . 70.420000000000002 112.227 -179.583 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 50' ' ' THR . . . . . 0.515 ' HA ' HD12 ' A' ' 53' ' ' ILE . 86.6 m -65.73 -38.19 88.46 Favored 'General case' 0 CA--C 1.541 0.598 0 N-CA-C 112.328 0.492 . . . . 71.329999999999998 112.328 -177.42 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 42.5 mt-10 -58.0 -50.83 72.07 Favored 'General case' 0 N--CA 1.473 0.699 0 CA-C-O 120.82 0.343 . . . . 74.430000000000007 111.533 177.613 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 52' ' ' LEU . . . . . 0.565 ' HG ' ' O ' ' A' ' 48' ' ' THR . 26.1 mt -59.1 -38.08 78.7 Favored 'General case' 0 CA--C 1.538 0.504 0 CA-C-N 116.435 -0.348 . . . . 75.310000000000002 111.441 -177.73 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 53' ' ' ILE . . . . . 0.515 HD12 ' HA ' ' A' ' 50' ' ' THR . 71.8 mt -57.69 -58.08 7.7 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.515 0 CA-C-O 121.093 0.473 . . . . 73.430000000000007 111.11 175.899 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 54' ' ' GLU . . . . . 0.424 ' HG2' HH11 ' A' ' 57' ' ' ARG . 44.4 mt-10 -65.7 -24.53 67.01 Favored 'General case' 0 N--CA 1.469 0.504 0 CA-C-N 116.207 -0.451 . . . . 71.409999999999997 111.864 179.697 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 55' ' ' ARG . . . . . 0.499 ' HD3' ' HD2' ' A' ' 44' ' ' PRO . 38.6 ttm180 -71.77 -44.46 63.98 Favored 'General case' 0 CA--C 1.54 0.57 0 CA-C-O 120.92 0.39 . . . . 70.519999999999996 110.912 177.329 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 56' ' ' LEU . . . . . 0.665 HD23 HH21 ' A' ' 41' ' ' ARG . 85.9 mt -58.96 -46.33 88.32 Favored 'General case' 0 N--CA 1.47 0.557 0 CA-C-O 121.236 0.541 . . . . 74.450000000000003 110.396 171.367 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 57' ' ' ARG . . . . . 0.424 HH11 ' HG2' ' A' ' 54' ' ' GLU . 48.6 mtp180 -59.47 -41.56 90.02 Favored 'General case' 0 CA--C 1.535 0.376 0 CA-C-N 115.499 -0.773 . . . . 72.310000000000002 111.419 177.58 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -59.55 -43.82 93.42 Favored 'General case' 0 CA--C 1.537 0.461 0 CA-C-N 116.472 -0.331 . . . . 54.210000000000001 111.663 179.218 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 59' ' ' TYR . . . . . . . . . . . . . 57.4 t80 -65.42 -48.28 73.33 Favored 'General case' 0 CA--C 1.54 0.56 0 CA-C-O 120.994 0.426 . . . . 64.129999999999995 110.918 178.368 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 60' ' ' GLN . . . . . . . . . . . . . 54.8 tp60 -59.89 -39.44 85.37 Favored 'General case' 0 CA--C 1.539 0.545 0 CA-C-O 121.347 0.594 . . . . 63.119999999999997 110.845 178.395 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 61' ' ' ASP . . . . . . . . . . . . . 24.2 t70 -56.21 -27.63 55.46 Favored 'General case' 0 CA--C 1.542 0.636 0 CA-C-N 115.459 -0.791 . . . . 72.209999999999994 111.821 178.048 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 62' ' ' GLN . . . . . . . . . . . . . 74.0 mt-30 -90.39 -36.4 14.63 Favored 'General case' 0 CA--C 1.542 0.639 0 N-CA-C 112.41 0.522 . . . . 75.319999999999993 112.41 -177.775 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 63' ' ' ILE . . . . . . . . . . . . . 43.8 pt -92.55 -20.85 6.4 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.72 0 N-CA-C 112.749 0.648 . . . . 72.430000000000007 112.749 -176.078 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 37.6 t -69.03 141.63 92.2 Favored Pre-proline 0 N--CA 1.474 0.755 0 N-CA-C 112.4 0.519 . . . . 61.409999999999997 112.4 -176.668 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 65' ' ' PRO . . . . . . . . . . . . . 19.2 Cg_exo -68.64 -169.38 0.27 Allowed 'Trans proline' 0 CA--C 1.544 0.985 0 C-N-CA 122.741 2.294 . . . . 63.439999999999998 112.039 171.387 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 66' ' ' VAL . . . . . . . . . . . . . 29.7 m -67.55 128.09 93.51 Favored Pre-proline 0 CA--C 1.544 0.733 0 O-C-N 122.132 -0.355 . . . . 72.239999999999995 111.724 177.906 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 67' ' ' PRO . . . . . . . . . . . . . 72.6 Cg_endo -77.56 -44.79 0.17 Allowed 'Trans proline' 0 CA--C 1.543 0.945 0 C-N-CA 122.444 2.096 . . . . 73.219999999999999 113.279 -178.731 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . -80.08 -41.72 11.78 Favored Glycine 0 CA--C 1.524 0.599 0 C-N-CA 121.164 -0.541 . . . . 63.409999999999997 112.624 179.767 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . 69.06 130.49 0.03 OUTLIER Pre-proline 0 CA--C 1.542 0.665 0 C-N-CA 123.255 0.622 . . . . 73.200000000000003 112.196 178.583 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 70' ' ' PRO . . . . . . . . . . . . . 46.9 Cg_exo -56.85 105.36 0.17 Allowed 'Trans proline' 0 CA--C 1.541 0.838 0 C-N-CA 122.585 2.19 . . . . 75.019999999999996 112.606 177.486 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 97.3 mttt -74.35 101.19 3.99 Favored 'General case' 0 CA--C 1.537 0.445 0 CA-C-O 120.782 0.325 . . . . 74.439999999999998 111.818 -177.193 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . 68.26 129.87 0.03 OUTLIER Pre-proline 0 CA--C 1.544 0.739 0 N-CA-C 112.667 0.617 . . . . 72.040000000000006 112.667 177.214 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 73' ' ' PRO . . . . . . . . . . . . . 32.4 Cg_exo -59.57 114.09 1.9 Allowed 'Trans proline' 0 C--N 1.352 0.748 0 C-N-CA 122.533 2.156 . . . . 72.129999999999995 112.484 176.668 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -63.5 132.21 50.6 Favored 'General case' 0 CA--C 1.538 0.495 0 N-CA-C 112.151 0.426 . . . . 71.519999999999996 112.151 -179.119 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.253 1.257 0 CA-C-O 118.808 -0.615 . . . . 75.319999999999993 111.635 178.51 . . . . . . . . 0 0 . 1 . 020 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 64.2 mtt . . . . . 0 N--CA 1.489 1.503 0 CA-C-O 120.897 0.379 . . . . 63.43 111.264 . . . . . . . . . 0 0 . 1 . 020 nuclear orig full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . 76.49 167.77 26.28 Favored Glycine 0 CA--C 1.528 0.867 0 CA-C-N 116.121 -0.49 . . . . 36.539999999999999 113.996 178.061 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 3' ' ' HIS . . . . . . . . . . . . . 94.2 m-70 -137.07 98.29 3.71 Favored 'General case' 0 N--CA 1.468 0.458 0 C-N-CA 122.776 0.43 . . . . 64.329999999999998 110.163 175.629 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 4' ' ' HIS . . . . . . . . . . . . . 34.5 m80 -69.02 123.84 22.12 Favored 'General case' 0 CA--C 1.542 0.661 0 CA-C-O 120.789 0.328 . . . . 63.43 111.279 -177.815 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 5' ' ' HIS . . . . . . . . . . . . . 40.2 m80 -108.35 111.62 23.65 Favored 'General case' 0 CA--C 1.538 0.481 0 N-CA-C 112.265 0.468 . . . . 64.439999999999998 112.265 -176.57 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 83.8 t60 -178.47 107.59 0.05 OUTLIER 'General case' 0 N--CA 1.471 0.59 0 CA-C-N 115.898 -0.592 . . . . 73.310000000000002 110.668 176.708 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 30.6 m170 -127.66 167.44 16.42 Favored 'General case' 0 N--CA 1.47 0.56 0 CA-C-O 121.06 0.457 . . . . 73.030000000000001 111.76 177.775 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 8' ' ' HIS . . . . . . . . . . . . . 17.8 p80 -157.19 114.34 3.06 Favored 'General case' 0 CA--C 1.538 0.514 0 CA-C-N 115.705 -0.68 . . . . 62.399999999999999 110.46 179.467 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 82.0 p -133.81 87.29 2.36 Favored 'General case' 0 N--CA 1.471 0.623 0 N-CA-C 112.507 0.558 . . . . 73.140000000000001 112.507 -177.902 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 32.5 p-80 -164.0 150.42 11.43 Favored 'General case' 0 N--CA 1.47 0.553 0 CA-C-N 116.479 -0.328 . . . . 65.439999999999998 110.985 173.131 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 11' ' ' MET . . . . . . . . . . . . . 26.3 ptt? -123.96 152.07 42.91 Favored 'General case' 0 N--CA 1.469 0.499 0 CA-C-O 120.931 0.396 . . . . 74.230000000000004 111.226 179.645 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 53.9 m -138.4 109.14 6.64 Favored 'General case' 0 N--CA 1.473 0.678 0 CA-C-O 120.802 0.334 . . . . 75.239999999999995 111.419 179.013 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 13' ' ' THR . . . . . 0.405 ' HA ' ' HD3' ' A' ' 14' ' ' PRO . 71.8 p -102.73 135.06 19.54 Favored Pre-proline 0 N--CA 1.473 0.686 0 N-CA-C 112.054 0.39 . . . . 74.409999999999997 112.054 -177.986 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 14' ' ' PRO . . . . . 0.405 ' HD3' ' HA ' ' A' ' 13' ' ' THR . 10.9 Cg_exo -72.77 139.19 30.22 Favored 'Trans proline' 0 CA--C 1.539 0.743 0 C-N-CA 122.729 2.286 . . . . 74.030000000000001 111.776 172.204 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 15' ' ' LEU . . . . . 0.452 ' N ' HD21 ' A' ' 15' ' ' LEU . 2.9 mm? -92.54 -47.13 7.29 Favored 'General case' 0 CA--C 1.539 0.555 0 CA-C-O 120.834 0.349 . . . . 74.329999999999998 111.805 -177.187 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 16' ' ' THR . . . . . . . . . . . . . 89.5 m -115.39 141.74 47.64 Favored 'General case' 0 N--CA 1.473 0.68 0 N-CA-C 112.304 0.483 . . . . 72.120000000000005 112.304 -175.704 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . 145.48 99.32 0.26 Allowed Glycine 0 CA--C 1.532 1.105 0 CA-C-N 116.11 -0.495 . . . . 65.239999999999995 113.047 177.784 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 22.7 pttp -148.12 125.23 5.6 Favored Pre-proline 0 CA--C 1.546 0.808 0 CA-C-N 117.185 0.493 . . . . 74.530000000000001 111.984 -179.114 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 74.5 Cg_endo -83.93 -165.7 0.32 Allowed 'Trans proline' 0 CA--C 1.542 0.915 0 C-N-CA 122.946 2.43 . . . . 75.209999999999994 113.113 178.977 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . 76.54 21.12 75.72 Favored Glycine 0 CA--C 1.527 0.781 0 C-N-CA 121.346 -0.454 . . . . 74.340000000000003 113.15 -179.344 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -164.29 -175.55 4.0 Favored 'General case' 0 CA--C 1.541 0.615 0 CA-C-O 121.396 0.617 . . . . 36.539999999999999 112.035 -177.031 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 22' ' ' LEU . . . . . 0.526 ' HG ' ' HG3' ' A' ' 60' ' ' GLN . 82.4 mt -82.52 159.34 64.36 Favored Pre-proline 0 CA--C 1.537 0.464 0 CA-C-N 115.936 -0.575 . . . . 63.329999999999998 111.713 179.978 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 23' ' ' PRO . . . . . 0.527 ' HD2' HD21 ' A' ' 26' ' ' LEU . 52.0 Cg_exo -57.77 150.52 61.92 Favored 'Trans proline' 0 CA--C 1.543 0.968 0 C-N-CA 122.403 2.069 . . . . 73.420000000000002 112.84 171.645 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -83.4 -9.45 59.02 Favored 'General case' 0 CA--C 1.539 0.54 0 N-CA-C 112.203 0.445 . . . . 72.129999999999995 112.203 -178.285 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 25' ' ' ASN . . . . . 0.51 ' HB3' ' HB3' ' A' ' 28' ' ' ASP . 15.4 m120 -112.67 24.98 11.89 Favored 'General case' 0 CA--C 1.541 0.632 0 N-CA-C 112.477 0.547 . . . . 71.439999999999998 112.477 -176.096 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 26' ' ' LEU . . . . . 0.527 HD21 ' HD2' ' A' ' 23' ' ' PRO . 95.1 mt -45.67 -47.29 15.05 Favored 'General case' 0 N--CA 1.48 1.033 0 N-CA-C 112.242 0.46 . . . . 63.5 112.242 -178.67 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 19.7 t70 -71.58 -30.9 66.36 Favored 'General case' 0 CA--C 1.539 0.526 0 CA-C-O 121.0 0.429 . . . . 75.420000000000002 111.533 -179.648 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 28' ' ' ASP . . . . . 0.51 ' HB3' ' HB3' ' A' ' 25' ' ' ASN . 20.9 t70 -78.23 -23.69 47.31 Favored 'General case' 0 CA--C 1.542 0.655 0 CA-C-O 121.193 0.52 . . . . 75.420000000000002 110.927 -179.89 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 29' ' ' MET . . . . . . . . . . . . . 71.5 mtp -73.23 -179.52 3.39 Favored 'General case' 0 CA--C 1.539 0.526 0 CA-C-N 115.823 -0.626 . . . . 72.519999999999996 111.966 -179.805 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 49.8 mtmt -95.76 153.81 17.55 Favored 'General case' 0 CA--C 1.54 0.562 0 CA-C-N 116.242 -0.435 . . . . 73.120000000000005 111.723 -176.654 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 31' ' ' VAL . . . . . 0.405 ' O ' ' HG3' ' A' ' 35' ' ' LYS . 57.7 t -51.55 -47.85 36.43 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.751 0 CA-C-N 116.196 -0.457 . . . . 74.510000000000005 111.924 -179.463 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -54.65 -45.37 73.79 Favored 'General case' 0 N--CA 1.473 0.679 0 CA-C-O 120.807 0.337 . . . . 43.450000000000003 111.752 178.687 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 13.8 mm-40 -53.58 -50.66 65.1 Favored 'General case' 0 N--CA 1.47 0.528 0 CA-C-O 121.193 0.52 . . . . 64.409999999999997 111.294 178.417 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 62.1 mt -62.63 -46.58 87.58 Favored 'General case' 0 CA--C 1.536 0.413 0 CA-C-N 115.497 -0.774 . . . . 71.239999999999995 111.422 -179.896 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 35' ' ' LYS . . . . . 0.405 ' HG3' ' O ' ' A' ' 31' ' ' VAL . 59.2 mtpt -56.22 -38.77 71.49 Favored 'General case' 0 CA--C 1.535 0.384 0 CA-C-N 116.284 -0.416 . . . . 74.0 111.549 179.834 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 16.8 mm100 -64.55 -51.34 63.37 Favored 'General case' 0 CA--C 1.537 0.468 0 CA-C-N 116.546 -0.297 . . . . 62.240000000000002 111.581 178.197 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 45.4 mt-10 -62.64 -20.75 65.11 Favored 'General case' 0 N--CA 1.473 0.71 0 CA-C-O 120.915 0.388 . . . . 75.549999999999997 111.86 179.893 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 38' ' ' LEU . . . . . 0.431 HD13 ' HA ' ' A' ' 52' ' ' LEU . 77.0 mt -76.18 -62.27 1.67 Allowed 'General case' 0 N--CA 1.47 0.527 0 CA-C-O 120.827 0.346 . . . . 72.150000000000006 111.211 170.734 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 14.1 ptmm? -62.41 -33.33 74.56 Favored 'General case' 0 CA--C 1.542 0.641 0 N-CA-C 112.31 0.485 . . . . 75.239999999999995 112.31 -173.861 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 95.2 mt -62.54 -27.28 69.05 Favored 'General case' 0 N--CA 1.473 0.707 0 CA-C-O 120.924 0.392 . . . . 65.239999999999995 111.164 174.765 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 41' ' ' ARG . . . . . 0.665 HH21 HD22 ' A' ' 56' ' ' LEU . 55.8 mtm180 -104.7 19.04 21.16 Favored 'General case' 0 CA--C 1.543 0.698 0 CA-C-N 116.418 -0.355 . . . . 75.5 111.132 179.386 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 25.7 m 68.72 13.26 8.87 Favored 'General case' 0 N--CA 1.479 1.008 0 C-N-CA 123.309 0.643 . . . . 42.439999999999998 112.715 177.154 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 80.6 mt -83.67 136.86 41.72 Favored Pre-proline 0 CA--C 1.54 0.572 0 O-C-N 122.316 -0.24 . . . . 72.409999999999997 111.085 178.33 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 44' ' ' PRO . . . . . . . . . . . . . 72.6 Cg_endo -74.94 126.83 10.26 Favored 'Trans proline' 0 CA--C 1.54 0.811 0 C-N-CA 122.55 2.167 . . . . 73.120000000000005 113.545 -178.621 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 26.1 m -85.48 20.93 0.3 Allowed 'Isoleucine or valine' 0 CA--C 1.544 0.736 0 CA-C-N 116.069 -0.514 . . . . 73.329999999999998 112.114 179.751 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 15.1 m -78.48 62.77 3.17 Favored 'General case' 0 N--CA 1.47 0.573 0 CA-C-O 120.821 0.343 . . . . 64.030000000000001 111.724 -176.308 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . -169.75 -177.34 40.13 Favored Glycine 0 CA--C 1.528 0.855 0 C-N-CA 120.598 -0.811 . . . . 72.209999999999994 113.961 -179.819 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 48' ' ' THR . . . . . 0.525 ' O ' ' HG ' ' A' ' 52' ' ' LEU . 47.6 p -82.25 171.65 14.02 Favored 'General case' 0 N--CA 1.473 0.677 0 C-N-CA 122.491 0.317 . . . . 70.209999999999994 111.38 179.705 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 79.8 tttt -48.0 -46.74 33.18 Favored 'General case' 0 N--CA 1.476 0.826 0 CA-C-O 120.999 0.428 . . . . 70.109999999999999 111.513 177.995 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 50' ' ' THR . . . . . 0.404 ' O ' ' HG3' ' A' ' 54' ' ' GLU . 13.6 m -58.77 -46.69 86.92 Favored 'General case' 0 CA--C 1.535 0.394 0 CA-C-N 116.053 -0.522 . . . . 64.200000000000003 111.229 179.726 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 74.8 mm-40 -59.09 -41.69 88.66 Favored 'General case' 0 N--CA 1.47 0.559 0 CA-C-O 120.915 0.388 . . . . 73.219999999999999 111.401 179.559 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 52' ' ' LEU . . . . . 0.525 ' HG ' ' O ' ' A' ' 48' ' ' THR . 30.1 mt -57.71 -50.39 73.37 Favored 'General case' 0 CA--C 1.538 0.486 0 CA-C-O 121.334 0.588 . . . . 74.420000000000002 110.767 179.371 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 53' ' ' ILE . . . . . . . . . . . . . 67.9 mt -60.46 -53.72 44.94 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.44 0 CA-C-N 115.607 -0.724 . . . . 71.230000000000004 111.541 178.7 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 54' ' ' GLU . . . . . 0.404 ' HG3' ' O ' ' A' ' 50' ' ' THR . 85.6 mt-10 -60.69 -37.91 83.22 Favored 'General case' 0 CA--C 1.537 0.468 0 CA-C-N 115.795 -0.639 . . . . 74.420000000000002 112.123 -177.084 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 55' ' ' ARG . . . . . 0.418 HH11 ' HD2' ' A' ' 55' ' ' ARG . 14.9 ttt180 -73.78 -37.77 64.87 Favored 'General case' 0 CA--C 1.539 0.528 0 O-C-N 122.14 -0.35 . . . . 73.409999999999997 111.21 179.863 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 56' ' ' LEU . . . . . 0.665 HD22 HH21 ' A' ' 41' ' ' ARG . 51.1 mt -53.03 -47.64 68.2 Favored 'General case' 0 N--CA 1.47 0.539 0 CA-C-O 121.028 0.442 . . . . 71.230000000000004 109.951 170.355 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 16.3 mtp180 -64.5 -57.02 10.37 Favored 'General case' 0 CA--C 1.539 0.548 0 CA-C-N 115.452 -0.794 . . . . 72.510000000000005 112.03 179.386 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -52.5 -44.85 65.93 Favored 'General case' 0 N--CA 1.472 0.666 0 CA-C-O 121.02 0.438 . . . . 41.340000000000003 112.074 -178.713 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 59' ' ' TYR . . . . . . . . . . . . . 79.4 t80 -67.28 -41.16 85.93 Favored 'General case' 0 CA--C 1.541 0.606 0 CA-C-N 116.397 -0.365 . . . . 73.420000000000002 111.793 178.952 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 60' ' ' GLN . . . . . 0.526 ' HG3' ' HG ' ' A' ' 22' ' ' LEU . 19.3 tm0? -70.56 -33.97 71.71 Favored 'General case' 0 CA--C 1.54 0.573 0 CA-C-O 121.207 0.527 . . . . 75.010000000000005 110.692 179.958 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 61' ' ' ASP . . . . . . . . . . . . . 24.8 t70 -66.92 -48.21 69.36 Favored 'General case' 0 CA--C 1.541 0.615 0 CA-C-N 115.993 -0.549 . . . . 74.349999999999994 111.801 179.304 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 62' ' ' GLN . . . . . . . . . . . . . 10.9 pt20 -62.5 -37.67 86.9 Favored 'General case' 0 N--CA 1.474 0.761 0 N-CA-C 111.829 0.307 . . . . 74.010000000000005 111.829 -179.025 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 63' ' ' ILE . . . . . . . . . . . . . 30.4 pt -78.52 -22.03 13.17 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.475 0 CA-C-O 120.8 0.333 . . . . 74.25 110.592 174.518 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 64' ' ' SER . . . . . 0.438 ' HA ' ' HD3' ' A' ' 65' ' ' PRO . 14.9 t 75.1 137.51 0.05 OUTLIER Pre-proline 0 N--CA 1.479 0.986 0 N-CA-C 113.049 0.759 . . . . 73.5 113.049 173.148 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 65' ' ' PRO . . . . . 0.438 ' HD3' ' HA ' ' A' ' 64' ' ' SER . 13.5 Cg_exo -70.59 -168.18 0.3 Allowed 'Trans proline' 0 C--N 1.355 0.873 0 C-N-CA 122.897 2.398 . . . . 74.519999999999996 112.936 176.234 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 66' ' ' VAL . . . . . 0.413 ' HA ' ' HD3' ' A' ' 67' ' ' PRO . 23.5 m -63.76 116.27 25.27 Favored Pre-proline 0 CA--C 1.548 0.873 0 CA-C-O 120.907 0.384 . . . . 72.150000000000006 111.975 178.515 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 67' ' ' PRO . . . . . 0.413 ' HD3' ' HA ' ' A' ' 66' ' ' VAL . 27.5 Cg_exo -63.89 -31.82 66.91 Favored 'Trans proline' 0 C--N 1.352 0.711 0 C-N-CA 122.863 2.375 . . . . 74.010000000000005 112.681 -179.724 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . -55.88 -56.98 21.16 Favored Glycine 0 CA--C 1.525 0.68 0 C-N-CA 121.051 -0.595 . . . . 74.329999999999998 112.012 174.788 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . 64.42 152.29 0.12 Allowed Pre-proline 0 CA--C 1.545 0.757 0 N-CA-C 113.323 0.86 . . . . 71.219999999999999 113.323 174.032 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 70' ' ' PRO . . . . . . . . . . . . . 2.7 Cg_exo -77.67 120.67 5.24 Favored 'Trans proline' 0 CA--C 1.54 0.821 0 C-N-CA 122.845 2.363 . . . . 71.530000000000001 112.025 173.327 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 87.2 tttt -72.77 140.04 47.49 Favored 'General case' 0 CA--C 1.538 0.51 0 CA-C-O 120.958 0.408 . . . . 70.319999999999993 111.256 -179.433 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -66.82 133.59 94.03 Favored Pre-proline 0 CA--C 1.542 0.636 0 CA-C-N 116.361 -0.381 . . . . 72.409999999999997 111.579 179.232 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 73' ' ' PRO . . . . . . . . . . . . . 35.6 Cg_exo -62.24 -165.19 0.04 OUTLIER 'Trans proline' 0 CA--C 1.543 0.93 0 C-N-CA 123.006 2.471 . . . . 73.349999999999994 113.175 178.624 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -72.95 66.19 0.78 Allowed 'General case' 0 CA--C 1.542 0.658 0 N-CA-C 111.924 0.342 . . . . 72.129999999999995 111.924 178.348 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.252 1.193 0 CA-C-O 118.527 -0.749 . . . . 70.099999999999994 112.608 -178.225 . . . . . . . . 0 0 . 1 . 001 nuclear build core ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 83.4 mt . . . . . 0 CA--C 1.543 0.692 0 CA-C-O 120.632 0.253 . . . . 74.12 111.559 . . . . . . . . . 0 0 . 1 . 001 nuclear build core ' A' A ' 23' ' ' PRO . . . . . 0.49 ' O ' ' HG ' ' A' ' 26' ' ' LEU . 38.7 Cg_exo -61.26 125.3 16.62 Favored 'Trans proline' 0 CA--C 1.541 0.84 0 C-N-CA 122.353 2.035 . . . . 74.52 112.459 177.364 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -77.73 -2.52 36.61 Favored 'General case' 0 N--CA 1.472 0.629 0 N-CA-C 112.087 0.403 . . . . 72.51 112.087 -178.122 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 23.0 m120 -101.93 31.37 3.92 Favored 'General case' 0 CA--C 1.54 0.562 0 N-CA-C 112.108 0.411 . . . . 73.15 112.108 179.94 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 26' ' ' LEU . . . . . 0.49 ' HG ' ' O ' ' A' ' 23' ' ' PRO . 92.5 mt -56.94 -44.29 82.37 Favored 'General case' 0 N--CA 1.471 0.578 0 CA-C-O 120.98 0.419 . . . . 71.53 111.122 177.307 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 5.4 m-20 -63.14 -31.8 73.03 Favored 'General case' 0 CA--C 1.54 0.579 0 CA-C-N 116.078 -0.51 . . . . 65.21 111.728 178.046 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 22.3 m-20 -75.59 -23.15 56.46 Favored 'General case' 0 CA--C 1.536 0.431 0 CA-C-N 116.244 -0.435 . . . . 65.01 112.13 -177.966 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 29' ' ' MET . . . . . . . . . . . . . 65.8 mtm -85.86 179.36 7.04 Favored 'General case' 0 CA--C 1.538 0.482 0 CA-C-O 121.498 0.666 . . . . 62.34 112.325 -177.278 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 30' ' ' LYS . . . . . 0.567 ' HB2' ' HG2' ' A' ' 33' ' ' GLU . 45.7 mtpt -85.69 158.71 19.99 Favored 'General case' 0 CA--C 1.538 0.493 0 CA-C-N 115.647 -0.706 . . . . 54.11 111.246 -179.255 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 60.9 t -57.04 -40.98 76.52 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.506 0 CA-C-O 121.055 0.455 . . . . 63.41 110.76 177.669 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -56.94 -43.98 82.05 Favored 'General case' 0 CA--C 1.538 0.494 0 CA-C-N 115.871 -0.604 . . . . 71.05 111.875 177.759 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 33' ' ' GLU . . . . . 0.567 ' HG2' ' HB2' ' A' ' 30' ' ' LYS . 5.4 mm-40 -60.13 -41.58 92.97 Favored 'General case' 0 N--CA 1.47 0.562 0 CA-C-O 121.112 0.482 . . . . 75.33 110.649 179.928 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 70.6 mt -62.95 -45.63 91.56 Favored 'General case' 0 N--CA 1.468 0.446 0 CA-C-N 115.952 -0.567 . . . . 64.43 110.685 176.88 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 28.1 mtpp -60.52 -34.12 73.64 Favored 'General case' 0 CA--C 1.542 0.635 0 CA-C-N 115.974 -0.557 . . . . 73.54 110.979 176.449 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 8.2 tp-100 -64.76 -50.31 67.34 Favored 'General case' 0 CA--C 1.541 0.6 0 CA-C-O 121.024 0.44 . . . . 73.11 111.057 175.711 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 37' ' ' GLU . . . . . 0.402 ' O ' ' HG3' ' A' ' 41' ' ' ARG . 23.2 mm-40 -58.64 -40.0 82.15 Favored 'General case' 0 CA--C 1.539 0.546 0 CA-C-N 116.293 -0.412 . . . . 75.51 111.832 177.199 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 38' ' ' LEU . . . . . 0.5 ' HB2' HG12 ' A' ' 45' ' ' VAL . 92.3 mt -64.36 -56.04 17.07 Favored 'General case' 0 CA--C 1.538 0.49 0 N-CA-C 112.089 0.403 . . . . 74.01 112.089 178.422 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 19.8 ptpt -55.51 -40.88 72.35 Favored 'General case' 0 N--CA 1.473 0.703 0 N-CA-C 112.02 0.378 . . . . 72.03 112.02 -175.367 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 93.4 mt -66.13 -22.72 66.39 Favored 'General case' 0 N--CA 1.471 0.596 0 CA-C-O 120.883 0.373 . . . . 63.31 111.85 -179.255 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 41' ' ' ARG . . . . . 0.402 ' HG3' ' O ' ' A' ' 37' ' ' GLU . 75.7 mtt-85 -104.22 18.24 22.49 Favored 'General case' 0 CA--C 1.541 0.61 0 CA-C-O 120.73 0.3 . . . . 75.12 111.441 -179.676 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 33.1 t 67.0 16.57 10.38 Favored 'General case' 0 N--CA 1.478 0.932 0 C-N-CA 122.949 0.5 . . . . 63.24 112.315 178.458 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 65.6 mt -90.52 143.38 29.12 Favored Pre-proline 0 CA--C 1.542 0.641 0 N-CA-C 111.947 0.351 . . . . 64.13 111.947 -178.851 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 44' ' ' PRO . . . . . . . . . . . . . 42.9 Cg_endo -67.89 132.41 26.47 Favored 'Trans proline' 0 CA--C 1.542 0.891 0 C-N-CA 122.622 2.215 . . . . 63.54 113.008 176.812 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 45' ' ' VAL . . . . . 0.5 HG12 ' HB2' ' A' ' 38' ' ' LEU . 33.6 m -96.49 36.47 0.13 Allowed 'Isoleucine or valine' 0 N--CA 1.471 0.622 0 CA-C-N 116.122 -0.49 . . . . 61.32 111.806 -177.375 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 17.4 m -80.65 -61.67 1.9 Allowed 'General case' 0 CA--C 1.542 0.657 0 N-CA-C 114.064 1.135 . . . . 61.54 114.064 -168.777 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . -66.91 -170.82 4.4 Favored Glycine 0 CA--C 1.53 0.976 0 N-CA-C 115.996 1.159 . . . . 64.33 115.996 -166.944 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 48' ' ' THR . . . . . 0.586 ' O ' ' HG ' ' A' ' 52' ' ' LEU . 62.4 p -74.38 175.5 7.62 Favored 'General case' 0 N--CA 1.471 0.584 0 CA-C-N 115.295 -0.453 . . . . 51.12 111.749 -178.337 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 49' ' ' LYS . . . . . 0.423 ' O ' HG13 ' A' ' 53' ' ' ILE . 87.8 tttt -49.96 -53.79 24.11 Favored 'General case' 0 CA--C 1.543 0.677 0 N-CA-C 111.847 0.314 . . . . 53.51 111.847 -178.868 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 50' ' ' THR . . . . . . . . . . . . . 47.8 m -59.24 -43.28 92.39 Favored 'General case' 0 N--CA 1.473 0.705 0 CA-C-O 120.799 0.333 . . . . 71.25 111.595 179.351 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 51' ' ' GLU . . . . . 0.422 ' CD ' HH21 ' A' ' 55' ' ' ARG . 0.7 OUTLIER -53.61 -54.5 36.72 Favored 'General case' 0 CA--C 1.539 0.542 0 CA-C-O 120.941 0.401 . . . . 73.43 110.512 176.632 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 52' ' ' LEU . . . . . 0.586 ' HG ' ' O ' ' A' ' 48' ' ' THR . 25.7 mt -57.2 -47.62 80.81 Favored 'General case' 0 CA--C 1.54 0.586 0 CA-C-N 116.024 -0.534 . . . . 55.34 111.199 -179.718 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 53' ' ' ILE . . . . . 0.423 HG13 ' O ' ' A' ' 49' ' ' LYS . 91.2 mt -54.52 -52.73 37.57 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.616 0 CA-C-O 121.304 0.573 . . . . 52.5 111.678 177.951 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 54' ' ' GLU . . . . . 0.415 ' HA ' ' HE ' ' A' ' 57' ' ' ARG . 35.0 mt-10 -70.95 -24.86 62.51 Favored 'General case' 0 CA--C 1.536 0.432 0 N-CA-C 112.164 0.431 . . . . 74.34 112.164 -178.253 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 55' ' ' ARG . . . . . 0.422 HH21 ' CD ' ' A' ' 51' ' ' GLU . 46.6 ttm-85 -68.52 -36.45 78.88 Favored 'General case' 0 CA--C 1.538 0.502 0 CA-C-O 121.095 0.474 . . . . 73.41 110.257 175.639 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 89.9 mt -61.4 -44.73 96.65 Favored 'General case' 0 N--CA 1.469 0.495 0 CA-C-N 116.176 -0.466 . . . . 64.11 110.81 172.556 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 57' ' ' ARG . . . . . 0.415 ' HE ' ' HA ' ' A' ' 54' ' ' GLU . 40.3 mtm180 -62.89 -42.42 99.77 Favored 'General case' 0 N--CA 1.471 0.582 0 CA-C-O 121.027 0.442 . . . . 72.44 111.061 176.751 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -61.65 -39.45 91.39 Favored 'General case' 0 N--CA 1.469 0.495 0 CA-C-O 121.113 0.483 . . . . 51.13 111.482 178.027 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 59' ' ' TYR . . . . . . . . . . . . . 63.2 t80 -62.78 -47.17 84.63 Favored 'General case' 0 CA--C 1.537 0.462 0 CA-C-O 121.094 0.474 . . . . 75.51 110.806 176.021 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 60' ' ' GLN . . . . . . . . . . . . . 58.7 tp60 -58.44 -44.62 89.26 Favored 'General case' 0 N--CA 1.468 0.468 0 CA-C-N 116.027 -0.533 . . . . 74.24 110.941 176.163 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 61' ' ' ASP . . . . . . . . . . . . . 31.9 t70 -59.03 -23.0 61.59 Favored 'General case' 0 CA--C 1.545 0.774 0 CA-C-O 121.208 0.527 . . . . 71.14 111.699 -178.401 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 62' ' ' GLN . . . . . . . . . . . . . 49.2 mt-30 . . . . . 0 CA--C 1.54 0.592 0 CA-C-N 116.299 -0.409 . . . . 75.13 111.683 178.675 . . . . . . . . 0 0 . 1 . 002 nuclear build core ' A' A ' 22' ' ' LEU . . . . . 0.577 ' HG ' ' HG3' ' A' ' 60' ' ' GLN . 97.0 mt . . . . . 0 N--CA 1.473 0.72 0 N-CA-C 112.331 0.493 . . . . 72.2 112.331 . . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 23' ' ' PRO . . . . . . . . . . . . . 5.3 Cg_endo -85.97 149.14 9.51 Favored 'Trans proline' 0 CA--C 1.542 0.88 0 C-N-CA 123.133 2.555 . . . . 74.21 111.764 171.987 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -74.96 -10.33 59.38 Favored 'General case' 0 N--CA 1.471 0.59 0 N-CA-C 112.108 0.41 . . . . 54.21 112.108 -179.081 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 14.1 m120 -84.97 28.75 0.68 Allowed 'General case' 0 CA--C 1.546 0.81 0 N-CA-C 112.586 0.587 . . . . 64.32 112.586 -177.554 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 85.5 mt -57.75 -62.23 1.95 Allowed 'General case' 0 N--CA 1.473 0.711 0 N-CA-C 112.606 0.595 . . . . 74.24 112.606 -177.059 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 27' ' ' ASP . . . . . 0.518 ' HA ' ' HE2' ' A' ' 49' ' ' LYS . 29.9 t70 -71.61 -20.23 62.01 Favored 'General case' 0 N--CA 1.471 0.589 0 CA-C-O 121.012 0.434 . . . . 70.24 111.13 -179.127 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 5.6 m-20 -67.77 -29.02 68.12 Favored 'General case' 0 CA--C 1.538 0.504 0 CA-C-N 116.49 -0.323 . . . . 73.24 110.941 175.087 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 29' ' ' MET . . . . . 0.485 ' O ' ' HE3' ' A' ' 49' ' ' LYS . 59.8 mtm -83.25 164.32 20.19 Favored 'General case' 0 CA--C 1.539 0.521 0 CA-C-O 120.739 0.304 . . . . 63.32 110.57 172.04 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 59.2 mtpt -86.45 166.25 15.67 Favored 'General case' 0 CA--C 1.54 0.587 0 CA-C-O 121.441 0.639 . . . . 65.14 112.676 -177.08 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 31' ' ' VAL . . . . . 0.506 HG13 HD11 ' A' ' 52' ' ' LEU . 61.4 t -53.34 -47.94 57.02 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.798 0 CA-C-N 115.694 -0.685 . . . . 62.32 112.096 -177.812 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -61.33 -27.28 68.38 Favored 'General case' 0 CA--C 1.539 0.526 0 N-CA-C 112.221 0.452 . . . . 60.1 112.221 -179.598 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 33' ' ' GLU . . . . . 0.43 ' O ' ' HB3' ' A' ' 36' ' ' GLN . 40.9 mt-10 -78.79 -39.58 35.41 Favored 'General case' 0 N--CA 1.47 0.574 0 CA-C-O 121.035 0.445 . . . . 72.04 111.334 -179.925 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 92.9 mt -66.74 -40.87 88.5 Favored 'General case' 0 CA--C 1.538 0.513 0 CA-C-O 120.703 0.287 . . . . 71.13 111.385 177.478 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 35' ' ' LYS . . . . . 0.518 ' HA ' HD12 ' A' ' 38' ' ' LEU . 96.3 mttt -61.23 -30.28 70.35 Favored 'General case' 0 CA--C 1.538 0.518 0 CA-C-O 120.872 0.368 . . . . 63.12 111.218 176.194 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 36' ' ' GLN . . . . . 0.43 ' HB3' ' O ' ' A' ' 33' ' ' GLU . 0.2 OUTLIER -61.82 -54.15 46.2 Favored 'General case' 0 CA--C 1.538 0.514 0 CA-C-O 121.125 0.488 . . . . 75.11 110.115 171.694 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 36.6 mm-40 -57.57 -26.22 61.14 Favored 'General case' 0 CA--C 1.54 0.594 0 CA-C-N 115.916 -0.583 . . . . 62.33 112.133 177.575 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 38' ' ' LEU . . . . . 0.518 HD12 ' HA ' ' A' ' 35' ' ' LYS . 93.7 mt -72.5 -56.91 4.64 Favored 'General case' 0 CA--C 1.535 0.381 0 CA-C-O 120.931 0.396 . . . . 52.43 111.571 175.182 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 39' ' ' LYS . . . . . 0.414 ' HE2' ' HB3' ' A' ' 39' ' ' LYS . 16.9 ptpt -61.86 -30.13 70.65 Favored 'General case' 0 CA--C 1.539 0.557 0 N-CA-C 112.197 0.443 . . . . 61.52 112.197 -175.734 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 75.8 mt -58.05 -25.6 61.41 Favored 'General case' 0 N--CA 1.473 0.676 0 CA-C-O 120.891 0.377 . . . . 73.23 111.754 174.867 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 41' ' ' ARG . . . . . . . . . . . . . 13.7 mtm180 -121.71 24.55 9.69 Favored 'General case' 0 CA--C 1.539 0.539 0 CA-C-O 120.778 0.323 . . . . 70.24 111.761 -178.567 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 23.2 t 62.46 33.51 16.08 Favored 'General case' 0 N--CA 1.475 0.807 0 N-CA-C 112.336 0.495 . . . . 73.32 112.336 174.935 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 43' ' ' LEU . . . . . 0.408 ' HB3' HD22 ' A' ' 38' ' ' LEU . 76.3 mt -97.01 147.56 33.09 Favored Pre-proline 0 CA--C 1.542 0.661 0 CA-C-O 120.72 0.295 . . . . 64.22 111.596 178.546 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 44' ' ' PRO . . . . . . . . . . . . . 35.6 Cg_endo -64.16 122.81 10.92 Favored 'Trans proline' 0 CA--C 1.541 0.844 0 C-N-CA 122.859 2.373 . . . . 71.4 113.445 -178.04 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 33.7 m -98.93 31.19 0.41 Allowed 'Isoleucine or valine' 0 CA--C 1.545 0.767 0 CA-C-N 116.184 -0.462 . . . . 74.33 112.027 -177.498 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 78.5 p -93.94 -41.08 9.79 Favored 'General case' 0 N--CA 1.473 0.716 0 N-CA-C 112.754 0.65 . . . . 75.43 112.754 -175.514 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . -66.69 -179.33 10.68 Favored Glycine 0 CA--C 1.534 1.254 0 N-CA-C 115.078 0.791 . . . . 73.41 115.078 -174.021 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 48' ' ' THR . . . . . 0.618 ' O ' ' HG ' ' A' ' 52' ' ' LEU . 50.8 p -85.39 179.56 7.14 Favored 'General case' 0 N--CA 1.475 0.791 0 C-N-CA 122.811 0.444 . . . . 72.2 112.164 -178.254 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 49' ' ' LYS . . . . . 0.518 ' HE2' ' HA ' ' A' ' 27' ' ' ASP . 24.1 tptm -41.82 -58.7 1.93 Allowed 'General case' 0 N--CA 1.476 0.831 0 C-N-CA 123.418 0.687 . . . . 73.42 112.561 179.506 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 50' ' ' THR . . . . . . . . . . . . . 24.1 m -60.96 -38.32 85.5 Favored 'General case' 0 CA--C 1.537 0.467 0 CA-C-O 120.866 0.365 . . . . 73.21 111.583 -178.315 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 51' ' ' GLU . . . . . 0.461 ' O ' ' HB2' ' A' ' 55' ' ' ARG . 57.4 mm-40 -60.95 -42.44 98.23 Favored 'General case' 0 N--CA 1.469 0.524 0 CA-C-N 116.445 -0.343 . . . . 71.03 111.08 178.542 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 52' ' ' LEU . . . . . 0.618 ' HG ' ' O ' ' A' ' 48' ' ' THR . 14.3 mt -61.68 -45.48 93.8 Favored 'General case' 0 N--CA 1.467 0.406 0 CA-C-O 121.085 0.469 . . . . 74.32 110.628 179.15 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 53' ' ' ILE . . . . . . . . . . . . . 68.3 mt -58.5 -53.85 41.06 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.49 0 CA-C-N 115.746 -0.661 . . . . 72.41 111.332 178.341 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 40.5 mt-10 -65.07 -32.64 74.45 Favored 'General case' 0 CA--C 1.536 0.419 0 CA-C-N 116.394 -0.367 . . . . 71.34 111.38 -179.76 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 55' ' ' ARG . . . . . 0.473 ' HB3' HD21 ' A' ' 38' ' ' LEU . 0.0 OUTLIER -60.1 -53.23 60.25 Favored 'General case' 0 CA--C 1.537 0.45 0 CA-C-O 121.19 0.519 . . . . 74.14 110.588 177.573 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 98.3 mt -57.29 -50.93 71.36 Favored 'General case' 0 CA--C 1.537 0.444 0 CA-C-N 115.834 -0.621 . . . . 73.12 111.363 176.269 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 19.9 mtp180 -63.81 -30.49 71.58 Favored 'General case' 0 CA--C 1.541 0.602 0 N-CA-C 112.187 0.44 . . . . 75.53 112.187 -178.487 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -71.46 -48.08 51.6 Favored 'General case' 0 N--CA 1.469 0.516 0 CA-C-O 121.216 0.531 . . . . 72.31 110.921 175.896 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 59' ' ' TYR . . . . . . . . . . . . . 74.1 t80 -61.21 -42.66 98.98 Favored 'General case' 0 CA--C 1.539 0.527 0 CA-C-O 121.074 0.464 . . . . 73.33 111.234 177.841 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 60' ' ' GLN . . . . . 0.577 ' HG3' ' HG ' ' A' ' 22' ' ' LEU . 21.7 tm0? -71.82 -36.83 70.34 Favored 'General case' 0 CA--C 1.538 0.516 0 CA-C-N 116.255 -0.43 . . . . 75.04 111.145 -178.528 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 61' ' ' ASP . . . . . . . . . . . . . 20.7 t70 -56.33 -40.77 74.98 Favored 'General case' 0 N--CA 1.47 0.556 0 CA-C-O 121.306 0.574 . . . . 71.24 111.064 178.984 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 62' ' ' GLN . . . . . . . . . . . . . 47.4 mt-30 . . . . . 0 CA--C 1.542 0.644 0 CA-C-N 115.377 -0.829 . . . . 70.14 112.148 -179.331 . . . . . . . . 0 0 . 1 . 003 nuclear build core ' A' A ' 22' ' ' LEU . . . . . 0.622 ' HG ' ' HG3' ' A' ' 60' ' ' GLN . 91.6 mt . . . . . 0 N--CA 1.472 0.655 0 N-CA-C 111.916 0.339 . . . . 75.44 111.916 . . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 23' ' ' PRO . . . . . . . . . . . . . 32.9 Cg_exo -62.19 166.61 12.42 Favored 'Trans proline' 0 CA--C 1.541 0.844 0 C-N-CA 122.656 2.237 . . . . 73.52 111.845 169.233 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -76.36 -65.07 0.97 Allowed 'General case' 0 CA--C 1.54 0.577 0 CA-C-O 120.963 0.411 . . . . 62.45 112.053 -177.532 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 25' ' ' ASN . . . . . 0.594 ' HB3' ' HB2' ' A' ' 28' ' ' ASP . 1.8 m-20 -81.27 67.54 7.25 Favored 'General case' 0 CA--C 1.541 0.613 0 CA-C-O 121.086 0.47 . . . . 70.44 111.85 -175.578 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 26' ' ' LEU . . . . . 0.445 HD21 ' HB3' ' A' ' 22' ' ' LEU . 95.4 mt -58.87 -51.75 68.66 Favored 'General case' 0 CA--C 1.542 0.635 0 N-CA-C 112.834 0.679 . . . . 72.12 112.834 -176.284 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 35.4 t70 -71.81 -17.01 62.19 Favored 'General case' 0 CA--C 1.54 0.578 0 CA-C-O 121.03 0.443 . . . . 71.41 111.622 -177.975 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 28' ' ' ASP . . . . . 0.594 ' HB2' ' HB3' ' A' ' 25' ' ' ASN . 6.0 m-20 -80.5 -25.26 38.85 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-O 120.775 0.322 . . . . 73.15 110.986 174.802 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 29' ' ' MET . . . . . 0.434 ' HG3' ' O ' ' A' ' 25' ' ' ASN . 87.4 mtp -67.74 139.95 56.69 Favored 'General case' 0 CA--C 1.537 0.448 0 CA-C-O 121.129 0.49 . . . . 73.11 110.575 173.835 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 49.9 mtmt -66.41 151.96 46.07 Favored 'General case' 0 CA--C 1.538 0.484 0 CA-C-O 121.023 0.439 . . . . 73.5 111.769 -176.514 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 31' ' ' VAL . . . . . 0.48 HG12 ' HE3' ' A' ' 35' ' ' LYS . 39.8 t -49.67 -42.74 17.87 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.684 0 CA-C-N 116.085 -0.507 . . . . 74.54 112.288 -176.842 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -63.04 -37.54 87.6 Favored 'General case' 0 CA--C 1.539 0.556 0 N-CA-C 111.854 0.316 . . . . 53.15 111.854 178.041 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 38.2 mt-10 -64.29 -40.55 96.17 Favored 'General case' 0 N--CA 1.469 0.518 0 CA-C-O 120.987 0.423 . . . . 75.31 111.114 179.114 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 88.1 mt -61.96 -46.17 90.47 Favored 'General case' 0 N--CA 1.468 0.47 0 CA-C-N 116.111 -0.495 . . . . 72.12 110.911 176.487 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 35' ' ' LYS . . . . . 0.48 ' HE3' HG12 ' A' ' 31' ' ' VAL . 98.0 mttt -63.8 -32.74 74.34 Favored 'General case' 0 CA--C 1.539 0.538 0 CA-C-N 116.199 -0.455 . . . . 71.12 111.602 177.311 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 36' ' ' GLN . . . . . 0.474 ' O ' ' HG ' ' A' ' 40' ' ' LEU . 25.6 tm0? -62.92 -41.75 99.57 Favored 'General case' 0 CA--C 1.538 0.502 0 CA-C-O 120.844 0.354 . . . . 74.14 110.704 176.744 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 52.9 mm-40 -67.18 -46.69 73.2 Favored 'General case' 0 CA--C 1.542 0.641 0 CA-C-O 120.907 0.384 . . . . 61.13 111.513 174.219 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 38' ' ' LEU . . . . . 0.405 ' CD1' HD22 ' A' ' 52' ' ' LEU . 81.1 mt -53.57 -52.51 59.52 Favored 'General case' 0 N--CA 1.47 0.574 0 N-CA-C 112.472 0.545 . . . . 64.11 112.472 179.942 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 18.4 ptpt -58.59 -40.37 82.98 Favored 'General case' 0 N--CA 1.473 0.678 0 N-CA-C 111.751 0.278 . . . . 72.42 111.751 -177.7 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 40' ' ' LEU . . . . . 0.474 ' HG ' ' O ' ' A' ' 36' ' ' GLN . 94.9 mt -59.69 -30.09 68.54 Favored 'General case' 0 N--CA 1.472 0.642 0 CA-C-O 121.341 0.591 . . . . 54.55 110.993 176.963 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 41' ' ' ARG . . . . . 0.43 ' NH1' ' OE1' ' A' ' 60' ' ' GLN . 60.2 mtt-85 -99.67 14.07 31.37 Favored 'General case' 0 CA--C 1.537 0.466 0 CA-C-N 115.695 -0.684 . . . . 74.31 111.778 -175.804 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 47.7 m 64.16 19.51 11.8 Favored 'General case' 0 N--CA 1.479 0.986 0 CA-C-O 121.066 0.46 . . . . 72.43 111.985 179.045 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 74.3 mt -91.03 146.52 33.83 Favored Pre-proline 0 CA--C 1.541 0.599 0 CA-C-N 116.085 -0.507 . . . . 62.05 111.639 -178.88 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 44' ' ' PRO . . . . . 0.528 ' HD2' ' HD3' ' A' ' 55' ' ' ARG . 33.6 Cg_exo -57.99 134.06 59.83 Favored 'Trans proline' 0 CA--C 1.545 1.03 0 C-N-CA 122.305 2.003 . . . . 75.42 112.546 174.737 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 34.0 m -105.64 -12.91 9.54 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.772 0 N-CA-C 112.57 0.581 . . . . 72.12 112.57 -175.197 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 57.4 p -85.0 37.13 0.65 Allowed 'General case' 0 N--CA 1.478 0.948 0 N-CA-C 112.802 0.667 . . . . 65.43 112.802 -174.933 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . -108.54 174.11 18.41 Favored Glycine 0 CA--C 1.529 0.92 0 C-N-CA 121.277 -0.487 . . . . 61.31 112.946 177.638 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 48' ' ' THR . . . . . 0.496 ' O ' ' HG ' ' A' ' 52' ' ' LEU . 70.6 p -80.96 162.1 24.01 Favored 'General case' 0 N--CA 1.474 0.76 0 O-C-N 122.437 -0.449 . . . . 74.31 111.476 177.811 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 49' ' ' LYS . . . . . 0.406 ' HD3' HG22 ' A' ' 31' ' ' VAL . 22.8 tptm -37.99 -60.44 0.75 Allowed 'General case' 0 N--CA 1.478 0.946 0 N-CA-C 113.106 0.78 . . . . 70.33 113.106 -177.561 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 50' ' ' THR . . . . . . . . . . . . . 60.3 m -58.99 -41.01 86.59 Favored 'General case' 0 N--CA 1.472 0.629 0 N-CA-C 112.146 0.424 . . . . 73.21 112.146 -178.072 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 47.3 mt-10 -62.54 -41.99 99.24 Favored 'General case' 0 N--CA 1.469 0.489 0 CA-C-O 120.803 0.335 . . . . 63.14 111.274 179.784 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 52' ' ' LEU . . . . . 0.496 ' HG ' ' O ' ' A' ' 48' ' ' THR . 42.4 mt -57.63 -46.94 83.49 Favored 'General case' 0 N--CA 1.47 0.527 0 CA-C-O 121.254 0.549 . . . . 70.02 110.803 179.783 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 53' ' ' ILE . . . . . . . . . . . . . 66.3 mt -63.81 -57.5 11.42 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.55 0 CA-C-N 115.578 -0.737 . . . . 71.02 111.934 -179.685 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 21.0 mm-40 -60.03 -33.14 71.61 Favored 'General case' 0 CA--C 1.538 0.485 0 CA-C-N 116.277 -0.419 . . . . 72.02 111.86 -177.918 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 55' ' ' ARG . . . . . 0.528 ' HD3' ' HD2' ' A' ' 44' ' ' PRO . 40.5 ttm180 -64.19 -44.93 90.5 Favored 'General case' 0 CA--C 1.542 0.666 0 CA-C-O 120.814 0.34 . . . . 72.25 111.161 175.576 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 81.1 mt -57.73 -45.87 85.23 Favored 'General case' 0 N--CA 1.471 0.619 0 CA-C-O 121.232 0.539 . . . . 64.53 111.184 174.561 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 81.2 mtp180 -65.26 -43.11 92.34 Favored 'General case' 0 CA--C 1.536 0.439 0 CA-C-N 115.88 -0.6 . . . . 61.34 111.442 -179.041 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 58' ' ' ALA . . . . . 0.404 ' O ' ' HG3' ' A' ' 62' ' ' GLN . . . -60.93 -40.43 93.17 Favored 'General case' 0 CA--C 1.535 0.392 0 CA-C-O 120.916 0.389 . . . . 53.4 111.269 178.775 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 59' ' ' TYR . . . . . . . . . . . . . 81.5 t80 -59.55 -49.92 75.91 Favored 'General case' 0 CA--C 1.54 0.571 0 CA-C-N 115.848 -0.615 . . . . 63.31 111.395 176.396 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 60' ' ' GLN . . . . . 0.622 ' HG3' ' HG ' ' A' ' 22' ' ' LEU . 14.3 mm100 -66.75 -30.19 70.35 Favored 'General case' 0 N--CA 1.471 0.614 0 N-CA-C 111.885 0.328 . . . . 73.42 111.885 178.969 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 61' ' ' ASP . . . . . . . . . . . . . 17.2 t70 -63.37 -40.87 98.43 Favored 'General case' 0 CA--C 1.539 0.545 0 CA-C-O 120.942 0.401 . . . . 65.44 111.437 177.799 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 62' ' ' GLN . . . . . 0.404 ' HG3' ' O ' ' A' ' 58' ' ' ALA . 51.1 mt-30 . . . . . 0 CA--C 1.537 0.469 0 CA-C-N 116.319 -0.4 . . . . 72.21 111.768 179.389 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 76.2 mt . . . . . 0 N--CA 1.472 0.644 0 CA-C-O 120.843 0.354 . . . . 51.44 111.783 . . . . . . . . . 0 0 . 1 . 004 nuclear build core ' A' A ' 23' ' ' PRO . . . . . . . . . . . . . 87.4 Cg_endo -83.54 171.14 11.2 Favored 'Trans proline' 0 CA--C 1.538 0.704 0 C-N-CA 122.797 2.331 . . . . 64.52 112.37 171.643 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -92.97 -2.7 55.53 Favored 'General case' 0 CA--C 1.541 0.631 0 CA-C-O 120.816 0.341 . . . . 73.12 111.481 176.31 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 1.5 m-20 -88.35 19.86 3.59 Favored 'General case' 0 N--CA 1.473 0.687 0 N-CA-C 112.203 0.446 . . . . 65.55 112.203 -177.138 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 99.1 mt -54.14 -51.83 63.0 Favored 'General case' 0 CA--C 1.545 0.767 0 N-CA-C 112.877 0.695 . . . . 64.42 112.877 -174.544 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 17.6 t70 -76.86 -16.47 59.4 Favored 'General case' 0 CA--C 1.543 0.709 0 CA-C-O 121.001 0.429 . . . . 61.55 111.571 -179.15 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 24.7 t70 -81.12 -29.14 34.87 Favored 'General case' 0 CA--C 1.543 0.694 0 CA-C-O 120.89 0.376 . . . . 74.13 111.474 179.985 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 29' ' ' MET . . . . . . . . . . . . . 58.2 mtm -81.55 172.66 13.21 Favored 'General case' 0 CA--C 1.541 0.623 0 CA-C-O 121.368 0.604 . . . . 51.0 111.989 -179.491 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 48.8 mtmt -77.95 156.04 30.47 Favored 'General case' 0 CA--C 1.539 0.544 0 CA-C-N 115.672 -0.694 . . . . 41.11 111.563 -179.402 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 59.7 t -57.79 -35.22 50.35 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.584 0 CA-C-O 120.934 0.397 . . . . 72.24 111.31 179.183 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -59.87 -37.17 78.56 Favored 'General case' 0 CA--C 1.54 0.559 0 CA-C-N 116.523 -0.308 . . . . 53.44 111.659 176.659 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 23.5 mm-40 -64.63 -45.86 85.03 Favored 'General case' 0 N--CA 1.469 0.476 0 CA-C-O 121.224 0.535 . . . . 61.1 110.824 178.046 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 63.1 mt -58.43 -51.29 70.47 Favored 'General case' 0 CA--C 1.537 0.444 0 CA-C-N 115.8 -0.636 . . . . 62.45 110.887 176.907 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 56.7 mtmt -60.82 -31.19 70.61 Favored 'General case' 0 CA--C 1.54 0.592 0 CA-C-N 116.085 -0.507 . . . . 71.23 111.374 177.183 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER -64.57 -45.62 86.29 Favored 'General case' 0 CA--C 1.54 0.571 0 CA-C-N 116.206 -0.452 . . . . 72.45 110.621 177.387 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 42.1 mm-40 -66.11 -40.91 91.08 Favored 'General case' 0 CA--C 1.538 0.488 0 CA-C-O 120.995 0.426 . . . . 54.43 111.505 176.446 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 38' ' ' LEU . . . . . 0.436 HD11 ' HB3' ' A' ' 52' ' ' LEU . 94.5 mt -58.28 -53.67 55.61 Favored 'General case' 0 CA--C 1.538 0.483 0 N-CA-C 112.07 0.396 . . . . 61.35 112.07 178.547 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 39' ' ' LYS . . . . . 0.446 ' NZ ' ' HB3' ' A' ' 39' ' ' LYS . 0.5 OUTLIER -59.59 -31.97 69.96 Favored 'General case' 0 N--CA 1.472 0.649 0 N-CA-C 112.11 0.411 . . . . 64.1 112.11 -176.224 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 78.2 mt -68.26 -28.1 66.91 Favored 'General case' 0 N--CA 1.469 0.503 0 CA-C-O 121.038 0.447 . . . . 72.44 111.364 176.584 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 41' ' ' ARG . . . . . . . . . . . . . 53.1 mtt-85 -103.23 16.18 27.26 Favored 'General case' 0 CA--C 1.539 0.537 0 CA-C-N 116.368 -0.378 . . . . 71.01 111.663 -175.91 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 51.1 m 62.45 24.69 14.71 Favored 'General case' 0 N--CA 1.48 1.028 0 CA-C-O 121.144 0.497 . . . . 75.43 111.888 -179.475 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 78.1 mt -95.2 135.8 23.12 Favored Pre-proline 0 CA--C 1.542 0.65 0 CA-C-N 116.135 -0.484 . . . . 71.43 111.592 -179.039 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 44' ' ' PRO . . . . . 0.408 ' HG2' ' NH1' ' A' ' 55' ' ' ARG . 58.6 Cg_endo -70.98 143.56 45.3 Favored 'Trans proline' 0 CA--C 1.545 1.027 0 C-N-CA 122.752 2.301 . . . . 54.2 113.57 179.392 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 27.5 m -100.26 34.92 0.26 Allowed 'Isoleucine or valine' 0 N--CA 1.475 0.776 0 CA-C-O 121.389 0.614 . . . . 61.04 111.254 -179.718 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 37.3 m -74.94 -26.33 59.53 Favored 'General case' 0 N--CA 1.473 0.712 0 N-CA-C 114.009 1.115 . . . . 74.41 114.009 -169.371 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . -94.95 -171.95 37.24 Favored Glycine 0 CA--C 1.529 0.919 0 C-N-CA 120.655 -0.783 . . . . 73.35 114.522 -175.281 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 48' ' ' THR . . . . . 0.523 ' O ' ' HG ' ' A' ' 52' ' ' LEU . 81.3 p -84.77 179.67 7.29 Favored 'General case' 0 N--CA 1.471 0.584 0 C-N-CA 122.581 0.353 . . . . 64.42 111.273 178.097 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 49' ' ' LYS . . . . . 0.429 ' O ' HG13 ' A' ' 53' ' ' ILE . 87.4 tttt -46.23 -59.92 2.62 Favored 'General case' 0 N--CA 1.475 0.812 0 N-CA-C 112.32 0.489 . . . . 74.21 112.32 -178.384 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 50' ' ' THR . . . . . . . . . . . . . 94.9 m -58.62 -39.86 81.66 Favored 'General case' 0 N--CA 1.472 0.627 0 N-CA-C 111.869 0.322 . . . . 61.02 111.869 -178.845 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -57.44 -54.08 50.91 Favored 'General case' 0 CA--C 1.536 0.433 0 CA-C-O 120.924 0.392 . . . . 71.35 110.819 176.989 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 52' ' ' LEU . . . . . 0.523 ' HG ' ' O ' ' A' ' 48' ' ' THR . 42.6 mt -54.64 -41.42 70.04 Favored 'General case' 0 CA--C 1.538 0.495 0 CA-C-O 121.229 0.538 . . . . 53.32 111.088 178.969 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 53' ' ' ILE . . . . . 0.477 HG22 ' HD3' ' A' ' 57' ' ' ARG . 77.6 mt -62.16 -47.78 91.53 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.636 0 CA-C-N 115.946 -0.57 . . . . 72.24 111.258 176.711 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 36.6 mm-40 -62.5 -35.56 79.77 Favored 'General case' 0 N--CA 1.468 0.472 0 CA-C-N 116.471 -0.332 . . . . 72.33 111.506 177.387 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 55' ' ' ARG . . . . . 0.408 ' NH1' ' HG2' ' A' ' 44' ' ' PRO . 47.9 ttm-85 -65.08 -45.09 86.71 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-O 120.953 0.406 . . . . 72.33 110.995 178.009 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 81.9 mt -59.17 -48.49 81.4 Favored 'General case' 0 CA--C 1.537 0.479 0 CA-C-O 120.99 0.424 . . . . 73.23 110.918 174.76 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 57' ' ' ARG . . . . . 0.477 ' HD3' HG22 ' A' ' 53' ' ' ILE . 7.8 mtp85 -64.37 -41.16 96.87 Favored 'General case' 0 N--CA 1.471 0.597 0 CA-C-N 116.268 -0.424 . . . . 64.34 112.139 179.859 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -67.63 -30.64 70.26 Favored 'General case' 0 N--CA 1.469 0.479 0 CA-C-O 121.147 0.499 . . . . 64.24 111.514 177.92 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 59' ' ' TYR . . . . . . . . . . . . . 77.0 t80 -74.93 -44.47 48.43 Favored 'General case' 0 CA--C 1.539 0.527 0 CA-C-O 121.069 0.462 . . . . 74.34 110.986 175.956 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 60' ' ' GLN . . . . . . . . . . . . . 62.3 tp60 -65.52 -36.39 83.7 Favored 'General case' 0 CA--C 1.537 0.449 0 CA-C-N 116.367 -0.379 . . . . 75.11 110.912 178.409 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 61' ' ' ASP . . . . . . . . . . . . . 14.9 t70 -49.27 -32.44 10.84 Favored 'General case' 0 CA--C 1.543 0.69 0 CA-C-O 121.35 0.595 . . . . 50.11 111.404 175.771 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 62' ' ' GLN . . . . . . . . . . . . . 60.8 mt-30 . . . . . 0 CA--C 1.543 0.696 0 CA-C-N 115.99 -0.55 . . . . 74.0 112.457 -176.923 . . . . . . . . 0 0 . 1 . 005 nuclear build core ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 95.1 mt . . . . . 0 N--CA 1.468 0.431 0 CA-C-O 120.624 0.25 . . . . 71.12 111.503 . . . . . . . . . 0 0 . 1 . 005 nuclear build core ' A' A ' 23' ' ' PRO . . . . . 0.488 ' O ' ' HG ' ' A' ' 26' ' ' LEU . 72.3 Cg_endo -75.61 135.58 18.15 Favored 'Trans proline' 0 CA--C 1.539 0.763 0 C-N-CA 122.333 2.022 . . . . 51.45 112.478 177.31 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -59.41 -16.42 23.19 Favored 'General case' 0 CA--C 1.542 0.647 0 CA-C-O 121.151 0.5 . . . . 75.33 111.707 178.657 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 25' ' ' ASN . . . . . 0.405 ' O ' ' HG3' ' A' ' 29' ' ' MET . 86.7 m-20 -71.94 -2.64 18.82 Favored 'General case' 0 CA--C 1.541 0.609 0 N-CA-C 113.171 0.804 . . . . 71.34 113.171 -179.565 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 26' ' ' LEU . . . . . 0.488 ' HG ' ' O ' ' A' ' 23' ' ' PRO . 89.4 mt -54.8 -31.64 59.25 Favored 'General case' 0 N--CA 1.474 0.744 0 CA-C-O 121.415 0.626 . . . . 74.12 110.531 174.392 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 13.3 t70 -62.09 -48.81 78.51 Favored 'General case' 0 CA--C 1.542 0.654 0 CA-C-N 115.697 -0.683 . . . . 74.43 110.901 173.09 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 20.7 m-20 -66.61 -35.37 80.03 Favored 'General case' 0 CA--C 1.543 0.698 0 CA-C-N 115.983 -0.553 . . . . 75.14 111.609 -179.877 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 29' ' ' MET . . . . . 0.445 ' SD ' HD23 ' A' ' 26' ' ' LEU . 83.6 mtp -62.01 146.87 48.9 Favored 'General case' 0 CA--C 1.537 0.463 0 CA-C-O 121.249 0.547 . . . . 62.31 111.935 -178.43 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 30' ' ' LYS . . . . . 0.585 ' HB2' ' HG2' ' A' ' 33' ' ' GLU . 22.1 mtpp -75.24 170.08 16.77 Favored 'General case' 0 CA--C 1.538 0.501 0 CA-C-N 115.76 -0.655 . . . . 62.01 111.682 -176.298 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 31' ' ' VAL . . . . . 0.499 HG12 ' HE3' ' A' ' 35' ' ' LYS . 45.7 t -60.48 -46.4 95.43 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.669 0 CA-C-N 116.017 -0.538 . . . . 71.42 111.796 -177.354 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -63.99 -36.66 84.71 Favored 'General case' 0 N--CA 1.47 0.532 0 N-CA-C 112.069 0.396 . . . . 51.35 112.069 -179.785 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 33' ' ' GLU . . . . . 0.585 ' HG2' ' HB2' ' A' ' 30' ' ' LYS . 3.3 mm-40 -64.21 -45.65 87.32 Favored 'General case' 0 N--CA 1.471 0.578 0 CA-C-O 121.076 0.465 . . . . 64.23 110.806 -179.032 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 87.6 mt -59.4 -44.57 92.79 Favored 'General case' 0 CA--C 1.539 0.543 0 CA-C-N 116.032 -0.531 . . . . 62.32 110.903 177.607 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 35' ' ' LYS . . . . . 0.499 ' HE3' HG12 ' A' ' 31' ' ' VAL . 99.2 mttt -59.35 -35.87 74.68 Favored 'General case' 0 N--CA 1.469 0.488 0 CA-C-N 116.267 -0.424 . . . . 75.01 111.36 176.101 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 36' ' ' GLN . . . . . 0.513 ' O ' ' HG ' ' A' ' 40' ' ' LEU . 54.4 tp60 -59.69 -43.93 93.85 Favored 'General case' 0 CA--C 1.535 0.392 0 CA-C-N 116.371 -0.377 . . . . 71.23 111.217 178.916 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 37' ' ' GLU . . . . . 0.479 ' O ' ' HG3' ' A' ' 41' ' ' ARG . 35.1 mt-10 -67.63 -42.76 81.8 Favored 'General case' 0 CA--C 1.537 0.464 0 C-N-CA 121.082 -0.247 . . . . 75.15 111.224 176.33 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 38' ' ' LEU . . . . . . . . . . . . . 78.7 mt -52.07 -58.84 5.35 Favored 'General case' 0 N--CA 1.472 0.673 0 N-CA-C 111.863 0.32 . . . . 73.34 111.863 177.295 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 39' ' ' LYS . . . . . 0.409 ' HG2' ' O ' ' A' ' 36' ' ' GLN . 16.1 ptpt -55.98 -36.63 68.07 Favored 'General case' 0 N--CA 1.473 0.692 0 N-CA-C 111.891 0.33 . . . . 75.43 111.891 -177.999 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 40' ' ' LEU . . . . . 0.513 ' HG ' ' O ' ' A' ' 36' ' ' GLN . 92.3 mt -68.72 -29.76 68.26 Favored 'General case' 0 CA--C 1.538 0.501 0 CA-C-O 121.015 0.436 . . . . 73.13 111.33 178.083 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 41' ' ' ARG . . . . . 0.479 ' HG3' ' O ' ' A' ' 37' ' ' GLU . 53.9 mtt-85 -96.01 16.04 18.98 Favored 'General case' 0 CA--C 1.541 0.617 0 CA-C-N 116.327 -0.397 . . . . 75.41 111.454 -179.921 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 50.5 m 65.66 27.52 11.35 Favored 'General case' 0 N--CA 1.48 1.067 0 CA-C-O 121.356 0.598 . . . . 61.42 112.154 178.268 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 49.1 mt -102.28 144.75 29.22 Favored Pre-proline 0 CA--C 1.544 0.734 0 CA-C-N 116.192 -0.458 . . . . 75.12 111.385 -179.916 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 44' ' ' PRO . . . . . . . . . . . . . 57.6 Cg_endo -70.13 123.84 10.36 Favored 'Trans proline' 0 CA--C 1.542 0.888 0 C-N-CA 122.479 2.12 . . . . 70.33 112.944 178.802 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 28.3 m -82.27 -15.04 12.11 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.596 0 N-CA-C 112.853 0.686 . . . . 71.15 112.853 -174.598 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 65.9 m -71.18 79.56 0.7 Allowed 'General case' 0 N--CA 1.472 0.658 0 N-CA-C 112.358 0.503 . . . . 61.22 112.358 -178.272 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . -158.05 173.41 35.27 Favored Glycine 0 CA--C 1.526 0.764 0 C-N-CA 121.239 -0.505 . . . . 74.5 113.193 177.404 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 48' ' ' THR . . . . . 0.539 ' O ' ' HG ' ' A' ' 52' ' ' LEU . 72.3 p -77.58 158.53 29.78 Favored 'General case' 0 N--CA 1.474 0.739 0 O-C-N 122.779 -0.248 . . . . 51.33 110.715 176.808 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 60.0 tttm -49.04 -40.95 33.31 Favored 'General case' 0 N--CA 1.476 0.846 0 CA-C-O 120.729 0.299 . . . . 64.32 111.596 -177.228 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 50' ' ' THR . . . . . 0.464 ' O ' ' HG2' ' A' ' 54' ' ' GLU . 89.2 m -60.63 -54.77 41.32 Favored 'General case' 0 N--CA 1.469 0.481 0 CA-C-O 120.818 0.342 . . . . 71.35 110.96 174.714 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 10.0 mm-40 -54.5 -35.15 62.81 Favored 'General case' 0 N--CA 1.47 0.541 0 CA-C-N 116.22 -0.445 . . . . 72.41 111.971 -179.564 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 52' ' ' LEU . . . . . 0.539 ' HG ' ' O ' ' A' ' 48' ' ' THR . 46.5 mt -62.36 -49.77 74.24 Favored 'General case' 0 CA--C 1.537 0.466 0 CA-C-O 120.977 0.418 . . . . 72.5 110.912 177.962 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 53' ' ' ILE . . . . . 0.512 ' O ' ' HG3' ' A' ' 57' ' ' ARG . 66.6 mt -60.71 -51.61 71.13 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.481 0 CA-C-N 116.149 -0.478 . . . . 74.12 110.847 177.757 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 54' ' ' GLU . . . . . 0.464 ' HG2' ' O ' ' A' ' 50' ' ' THR . 7.5 mm-40 -55.54 -40.75 72.26 Favored 'General case' 0 N--CA 1.47 0.548 0 CA-C-O 121.155 0.503 . . . . 74.51 111.205 178.778 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 23.7 ttm180 -67.37 -38.6 85.0 Favored 'General case' 0 CA--C 1.536 0.428 0 CA-C-N 116.048 -0.524 . . . . 71.44 111.333 -178.685 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 89.7 mt -60.63 -41.45 94.92 Favored 'General case' 0 CA--C 1.535 0.401 0 CA-C-O 120.916 0.388 . . . . 65.22 110.555 172.292 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 57' ' ' ARG . . . . . 0.512 ' HG3' ' O ' ' A' ' 53' ' ' ILE . 44.2 mtm180 -60.98 -53.99 50.42 Favored 'General case' 0 C--O 1.221 -0.41 0 CA-C-N 116.29 -0.413 . . . . 72.45 111.018 177.902 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 58' ' ' ALA . . . . . 0.437 ' O ' ' HG3' ' A' ' 62' ' ' GLN . . . -49.74 -48.82 49.85 Favored 'General case' 0 N--CA 1.471 0.582 0 N-CA-C 112.302 0.482 . . . . 71.24 112.302 -178.518 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 59' ' ' TYR . . . . . . . . . . . . . 70.1 t80 -57.63 -56.83 16.79 Favored 'General case' 0 CA--C 1.54 0.587 0 CA-C-O 120.94 0.4 . . . . 64.42 111.714 178.022 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 60' ' ' GLN . . . . . . . . . . . . . 25.7 tm0? -66.47 -31.99 73.08 Favored 'General case' 0 CA--C 1.545 0.774 0 CA-C-N 116.131 -0.486 . . . . 62.23 111.485 -176.825 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 61' ' ' ASP . . . . . . . . . . . . . 32.6 t70 -64.34 -30.29 71.34 Favored 'General case' 0 CA--C 1.541 0.616 0 C-N-CA 123.267 0.627 . . . . 75.33 112.032 -177.622 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 62' ' ' GLN . . . . . 0.437 ' HG3' ' O ' ' A' ' 58' ' ' ALA . 57.0 mt-30 . . . . . 0 N--CA 1.472 0.652 0 CA-C-O 120.93 0.395 . . . . 74.13 111.61 179.712 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 22' ' ' LEU . . . . . 0.446 ' HG ' ' HG3' ' A' ' 60' ' ' GLN . 95.9 mt . . . . . 0 N--CA 1.471 0.615 0 CA-C-O 120.619 0.247 . . . . 75.33 111.378 . . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 23' ' ' PRO . . . . . 0.412 ' HD2' HD21 ' A' ' 26' ' ' LEU . 39.3 Cg_exo -62.44 140.41 81.97 Favored 'Trans proline' 0 CA--C 1.543 0.97 0 C-N-CA 122.195 1.93 . . . . 73.43 112.249 171.562 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -60.66 -55.35 34.32 Favored 'General case' 0 CA--C 1.541 0.6 0 N-CA-C 112.235 0.458 . . . . 75.14 112.235 -178.907 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 61.7 m-20 -91.84 84.84 5.44 Favored 'General case' 0 CA--C 1.536 0.43 0 CA-C-O 120.914 0.388 . . . . 71.15 111.813 -177.021 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 26' ' ' LEU . . . . . 0.412 HD21 ' HD2' ' A' ' 23' ' ' PRO . 98.6 mt -84.12 -32.98 24.42 Favored 'General case' 0 CA--C 1.538 0.496 0 CA-C-O 120.881 0.372 . . . . 62.21 111.062 176.886 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 4.7 m-20 -66.29 -40.81 90.29 Favored 'General case' 0 CA--C 1.538 0.517 0 CA-C-N 116.308 -0.406 . . . . 64.51 111.562 -179.898 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 1.9 m-20 -60.39 -44.65 95.46 Favored 'General case' 0 CA--C 1.538 0.494 0 CA-C-N 116.21 -0.45 . . . . 65.33 112.05 179.506 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 29' ' ' MET . . . . . . . . . . . . . 59.0 mtm -66.46 157.48 31.94 Favored 'General case' 0 CA--C 1.54 0.573 0 CA-C-O 120.995 0.426 . . . . 63.24 111.429 179.874 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 30' ' ' LYS . . . . . 0.477 ' HB2' ' HG2' ' A' ' 33' ' ' GLU . 46.5 mtmt -78.71 160.88 27.25 Favored 'General case' 0 N--CA 1.47 0.551 0 CA-C-O 120.978 0.418 . . . . 74.51 111.902 -174.659 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 31' ' ' VAL . . . . . 0.411 HG12 ' HE3' ' A' ' 35' ' ' LYS . 47.9 t -54.8 -40.34 51.76 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.547 0 CA-C-O 121.19 0.519 . . . . 72.11 110.941 177.011 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -59.59 -39.44 84.18 Favored 'General case' 0 CA--C 1.54 0.565 0 CA-C-N 116.043 -0.526 . . . . 41.2 111.656 176.834 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 33' ' ' GLU . . . . . 0.477 ' HG2' ' HB2' ' A' ' 30' ' ' LYS . 45.8 mm-40 -64.27 -45.89 86.11 Favored 'General case' 0 CA--C 1.537 0.444 0 CA-C-O 121.195 0.522 . . . . 62.01 110.559 178.134 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 94.3 mt -59.5 -40.78 88.16 Favored 'General case' 0 N--CA 1.468 0.442 0 CA-C-N 115.963 -0.562 . . . . 72.12 111.484 178.597 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 35' ' ' LYS . . . . . 0.436 ' HA ' HD12 ' A' ' 38' ' ' LEU . 99.6 mttt -61.6 -36.93 82.11 Favored 'General case' 0 CA--C 1.538 0.517 0 CA-C-O 121.022 0.439 . . . . 60.42 111.428 177.082 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 36' ' ' GLN . . . . . 0.428 ' O ' ' HG2' ' A' ' 39' ' ' LYS . 8.4 tm0? -63.58 -42.38 98.3 Favored 'General case' 0 CA--C 1.539 0.555 0 CA-C-O 121.105 0.479 . . . . 74.43 110.748 174.357 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 37' ' ' GLU . . . . . 0.447 ' HA ' HH21 ' A' ' 41' ' ' ARG . 18.0 mm-40 -65.16 -40.52 94.44 Favored 'General case' 0 CA--C 1.541 0.6 0 CA-C-N 116.437 -0.347 . . . . 73.24 111.775 175.433 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 38' ' ' LEU . . . . . 0.516 HD11 HD22 ' A' ' 52' ' ' LEU . 86.0 mt -57.0 -52.74 64.06 Favored 'General case' 0 N--CA 1.468 0.464 0 N-CA-C 112.142 0.423 . . . . 73.1 112.142 179.377 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 39' ' ' LYS . . . . . 0.428 ' HG2' ' O ' ' A' ' 36' ' ' GLN . 17.6 ptpt -58.3 -33.92 69.98 Favored 'General case' 0 CA--C 1.542 0.64 0 CA-C-O 120.757 0.313 . . . . 75.54 111.737 -178.135 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 65.4 mt -69.06 -22.5 64.02 Favored 'General case' 0 N--CA 1.471 0.615 0 CA-C-O 121.016 0.436 . . . . 62.14 111.373 176.119 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 41' ' ' ARG . . . . . 0.447 HH21 ' HA ' ' A' ' 37' ' ' GLU . 0.6 OUTLIER -101.8 14.16 32.77 Favored 'General case' 0 CA--C 1.543 0.687 0 CA-C-N 116.12 -0.491 . . . . 72.1 111.415 178.354 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 62.5 m 63.01 18.84 11.24 Favored 'General case' 0 N--CA 1.48 1.058 0 CA-C-O 121.107 0.48 . . . . 72.23 112.237 -179.178 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 43' ' ' LEU . . . . . 0.402 HD22 ' HG2' ' A' ' 55' ' ' ARG . 76.3 mt -93.14 146.64 32.32 Favored Pre-proline 0 CA--C 1.542 0.64 0 C-N-CA 122.714 0.406 . . . . 72.03 111.526 -179.131 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 44' ' ' PRO . . . . . . . . . . . . . 73.8 Cg_endo -73.26 145.51 38.88 Favored 'Trans proline' 0 CA--C 1.541 0.841 0 C-N-CA 122.58 2.187 . . . . 61.43 112.799 178.092 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 34.1 m -88.93 19.08 0.59 Allowed 'Isoleucine or valine' 0 CA--C 1.544 0.733 0 N-CA-C 112.583 0.586 . . . . 74.41 112.583 -175.439 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 46.7 t -100.49 104.15 15.52 Favored 'General case' 0 N--CA 1.475 0.787 0 CA-C-O 120.814 0.34 . . . . 51.34 111.724 -177.929 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 171.24 -175.22 44.9 Favored Glycine 0 CA--C 1.527 0.817 0 C-N-CA 121.052 -0.594 . . . . 54.31 113.417 178.844 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 48' ' ' THR . . . . . 0.548 ' O ' ' HG ' ' A' ' 52' ' ' LEU . 43.8 p -96.98 169.2 9.99 Favored 'General case' 0 N--CA 1.472 0.666 0 O-C-N 122.661 -0.317 . . . . 63.44 111.537 -179.957 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 49' ' ' LYS . . . . . 0.404 ' HD3' HG22 ' A' ' 31' ' ' VAL . 21.4 tptm -50.16 -55.22 15.97 Favored 'General case' 0 N--CA 1.473 0.683 0 N-CA-C 111.924 0.342 . . . . 63.45 111.924 -179.686 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 50' ' ' THR . . . . . 0.44 ' O ' ' HG2' ' A' ' 54' ' ' GLU . 91.5 m -63.64 -43.77 95.82 Favored 'General case' 0 N--CA 1.471 0.583 0 CA-C-O 120.791 0.329 . . . . 75.2 111.536 178.049 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 51' ' ' GLU . . . . . 0.424 ' HB2' ' OG1' ' A' ' 48' ' ' THR . 2.6 tm-20 -55.19 -54.74 39.53 Favored 'General case' 0 CA--C 1.539 0.557 0 C-N-CA 122.896 0.478 . . . . 64.01 111.838 -177.656 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 52' ' ' LEU . . . . . 0.548 ' HG ' ' O ' ' A' ' 48' ' ' THR . 40.8 mt -55.12 -39.39 69.34 Favored 'General case' 0 N--CA 1.471 0.583 0 CA-C-O 120.902 0.382 . . . . 75.43 111.851 -177.15 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 53' ' ' ILE . . . . . . . . . . . . . 77.9 mt -61.41 -45.01 99.5 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.442 0 CA-C-O 121.31 0.576 . . . . 73.21 110.821 175.364 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 54' ' ' GLU . . . . . 0.477 ' CD ' HH21 ' A' ' 57' ' ' ARG . 8.9 mm-40 -64.93 -35.45 81.2 Favored 'General case' 0 N--CA 1.468 0.426 0 CA-C-N 115.772 -0.649 . . . . 63.35 111.207 179.064 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 55' ' ' ARG . . . . . 0.447 HH11 ' HD3' ' A' ' 55' ' ' ARG . 13.2 ttm180 -68.61 -39.76 80.69 Favored 'General case' 0 CA--C 1.541 0.599 0 CA-C-N 116.16 -0.473 . . . . 72.03 110.647 178.165 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 59.1 mt -59.75 -53.23 60.34 Favored 'General case' 0 N--CA 1.47 0.559 0 CA-C-N 116.293 -0.412 . . . . 72.14 111.228 174.138 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 57' ' ' ARG . . . . . 0.477 HH21 ' CD ' ' A' ' 54' ' ' GLU . 40.5 mtm105 -57.38 -45.89 83.97 Favored 'General case' 0 CA--C 1.537 0.47 0 CA-C-O 120.687 0.279 . . . . 75.04 111.442 179.594 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 58' ' ' ALA . . . . . 0.427 ' O ' ' HG3' ' A' ' 62' ' ' GLN . . . -60.33 -34.39 73.75 Favored 'General case' 0 N--CA 1.47 0.531 0 N-CA-C 112.115 0.413 . . . . 51.03 112.115 -179.624 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 59' ' ' TYR . . . . . . . . . . . . . 71.2 t80 -75.27 -54.17 7.53 Favored 'General case' 0 CA--C 1.539 0.549 0 CA-C-O 120.962 0.411 . . . . 74.22 111.555 179.176 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 60' ' ' GLN . . . . . 0.446 ' HG3' ' HG ' ' A' ' 22' ' ' LEU . 24.4 tm0? -60.26 -32.57 71.29 Favored 'General case' 0 CA--C 1.542 0.66 0 CA-C-O 120.923 0.392 . . . . 73.31 111.072 -177.865 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 61' ' ' ASP . . . . . . . . . . . . . 15.8 t70 -57.53 -29.96 64.79 Favored 'General case' 0 CA--C 1.545 0.756 0 C-N-CA 122.977 0.511 . . . . 70.53 111.909 175.169 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 62' ' ' GLN . . . . . 0.427 ' HG3' ' O ' ' A' ' 58' ' ' ALA . 68.9 mt-30 . . . . . 0 N--CA 1.473 0.68 0 CA-C-O 120.889 0.376 . . . . 64.33 112.002 -177.487 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 22' ' ' LEU . . . . . 0.542 ' HG ' ' HG3' ' A' ' 60' ' ' GLN . 97.2 mt . . . . . 0 CA--C 1.539 0.527 0 N-CA-C 111.83 0.308 . . . . 73.33 111.83 . . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 23' ' ' PRO . . . . . 0.449 ' O ' ' HG ' ' A' ' 26' ' ' LEU . 39.8 Cg_endo -67.82 120.7 7.71 Favored 'Trans proline' 0 CA--C 1.539 0.735 0 C-N-CA 122.186 1.924 . . . . 71.42 111.715 174.409 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -57.06 -11.95 1.84 Allowed 'General case' 0 N--CA 1.475 0.798 0 N-CA-C 112.861 0.689 . . . . 52.3 112.861 -177.201 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 25' ' ' ASN . . . . . 0.544 ' HB3' ' HB2' ' A' ' 28' ' ' ASP . 18.8 m120 -92.38 33.76 1.08 Allowed 'General case' 0 CA--C 1.542 0.651 0 N-CA-C 112.265 0.468 . . . . 72.43 112.265 179.408 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 26' ' ' LEU . . . . . 0.449 ' HG ' ' O ' ' A' ' 23' ' ' PRO . 95.6 mt -54.23 -33.16 57.73 Favored 'General case' 0 N--CA 1.474 0.762 0 CA-C-O 120.785 0.326 . . . . 72.34 111.859 -179.671 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 11.3 m-20 -69.15 -38.94 79.04 Favored 'General case' 0 N--CA 1.47 0.548 0 CA-C-O 120.826 0.346 . . . . 73.53 111.554 175.159 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 28' ' ' ASP . . . . . 0.544 ' HB2' ' HB3' ' A' ' 25' ' ' ASN . 6.3 m-20 -69.64 -32.61 71.38 Favored 'General case' 0 CA--C 1.539 0.549 0 CA-C-N 116.285 -0.416 . . . . 55.01 111.319 179.057 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 29' ' ' MET . . . . . . . . . . . . . 84.2 mtp -66.32 140.33 58.1 Favored 'General case' 0 N--CA 1.468 0.426 0 CA-C-O 121.001 0.429 . . . . 74.53 111.307 178.82 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 55.1 mtmt -79.1 158.94 27.7 Favored 'General case' 0 CA--C 1.541 0.605 0 CA-C-O 120.945 0.403 . . . . 72.33 111.899 -177.892 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 94.9 t -49.58 -49.26 19.45 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.7 0 N-CA-C 112.842 0.682 . . . . 51.34 112.842 -176.097 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -57.92 -37.69 74.53 Favored 'General case' 0 N--CA 1.469 0.524 0 CA-C-O 120.855 0.359 . . . . 70.24 111.591 179.657 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 40.6 mt-10 -65.84 -48.55 71.26 Favored 'General case' 0 N--CA 1.466 0.338 0 CA-C-N 116.214 -0.448 . . . . 73.54 111.172 178.347 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 91.5 mt -58.55 -45.37 89.07 Favored 'General case' 0 N--CA 1.469 0.477 0 CA-C-O 120.965 0.412 . . . . 74.24 111.293 178.25 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 35' ' ' LYS . . . . . 0.499 ' HA ' HD12 ' A' ' 38' ' ' LEU . 98.0 mttt -62.83 -31.28 72.25 Favored 'General case' 0 CA--C 1.54 0.592 0 CA-C-O 121.003 0.43 . . . . 74.34 111.565 177.159 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 36' ' ' GLN . . . . . 0.407 ' O ' ' HG ' ' A' ' 40' ' ' LEU . 23.7 tm0? -70.05 -43.91 70.24 Favored 'General case' 0 CA--C 1.542 0.656 0 CA-C-O 121.06 0.457 . . . . 54.45 109.85 175.192 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 37' ' ' GLU . . . . . 0.474 ' HB3' ' NH2' ' A' ' 41' ' ' ARG . 52.8 mm-40 -58.15 -32.66 68.39 Favored 'General case' 0 N--CA 1.473 0.682 0 CA-C-N 115.945 -0.571 . . . . 63.42 111.86 174.436 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 38' ' ' LEU . . . . . 0.499 HD12 ' HA ' ' A' ' 35' ' ' LYS . 99.1 mt -69.45 -58.23 4.25 Favored 'General case' 0 CA--C 1.539 0.547 0 CA-C-N 116.289 -0.414 . . . . 53.1 111.913 178.116 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 39' ' ' LYS . . . . . 0.4 ' HB3' ' NZ ' ' A' ' 39' ' ' LYS . 0.3 OUTLIER -57.83 -31.62 66.82 Favored 'General case' 0 N--CA 1.474 0.741 0 N-CA-C 112.373 0.508 . . . . 75.41 112.373 -174.059 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 40' ' ' LEU . . . . . 0.407 ' HG ' ' O ' ' A' ' 36' ' ' GLN . 95.9 mt -58.96 -35.2 72.76 Favored 'General case' 0 N--CA 1.474 0.74 0 CA-C-O 121.18 0.514 . . . . 74.04 111.764 176.908 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 41' ' ' ARG . . . . . 0.508 ' HB3' ' CE2' ' A' ' 59' ' ' TYR . 16.5 mtm180 -114.21 34.25 4.79 Favored 'General case' 0 CA--C 1.54 0.573 0 CA-C-N 116.034 -0.53 . . . . 74.32 112.366 -173.505 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 32.4 t 69.05 10.17 7.77 Favored 'General case' 0 N--CA 1.479 0.99 0 N-CA-C 113.048 0.759 . . . . 72.24 113.048 172.482 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 43' ' ' LEU . . . . . 0.428 HD22 ' HG2' ' A' ' 55' ' ' ARG . 83.4 mt -88.8 142.0 30.28 Favored Pre-proline 0 CA--C 1.543 0.676 0 N-CA-C 112.126 0.417 . . . . 32.54 112.126 -177.562 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 44' ' ' PRO . . . . . 0.49 ' HG2' HH11 ' A' ' 55' ' ' ARG . 75.6 Cg_endo -76.05 143.38 25.81 Favored 'Trans proline' 0 CA--C 1.544 0.988 0 C-N-CA 123.036 2.491 . . . . 53.2 113.362 178.754 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 25.8 m -97.57 -0.05 10.47 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.711 0 N-CA-C 112.716 0.636 . . . . 53.53 112.716 -176.006 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 19.7 p -79.83 45.89 0.74 Allowed 'General case' 0 N--CA 1.475 0.806 0 N-CA-C 112.866 0.691 . . . . 64.41 112.866 -176.258 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . -131.54 173.77 20.35 Favored Glycine 0 CA--C 1.531 1.032 0 C-N-CA 121.079 -0.582 . . . . 63.42 113.6 179.607 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 48' ' ' THR . . . . . 0.59 ' O ' ' HG ' ' A' ' 52' ' ' LEU . 68.7 p -81.43 173.45 12.42 Favored 'General case' 0 N--CA 1.473 0.7 0 C-N-CA 122.487 0.315 . . . . 74.03 111.287 177.548 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 24.3 tptm -50.17 -50.38 49.35 Favored 'General case' 0 N--CA 1.473 0.709 0 CA-C-O 120.829 0.347 . . . . 75.5 111.599 -179.871 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 50' ' ' THR . . . . . . . . . . . . . 86.5 m -62.84 -39.93 95.88 Favored 'General case' 0 N--CA 1.47 0.542 0 CA-C-N 116.351 -0.386 . . . . 34.35 111.368 177.365 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 61.4 mm-40 -61.06 -42.2 98.05 Favored 'General case' 0 N--CA 1.469 0.501 0 N-CA-C 111.892 0.33 . . . . 71.34 111.892 178.423 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 52' ' ' LEU . . . . . 0.59 ' HG ' ' O ' ' A' ' 48' ' ' THR . 31.4 mt -58.16 -49.84 75.62 Favored 'General case' 0 CA--C 1.538 0.519 0 CA-C-O 121.323 0.582 . . . . 51.15 110.294 177.999 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 53' ' ' ILE . . . . . 0.466 ' O ' ' HG3' ' A' ' 57' ' ' ARG . 72.5 mt -63.4 -55.71 21.42 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.666 0 CA-C-N 115.623 -0.717 . . . . 64.34 111.944 179.704 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 15.3 mm-40 -59.39 -42.36 91.55 Favored 'General case' 0 N--CA 1.472 0.663 0 N-CA-C 112.233 0.457 . . . . 72.22 112.233 -177.96 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 55' ' ' ARG . . . . . 0.49 HH11 ' HG2' ' A' ' 44' ' ' PRO . 10.5 ttm180 -66.11 -35.23 79.95 Favored 'General case' 0 CA--C 1.539 0.553 0 CA-C-O 120.892 0.377 . . . . 65.12 110.792 -178.743 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 45.8 mt -63.04 -51.48 66.57 Favored 'General case' 0 N--CA 1.469 0.507 0 CA-C-N 116.355 -0.384 . . . . 75.42 111.254 172.696 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 57' ' ' ARG . . . . . 0.466 ' HG3' ' O ' ' A' ' 53' ' ' ILE . 29.3 mtp-105 -58.53 -51.66 68.96 Favored 'General case' 0 N--CA 1.47 0.549 0 CA-C-N 116.424 -0.353 . . . . 74.24 111.647 -177.041 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -57.8 -53.21 60.78 Favored 'General case' 0 CA--C 1.539 0.553 0 CA-C-N 116.297 -0.411 . . . . 71.34 111.893 -179.702 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 59' ' ' TYR . . . . . 0.508 ' CE2' ' HB3' ' A' ' 41' ' ' ARG . 72.1 t80 -57.59 -58.68 7.26 Favored 'General case' 0 N--CA 1.471 0.58 0 CA-C-O 121.041 0.448 . . . . 73.22 111.778 179.772 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 60' ' ' GLN . . . . . 0.542 ' HG3' ' HG ' ' A' ' 22' ' ' LEU . 15.6 tm0? -56.69 -31.38 64.41 Favored 'General case' 0 CA--C 1.546 0.819 0 CA-C-N 116.147 -0.478 . . . . 74.34 111.349 -175.278 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 61' ' ' ASP . . . . . . . . . . . . . 17.8 t70 -79.35 -45.77 18.95 Favored 'General case' 0 CA--C 1.542 0.657 0 CA-C-O 120.862 0.363 . . . . 45.22 111.884 -179.865 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 62' ' ' GLN . . . . . . . . . . . . . 14.1 pt20 . . . . . 0 CA--C 1.542 0.655 0 N-CA-C 112.455 0.539 . . . . 70.41 112.455 -174.654 . . . . . . . . 0 0 . 1 . 008 nuclear build core ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 92.9 mt . . . . . 0 CA--C 1.544 0.75 0 N-CA-C 110.441 -0.207 . . . . 72.33 110.441 . . . . . . . . . 0 0 . 1 . 008 nuclear build core ' A' A ' 23' ' ' PRO . . . . . . . . . . . . . 35.9 Cg_endo -65.99 131.87 28.42 Favored 'Trans proline' 0 CA--C 1.544 0.978 0 C-N-CA 122.042 1.828 . . . . 71.1 112.283 174.859 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -68.08 -27.94 66.93 Favored 'General case' 0 N--CA 1.472 0.643 0 N-CA-C 112.266 0.469 . . . . 73.3 112.266 -177.02 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 19.6 m120 -87.18 52.41 2.5 Favored 'General case' 0 CA--C 1.539 0.543 0 CA-C-O 121.058 0.456 . . . . 63.42 112.056 -179.799 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 26' ' ' LEU . . . . . 0.456 ' HB2' HG23 ' A' ' 53' ' ' ILE . 87.5 mt -60.75 -27.71 68.15 Favored 'General case' 0 N--CA 1.469 0.518 0 CA-C-O 121.251 0.548 . . . . 62.24 110.662 173.835 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 7.6 p-10 -67.82 -28.91 67.98 Favored 'General case' 0 CA--C 1.54 0.579 0 CA-C-N 115.836 -0.62 . . . . 74.21 111.63 176.69 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 26.0 t70 -76.7 -39.71 51.12 Favored 'General case' 0 CA--C 1.54 0.578 0 CA-C-N 116.463 -0.335 . . . . 74.43 111.776 -178.963 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 29' ' ' MET . . . . . . . . . . . . . 58.6 mtm -68.56 157.62 35.65 Favored 'General case' 0 N--CA 1.471 0.614 0 CA-C-O 121.549 0.69 . . . . 65.55 112.366 -177.398 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 30' ' ' LYS . . . . . 0.44 ' HB2' ' HG2' ' A' ' 33' ' ' GLU . 50.5 mtmt -69.92 156.58 38.88 Favored 'General case' 0 CA--C 1.539 0.524 0 CA-C-N 115.535 -0.757 . . . . 75.51 112.138 -179.289 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 42.2 t -54.51 -42.71 60.79 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.561 0 CA-C-N 116.12 -0.491 . . . . 70.04 111.273 178.039 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -60.87 -33.74 73.54 Favored 'General case' 0 CA--C 1.54 0.57 0 CA-C-N 116.061 -0.518 . . . . 62.45 111.778 177.913 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 33' ' ' GLU . . . . . 0.44 ' HG2' ' HB2' ' A' ' 30' ' ' LYS . 36.9 mm-40 -67.37 -45.01 77.54 Favored 'General case' 0 N--CA 1.468 0.441 0 CA-C-O 121.122 0.487 . . . . 73.34 110.662 177.185 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 63.4 mt -58.75 -48.3 81.66 Favored 'General case' 0 CA--C 1.537 0.459 0 CA-C-N 115.954 -0.566 . . . . 75.33 110.973 177.481 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 35' ' ' LYS . . . . . 0.418 ' HA ' HD12 ' A' ' 38' ' ' LEU . 98.7 mttt -63.1 -29.6 70.94 Favored 'General case' 0 CA--C 1.54 0.564 0 CA-C-N 116.182 -0.463 . . . . 65.21 111.603 176.964 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 36' ' ' GLN . . . . . 0.553 ' HA ' ' HE3' ' A' ' 39' ' ' LYS . 56.8 tp60 -65.5 -49.72 67.95 Favored 'General case' 0 CA--C 1.537 0.474 0 CA-C-O 121.011 0.434 . . . . 73.34 110.654 174.701 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 7.8 mm-40 -63.45 -21.84 66.53 Favored 'General case' 0 CA--C 1.545 0.759 0 CA-C-O 121.128 0.49 . . . . 75.43 111.621 178.794 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 38' ' ' LEU . . . . . 0.46 ' CD1' HD22 ' A' ' 52' ' ' LEU . 94.8 mt -75.65 -56.24 4.88 Favored 'General case' 0 CA--C 1.539 0.531 0 CA-C-N 116.445 -0.343 . . . . 75.34 111.583 174.736 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 39' ' ' LYS . . . . . 0.553 ' HE3' ' HA ' ' A' ' 36' ' ' GLN . 17.0 ptpt -57.64 -35.96 71.21 Favored 'General case' 0 CA--C 1.543 0.682 0 CA-C-O 120.7 0.286 . . . . 74.32 111.682 -176.727 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 40' ' ' LEU . . . . . 0.469 ' HG ' ' O ' ' A' ' 36' ' ' GLN . 88.3 mt -66.32 -23.56 66.39 Favored 'General case' 0 N--CA 1.472 0.673 0 N-CA-C 111.855 0.317 . . . . 75.4 111.855 -179.793 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 41' ' ' ARG . . . . . 0.784 HH22 ' HA ' ' A' ' 56' ' ' LEU . 52.5 mtm180 -114.07 15.41 18.35 Favored 'General case' 0 CA--C 1.541 0.629 0 N-CA-C 111.987 0.366 . . . . 72.33 111.987 -176.612 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 33.3 t 63.23 73.68 0.45 Allowed 'General case' 0 N--CA 1.477 0.892 0 CA-C-O 121.146 0.498 . . . . 74.12 111.896 -179.056 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 43' ' ' LEU . . . . . 0.425 HD21 ' CD2' ' A' ' 59' ' ' TYR . 68.3 mt -144.3 143.74 23.21 Favored Pre-proline 0 N--CA 1.47 0.557 0 CA-C-N 116.183 -0.462 . . . . 63.14 111.616 -177.773 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 44' ' ' PRO . . . . . . . . . . . . . 56.7 Cg_endo -69.54 127.62 15.03 Favored 'Trans proline' 0 CA--C 1.543 0.933 0 C-N-CA 122.704 2.269 . . . . 74.03 113.09 178.868 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 33.6 m -96.91 23.05 0.94 Allowed 'Isoleucine or valine' 0 CA--C 1.544 0.736 0 CA-C-O 120.978 0.418 . . . . 64.11 112.068 -177.226 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 54.0 m -84.73 -8.33 58.88 Favored 'General case' 0 N--CA 1.477 0.917 0 N-CA-C 113.206 0.817 . . . . 53.21 113.206 -175.023 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . -87.3 170.74 41.3 Favored Glycine 0 CA--C 1.531 1.046 0 C-N-CA 120.928 -0.653 . . . . 73.34 113.824 -176.485 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 48' ' ' THR . . . . . 0.606 ' O ' ' HG ' ' A' ' 52' ' ' LEU . 63.1 p -77.31 167.69 21.29 Favored 'General case' 0 N--CA 1.477 0.91 0 O-C-N 122.637 -0.331 . . . . 64.12 111.359 177.511 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 65.0 tttm -48.37 -48.34 36.75 Favored 'General case' 0 N--CA 1.476 0.825 0 N-CA-C 112.357 0.503 . . . . 72.53 112.357 -176.364 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 50' ' ' THR . . . . . . . . . . . . . 87.3 m -64.55 -39.75 94.32 Favored 'General case' 0 N--CA 1.474 0.743 0 CA-C-O 120.949 0.404 . . . . 64.24 111.904 178.748 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 43.5 mt-10 -64.88 -40.71 95.54 Favored 'General case' 0 N--CA 1.472 0.634 0 CA-C-O 120.86 0.362 . . . . 71.12 111.331 177.933 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 52' ' ' LEU . . . . . 0.606 ' HG ' ' O ' ' A' ' 48' ' ' THR . 47.7 mt -58.34 -50.99 71.67 Favored 'General case' 0 CA--C 1.535 0.398 0 CA-C-O 121.082 0.468 . . . . 73.04 110.024 176.754 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 53' ' ' ILE . . . . . 0.456 HG23 ' HB2' ' A' ' 26' ' ' LEU . 85.2 mt -53.26 -54.73 16.19 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.577 0 CA-C-N 115.742 -0.663 . . . . 63.42 111.732 177.036 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -58.57 -38.43 77.87 Favored 'General case' 0 CA--C 1.537 0.443 0 CA-C-N 116.386 -0.37 . . . . 64.44 111.859 -178.974 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 55' ' ' ARG . . . . . 0.425 HH11 ' HD2' ' A' ' 55' ' ' ARG . 15.9 ttt180 -76.89 -25.1 52.64 Favored 'General case' 0 CA--C 1.541 0.613 0 O-C-N 122.112 -0.367 . . . . 52.44 111.257 -179.792 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 56' ' ' LEU . . . . . 0.784 ' HA ' HH22 ' A' ' 41' ' ' ARG . 85.2 mt -62.82 -49.34 75.31 Favored 'General case' 0 C--O 1.236 0.362 0 CA-C-O 121.126 0.489 . . . . 72.32 109.843 170.48 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 58.6 mtp180 -62.91 -47.83 81.59 Favored 'General case' 0 CA--C 1.538 0.518 0 CA-C-N 115.316 -0.856 . . . . 75.21 110.828 177.078 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 58' ' ' ALA . . . . . 0.513 ' O ' ' HG3' ' A' ' 62' ' ' GLN . . . -55.67 -57.43 12.0 Favored 'General case' 0 N--CA 1.469 0.495 0 CA-C-N 116.032 -0.531 . . . . 74.4 112.17 179.821 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 59' ' ' TYR . . . . . 0.425 ' CD2' HD21 ' A' ' 43' ' ' LEU . 54.1 t80 -54.46 -38.87 66.86 Favored 'General case' 0 N--CA 1.473 0.692 0 CA-C-O 120.993 0.425 . . . . 74.01 111.363 179.635 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 60' ' ' GLN . . . . . . . . . . . . . 23.9 tm0? -69.68 -34.75 74.38 Favored 'General case' 0 CA--C 1.538 0.492 0 CA-C-O 121.094 0.473 . . . . 73.3 110.461 177.614 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 61' ' ' ASP . . . . . . . . . . . . . 34.3 t70 -70.5 -33.63 71.44 Favored 'General case' 0 CA--C 1.543 0.692 0 CA-C-N 116.175 -0.466 . . . . 74.02 111.408 178.338 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 62' ' ' GLN . . . . . 0.513 ' HG3' ' O ' ' A' ' 58' ' ' ALA . 84.7 mt-30 . . . . . 0 N--CA 1.473 0.724 0 CA-C-O 121.147 0.498 . . . . 72.24 111.345 178.43 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 22' ' ' LEU . . . . . 0.452 HD12 ' HB2' ' A' ' 60' ' ' GLN . 79.4 mt . . . . . 0 CA--C 1.54 0.576 0 CA-C-O 120.437 0.161 . . . . 62.04 111.086 . . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 23' ' ' PRO . . . . . 0.523 ' O ' ' HG ' ' A' ' 26' ' ' LEU . 74.5 Cg_exo -50.92 136.84 44.04 Favored 'Trans proline' 0 CA--C 1.539 0.764 0 C-N-CA 122.925 2.416 . . . . 71.14 113.644 -177.243 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -80.15 -15.12 57.76 Favored 'General case' 0 N--CA 1.467 0.421 0 CA-C-O 120.965 0.412 . . . . 72.14 111.309 177.167 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 25' ' ' ASN . . . . . 0.432 ' HB3' ' HB3' ' A' ' 28' ' ' ASP . 14.9 m120 -92.77 27.07 2.47 Favored 'General case' 0 CA--C 1.542 0.67 0 N-CA-C 112.161 0.43 . . . . 64.02 112.161 -177.807 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 26' ' ' LEU . . . . . 0.523 ' HG ' ' O ' ' A' ' 23' ' ' PRO . 82.8 mt -51.07 -38.26 50.59 Favored 'General case' 0 N--CA 1.476 0.839 0 N-CA-C 112.949 0.722 . . . . 75.45 112.949 -176.873 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 35.2 t70 -75.53 -31.25 60.04 Favored 'General case' 0 CA--C 1.541 0.62 0 O-C-N 122.091 -0.38 . . . . 72.45 111.332 179.077 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 28' ' ' ASP . . . . . 0.432 ' HB3' ' HB3' ' A' ' 25' ' ' ASN . 22.1 t70 -73.14 -23.3 60.45 Favored 'General case' 0 CA--C 1.541 0.627 0 CA-C-O 121.124 0.488 . . . . 61.42 110.254 175.791 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 29' ' ' MET . . . . . 0.401 ' SD ' HD23 ' A' ' 26' ' ' LEU . 76.3 mtp -70.83 160.67 32.33 Favored 'General case' 0 CA--C 1.537 0.479 0 CA-C-O 121.295 0.569 . . . . 73.44 111.559 176.038 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 46.3 mtpt -92.9 157.68 16.23 Favored 'General case' 0 CA--C 1.539 0.531 0 CA-C-N 115.898 -0.592 . . . . 72.22 112.003 -177.926 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 57.3 t -52.13 -47.86 43.17 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.693 0 CA-C-N 115.909 -0.587 . . . . 51.21 112.27 -176.418 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -61.73 -35.96 79.6 Favored 'General case' 0 N--CA 1.471 0.575 0 CA-C-O 120.919 0.39 . . . . 73.41 111.874 179.853 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 41.7 mt-10 -72.01 -35.47 69.43 Favored 'General case' 0 N--CA 1.47 0.546 0 CA-C-N 116.297 -0.41 . . . . 65.14 111.126 -178.895 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 90.6 mt -65.79 -50.45 64.66 Favored 'General case' 0 CA--C 1.537 0.473 0 CA-C-N 116.145 -0.48 . . . . 65.14 110.887 174.501 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 35' ' ' LYS . . . . . 0.401 ' HG2' ' HB ' ' A' ' 45' ' ' VAL . 60.3 mttm -54.99 -41.82 71.7 Favored 'General case' 0 N--CA 1.47 0.544 0 CA-C-O 121.043 0.449 . . . . 74.43 111.299 175.667 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 36' ' ' GLN . . . . . 0.485 ' O ' ' HG ' ' A' ' 40' ' ' LEU . 26.0 tm0? -56.15 -47.81 77.5 Favored 'General case' 0 CA--C 1.539 0.539 0 CA-C-N 115.8 -0.636 . . . . 70.22 111.32 -179.489 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 37' ' ' GLU . . . . . 0.726 ' HB3' ' NH2' ' A' ' 41' ' ' ARG . 42.5 mt-10 -70.79 -39.18 73.29 Favored 'General case' 0 CA--C 1.538 0.518 0 N-CA-C 112.095 0.405 . . . . 63.04 112.095 178.151 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 38' ' ' LEU . . . . . 0.416 ' CD1' HD22 ' A' ' 52' ' ' LEU . 77.5 mt -55.84 -54.3 46.21 Favored 'General case' 0 N--CA 1.467 0.424 0 CA-C-O 120.822 0.344 . . . . 73.03 111.573 176.913 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 18.7 ptmt -63.48 -25.68 68.37 Favored 'General case' 0 CA--C 1.541 0.628 0 N-CA-C 112.225 0.454 . . . . 72.04 112.225 -175.006 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 40' ' ' LEU . . . . . 0.485 ' HG ' ' O ' ' A' ' 36' ' ' GLN . 66.1 mt -72.08 -30.03 64.7 Favored 'General case' 0 N--CA 1.471 0.576 0 CA-C-O 120.805 0.336 . . . . 74.3 111.174 175.388 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 41' ' ' ARG . . . . . 0.726 ' NH2' ' HB3' ' A' ' 37' ' ' GLU . 0.0 OUTLIER -97.52 17.07 18.49 Favored 'General case' 0 N--CA 1.472 0.64 0 CA-C-N 116.412 -0.358 . . . . 62.23 111.258 173.951 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 30.0 t 63.32 16.48 9.52 Favored 'General case' 0 N--CA 1.48 1.057 0 N-CA-C 112.706 0.632 . . . . 73.2 112.706 176.989 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 43' ' ' LEU . . . . . 0.426 ' HA ' ' HD3' ' A' ' 44' ' ' PRO . 58.4 mt -79.65 136.2 55.69 Favored Pre-proline 0 CA--C 1.543 0.674 0 N-CA-C 111.914 0.339 . . . . 74.43 111.914 -178.652 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 44' ' ' PRO . . . . . 0.426 ' HD3' ' HA ' ' A' ' 43' ' ' LEU . 51.6 Cg_exo -56.24 120.81 8.9 Favored 'Trans proline' 0 CA--C 1.542 0.905 0 C-N-CA 122.93 2.42 . . . . 61.53 113.227 178.588 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 45' ' ' VAL . . . . . 0.401 ' HB ' ' HG2' ' A' ' 35' ' ' LYS . 34.0 m -94.87 10.17 4.89 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.733 0 N-CA-C 112.719 0.637 . . . . 55.33 112.719 -176.419 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 37.1 t -73.99 -22.17 59.71 Favored 'General case' 0 N--CA 1.478 0.931 0 N-CA-C 113.063 0.764 . . . . 74.33 113.063 -176.226 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . -68.31 169.04 40.91 Favored Glycine 0 CA--C 1.534 1.25 0 C-N-CA 120.968 -0.634 . . . . 53.15 114.055 -176.944 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 48' ' ' THR . . . . . 0.589 ' O ' ' HG ' ' A' ' 52' ' ' LEU . 64.1 p -74.26 170.32 15.81 Favored 'General case' 0 N--CA 1.475 0.799 0 O-C-N 122.558 -0.378 . . . . 74.12 111.115 177.097 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 49' ' ' LYS . . . . . 0.406 ' O ' HG13 ' A' ' 53' ' ' ILE . 64.0 tttm -48.1 -44.98 32.32 Favored 'General case' 0 N--CA 1.471 0.611 0 N-CA-C 112.056 0.391 . . . . 72.33 112.056 -178.875 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 50' ' ' THR . . . . . . . . . . . . . 94.4 m -64.51 -43.86 92.75 Favored 'General case' 0 N--CA 1.472 0.634 0 CA-C-O 120.877 0.37 . . . . 64.23 111.313 177.565 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 44.8 mt-10 -64.6 -34.72 78.92 Favored 'General case' 0 N--CA 1.469 0.518 0 CA-C-N 116.45 -0.341 . . . . 74.43 111.533 -179.878 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 52' ' ' LEU . . . . . 0.589 ' HG ' ' O ' ' A' ' 48' ' ' THR . 44.5 mt -62.03 -44.51 96.55 Favored 'General case' 0 N--CA 1.471 0.6 0 CA-C-O 121.409 0.624 . . . . 72.25 110.318 176.381 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 53' ' ' ILE . . . . . 0.536 HG22 ' HD3' ' A' ' 57' ' ' ARG . 79.7 mt -60.91 -52.38 62.36 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.576 0 CA-C-N 115.525 -0.762 . . . . 73.2 111.301 176.172 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 11.8 mm-40 -61.45 -30.15 70.41 Favored 'General case' 0 N--CA 1.47 0.54 0 CA-C-N 116.204 -0.453 . . . . 54.41 111.757 178.68 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 55' ' ' ARG . . . . . 0.507 ' HA ' ' HE ' ' A' ' 55' ' ' ARG . 0.8 OUTLIER -67.33 -50.03 61.68 Favored 'General case' 0 CA--C 1.54 0.562 0 CA-C-O 120.865 0.364 . . . . 71.14 110.93 179.5 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 56' ' ' LEU . . . . . 0.62 HD22 HH21 ' A' ' 41' ' ' ARG . 60.7 mt -59.77 -51.34 70.16 Favored 'General case' 0 N--CA 1.472 0.667 0 CA-C-O 121.193 0.52 . . . . 64.34 111.126 175.376 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 57' ' ' ARG . . . . . 0.536 ' HD3' HG22 ' A' ' 53' ' ' ILE . 16.7 mtp85 -56.97 -39.11 74.0 Favored 'General case' 0 CA--C 1.539 0.538 0 CA-C-N 116.022 -0.536 . . . . 74.03 112.132 179.806 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -66.75 -40.03 88.14 Favored 'General case' 0 CA--C 1.54 0.575 0 CA-C-O 120.984 0.421 . . . . 74.33 111.5 176.797 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 59' ' ' TYR . . . . . . . . . . . . . 73.5 t80 -63.43 -38.09 89.8 Favored 'General case' 0 CA--C 1.542 0.657 0 CA-C-N 116.237 -0.438 . . . . 53.12 111.348 178.907 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 60' ' ' GLN . . . . . 0.452 ' HB2' HD12 ' A' ' 22' ' ' LEU . 0.0 OUTLIER -76.61 -45.7 29.12 Favored 'General case' 0 CA--C 1.542 0.669 0 CA-C-O 121.282 0.563 . . . . 54.32 110.536 178.618 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 61' ' ' ASP . . . . . . . . . . . . . 27.3 t70 -53.08 -28.77 26.68 Favored 'General case' 0 CA--C 1.545 0.787 0 N-CA-C 112.833 0.679 . . . . 74.12 112.833 -176.988 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 62' ' ' GLN . . . . . . . . . . . . . 10.1 pt20 . . . . . 0 N--CA 1.473 0.699 0 N-CA-C 112.735 0.642 . . . . 50.02 112.735 -178.956 . . . . . . . . 0 0 . 1 . 010 nuclear build core ' A' A ' 22' ' ' LEU . . . . . 0.457 ' HG ' ' HG3' ' A' ' 60' ' ' GLN . 91.3 mt . . . . . 0 N--CA 1.475 0.786 0 CA-C-O 120.577 0.227 . . . . 74.34 111.269 . . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 23' ' ' PRO . . . . . 0.434 ' HG2' HD23 ' A' ' 26' ' ' LEU . 46.9 Cg_endo -70.32 150.34 64.65 Favored 'Trans proline' 0 CA--C 1.541 0.838 0 C-N-CA 122.191 1.927 . . . . 74.23 111.751 170.714 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -67.17 -39.63 86.5 Favored 'General case' 0 N--CA 1.47 0.556 0 CA-C-O 121.023 0.44 . . . . 74.02 112.02 -177.855 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 25' ' ' ASN . . . . . 0.429 ' HB3' ' HB2' ' A' ' 28' ' ' ASP . 1.9 m-20 -92.57 72.44 5.08 Favored 'General case' 0 CA--C 1.537 0.456 0 CA-C-O 121.107 0.479 . . . . 75.34 111.812 -178.613 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 26' ' ' LEU . . . . . 0.434 HD23 ' HG2' ' A' ' 23' ' ' PRO . 92.9 mt -72.28 -33.49 67.48 Favored 'General case' 0 CA--C 1.536 0.412 0 CA-C-N 116.332 -0.395 . . . . 71.41 111.685 179.029 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 36.3 t70 -72.83 -25.17 61.03 Favored 'General case' 0 CA--C 1.538 0.516 0 O-C-N 122.17 -0.331 . . . . 64.43 111.42 178.611 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 28' ' ' ASP . . . . . 0.429 ' HB2' ' HB3' ' A' ' 25' ' ' ASN . 16.3 m-20 -74.91 -15.36 60.7 Favored 'General case' 0 N--CA 1.469 0.508 0 CA-C-O 120.89 0.376 . . . . 74.02 111.296 175.155 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 29' ' ' MET . . . . . . . . . . . . . 86.1 mtp -81.65 137.8 35.4 Favored 'General case' 0 CA--C 1.536 0.419 0 CA-C-O 121.01 0.433 . . . . 65.21 110.947 175.76 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 30' ' ' LYS . . . . . 0.46 ' HB2' ' HG2' ' A' ' 33' ' ' GLU . 51.3 mtmt -66.85 155.41 38.4 Favored 'General case' 0 CA--C 1.541 0.624 0 CA-C-N 116.302 -0.408 . . . . 74.41 111.357 -179.989 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 90.2 t -54.06 -42.4 54.82 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.713 0 N-CA-C 111.963 0.357 . . . . 73.24 111.963 -177.673 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -63.27 -33.08 74.72 Favored 'General case' 0 CA--C 1.539 0.528 0 CA-C-O 120.791 0.329 . . . . 74.51 111.643 177.68 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 33' ' ' GLU . . . . . 0.46 ' HG2' ' HB2' ' A' ' 30' ' ' LYS . 57.9 mm-40 -70.22 -47.61 60.68 Favored 'General case' 0 N--CA 1.468 0.426 0 CA-C-O 120.919 0.39 . . . . 65.4 110.636 177.462 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 97.7 mt -57.35 -46.08 83.68 Favored 'General case' 0 CA--C 1.539 0.535 0 CA-C-N 116.234 -0.439 . . . . 61.24 111.144 176.228 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 55.2 mtmt -63.98 -32.47 74.01 Favored 'General case' 0 CA--C 1.539 0.538 0 CA-C-N 116.426 -0.352 . . . . 74.23 111.568 177.5 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 51.5 tp60 -65.81 -49.6 67.69 Favored 'General case' 0 CA--C 1.539 0.533 0 CA-C-O 121.008 0.433 . . . . 71.51 110.067 175.495 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 37' ' ' GLU . . . . . 0.639 ' HB3' HH21 ' A' ' 41' ' ' ARG . 42.2 mm-40 -54.75 -31.77 59.0 Favored 'General case' 0 N--CA 1.472 0.637 0 CA-C-N 115.921 -0.581 . . . . 70.12 111.591 175.562 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 38' ' ' LEU . . . . . 0.45 ' CD1' HD22 ' A' ' 52' ' ' LEU . 91.5 mt -72.02 -62.2 1.51 Allowed 'General case' 0 CA--C 1.538 0.488 0 CA-C-N 116.284 -0.416 . . . . 73.41 111.92 176.694 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 20.6 ptmt -58.92 -34.28 71.53 Favored 'General case' 0 CA--C 1.541 0.599 0 N-CA-C 112.622 0.601 . . . . 72.21 112.622 -172.929 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 93.0 mt -64.87 -22.46 67.0 Favored 'General case' 0 N--CA 1.475 0.793 0 CA-C-O 121.193 0.521 . . . . 43.22 111.568 177.743 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 41' ' ' ARG . . . . . 0.639 HH21 ' HB3' ' A' ' 37' ' ' GLU . 15.5 mtm180 -109.72 27.12 9.89 Favored 'General case' 0 CA--C 1.541 0.603 0 CA-C-N 116.136 -0.484 . . . . 75.22 111.604 177.77 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 28.0 t 70.23 5.34 5.27 Favored 'General case' 0 N--CA 1.478 0.97 0 N-CA-C 112.809 0.67 . . . . 74.05 112.809 174.818 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 61.4 mt -82.8 142.38 45.26 Favored Pre-proline 0 CA--C 1.542 0.639 0 CA-C-O 120.723 0.297 . . . . 71.52 111.468 -179.569 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 44' ' ' PRO . . . . . 0.434 ' HG2' ' NH1' ' A' ' 55' ' ' ARG . 59.2 Cg_endo -70.13 143.79 50.14 Favored 'Trans proline' 0 C--N 1.352 0.723 0 C-N-CA 122.476 2.117 . . . . 72.32 112.567 178.411 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 30.2 m -95.09 16.45 1.99 Allowed 'Isoleucine or valine' 0 CA--C 1.54 0.59 0 CA-C-O 121.22 0.533 . . . . 71.31 111.93 -177.063 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 33.0 t -90.53 89.42 7.55 Favored 'General case' 0 N--CA 1.47 0.528 0 CA-C-N 116.247 -0.433 . . . . 72.12 111.455 179.713 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . -172.82 174.88 45.88 Favored Glycine 0 CA--C 1.528 0.867 0 C-N-CA 120.711 -0.757 . . . . 62.12 113.851 178.68 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 48' ' ' THR . . . . . 0.601 ' O ' ' HG ' ' A' ' 52' ' ' LEU . 68.3 p -93.12 170.03 9.95 Favored 'General case' 0 N--CA 1.469 0.516 0 C-N-CA 122.58 0.352 . . . . 72.4 111.019 178.748 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 22.8 tptm -44.47 -54.57 5.84 Favored 'General case' 0 N--CA 1.472 0.656 0 N-CA-C 112.135 0.42 . . . . 72.32 112.135 -179.02 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 50' ' ' THR . . . . . . . . . . . . . 51.4 m -69.96 -40.9 75.14 Favored 'General case' 0 CA--C 1.538 0.482 0 CA-C-N 116.405 -0.361 . . . . 72.43 111.781 -179.59 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 2.9 tm-20 -55.17 -48.82 73.24 Favored 'General case' 0 CA--C 1.542 0.647 0 CA-C-N 116.354 -0.384 . . . . 72.23 111.246 179.298 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 52' ' ' LEU . . . . . 0.601 ' HG ' ' O ' ' A' ' 48' ' ' THR . 54.2 mt -56.47 -46.38 80.44 Favored 'General case' 0 N--CA 1.47 0.556 0 CA-C-O 121.137 0.494 . . . . 73.24 111.059 179.169 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 53' ' ' ILE . . . . . . . . . . . . . 78.9 mt -56.23 -53.12 43.28 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.534 0 CA-C-N 115.948 -0.569 . . . . 75.15 111.634 178.162 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 38.9 mt-10 -68.31 -28.14 66.91 Favored 'General case' 0 CA--C 1.536 0.438 0 CA-C-N 116.243 -0.435 . . . . 72.45 111.816 -178.897 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 55' ' ' ARG . . . . . 0.434 ' NH1' ' HG2' ' A' ' 44' ' ' PRO . 41.9 ttm-85 -68.69 -38.71 80.54 Favored 'General case' 0 CA--C 1.537 0.481 0 CA-C-O 121.122 0.486 . . . . 74.23 110.596 176.752 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 62.4 mt -56.73 -48.39 77.88 Favored 'General case' 0 CA--C 1.538 0.494 0 CA-C-N 116.088 -0.506 . . . . 72.31 111.137 173.482 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 54.1 mtm180 -61.48 -41.96 98.05 Favored 'General case' 0 N--CA 1.469 0.497 0 CA-C-N 116.577 -0.283 . . . . 75.45 111.186 177.78 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -55.25 -41.21 71.85 Favored 'General case' 0 N--CA 1.471 0.584 0 CA-C-O 120.943 0.402 . . . . 61.12 111.682 179.703 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 59' ' ' TYR . . . . . . . . . . . . . 87.0 t80 -69.73 -51.57 33.07 Favored 'General case' 0 CA--C 1.536 0.44 0 CA-C-O 121.092 0.472 . . . . 74.32 110.833 176.207 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 60' ' ' GLN . . . . . 0.457 ' HG3' ' HG ' ' A' ' 22' ' ' LEU . 17.6 mm100 -58.42 -29.29 65.99 Favored 'General case' 0 CA--C 1.539 0.547 0 CA-C-N 116.101 -0.499 . . . . 71.11 112.264 179.484 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 61' ' ' ASP . . . . . . . . . . . . . 19.5 t70 -71.91 -45.27 61.8 Favored 'General case' 0 C--N 1.321 -0.65 0 CA-C-N 116.178 -0.465 . . . . 74.25 111.633 179.094 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 62' ' ' GLN . . . . . . . . . . . . . 11.0 pt20 . . . . . 0 CA--C 1.54 0.589 0 N-CA-C 112.706 0.632 . . . . 75.43 112.706 -175.348 . . . . . . . . 0 0 . 1 . 011 nuclear build core ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 98.8 mt . . . . . 0 CA--C 1.541 0.632 0 CA-C-O 120.327 0.108 . . . . 72.23 111.051 . . . . . . . . . 0 0 . 1 . 011 nuclear build core ' A' A ' 23' ' ' PRO . . . . . . . . . . . . . 74.5 Cg_exo -50.81 130.39 30.63 Favored 'Trans proline' 0 CA--C 1.541 0.87 0 C-N-CA 122.538 2.159 . . . . 71.42 112.898 177.266 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -55.33 -43.83 75.32 Favored 'General case' 0 CA--C 1.539 0.523 0 CA-C-O 121.106 0.479 . . . . 44.24 112.132 -178.022 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 85.1 m-20 -97.77 67.97 2.03 Favored 'General case' 0 CA--C 1.537 0.455 0 N-CA-C 112.122 0.416 . . . . 62.12 112.122 179.219 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 26' ' ' LEU . . . . . 0.414 ' HB2' HG23 ' A' ' 53' ' ' ILE . 96.5 mt -63.63 -28.58 70.01 Favored 'General case' 0 N--CA 1.47 0.539 0 CA-C-O 121.614 0.721 . . . . 73.34 110.086 170.444 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 8.8 p-10 -64.74 -25.17 67.81 Favored 'General case' 0 CA--C 1.539 0.54 0 CA-C-N 115.346 -0.843 . . . . 72.04 111.835 177.788 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 34.7 t70 -84.23 -6.77 59.44 Favored 'General case' 0 CA--C 1.543 0.698 0 CA-C-O 120.945 0.402 . . . . 73.32 111.65 -179.857 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 29' ' ' MET . . . . . 0.457 ' O ' ' HE3' ' A' ' 49' ' ' LYS . 83.6 mtp -87.66 166.78 14.43 Favored 'General case' 0 CA--C 1.541 0.613 0 CA-C-O 121.062 0.458 . . . . 64.11 111.752 179.875 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 30' ' ' LYS . . . . . 0.573 ' HB2' ' HG2' ' A' ' 33' ' ' GLU . 29.0 mtpp -84.17 153.1 23.87 Favored 'General case' 0 CA--C 1.54 0.585 0 CA-C-N 116.487 -0.324 . . . . 74.1 111.458 179.731 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 65.6 t -53.47 -57.1 5.77 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.772 0 N-CA-C 112.164 0.431 . . . . 71.24 112.164 -178.261 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 32' ' ' ALA . . . . . 0.53 ' HA ' ' HD3' ' A' ' 35' ' ' LYS . . . -58.38 -29.3 65.92 Favored 'General case' 0 N--CA 1.472 0.641 0 N-CA-C 112.214 0.449 . . . . 70.15 112.214 -178.85 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 33' ' ' GLU . . . . . 0.573 ' HG2' ' HB2' ' A' ' 30' ' ' LYS . 13.9 mm-40 -74.41 -38.95 62.94 Favored 'General case' 0 CA--C 1.538 0.519 0 CA-C-O 120.75 0.309 . . . . 74.32 110.938 179.413 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 92.9 mt -63.61 -44.14 94.82 Favored 'General case' 0 N--CA 1.47 0.531 0 CA-C-O 121.271 0.558 . . . . 72.23 110.308 172.925 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 35' ' ' LYS . . . . . 0.53 ' HD3' ' HA ' ' A' ' 32' ' ' ALA . 58.2 mtpt -55.84 -41.26 74.02 Favored 'General case' 0 N--CA 1.468 0.469 0 CA-C-N 115.775 -0.648 . . . . 63.42 111.447 176.658 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 36' ' ' GLN . . . . . 0.414 ' O ' ' HG ' ' A' ' 40' ' ' LEU . 8.0 tp-100 -56.69 -52.85 63.34 Favored 'General case' 0 CA--C 1.539 0.531 0 CA-C-O 120.876 0.37 . . . . 55.23 110.775 175.855 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 37' ' ' GLU . . . . . 0.629 ' HB3' ' NH2' ' A' ' 41' ' ' ARG . 25.9 mm-40 -57.91 -36.43 72.43 Favored 'General case' 0 CA--C 1.54 0.594 0 N-CA-C 112.253 0.464 . . . . 71.44 112.253 177.784 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 38' ' ' LEU . . . . . 0.446 ' CD1' HD22 ' A' ' 52' ' ' LEU . 88.0 mt -66.26 -58.33 5.59 Favored 'General case' 0 CA--C 1.539 0.54 0 CA-C-O 120.887 0.375 . . . . 71.41 111.549 177.14 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 20.7 ptmt -61.25 -30.24 70.33 Favored 'General case' 0 CA--C 1.54 0.585 0 N-CA-C 111.99 0.367 . . . . 73.23 111.99 -175.433 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 40' ' ' LEU . . . . . 0.414 ' HG ' ' O ' ' A' ' 36' ' ' GLN . 87.1 mt -68.21 -25.9 65.45 Favored 'General case' 0 CA--C 1.541 0.611 0 O-C-N 122.249 -0.282 . . . . 74.55 111.722 176.851 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 41' ' ' ARG . . . . . 0.678 HH21 HD22 ' A' ' 56' ' ' LEU . 80.8 mtm-85 -110.77 25.5 11.71 Favored 'General case' 0 N--CA 1.472 0.656 0 N-CA-C 112.051 0.389 . . . . 71.24 112.051 179.953 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 31.9 t 63.1 34.15 13.94 Favored 'General case' 0 N--CA 1.479 1.008 0 N-CA-C 112.415 0.524 . . . . 72.24 112.415 174.832 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 64.3 mt -105.16 138.55 19.56 Favored Pre-proline 0 CA--C 1.541 0.625 0 CA-C-N 116.554 -0.293 . . . . 74.15 111.499 179.367 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 44' ' ' PRO . . . . . 0.412 ' HG2' ' NH1' ' A' ' 55' ' ' ARG . 37.2 Cg_endo -66.84 131.64 26.24 Favored 'Trans proline' 0 CA--C 1.544 1.007 0 C-N-CA 122.524 2.149 . . . . 53.22 112.801 178.066 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 34.2 m -102.47 17.22 4.51 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.748 0 N-CA-C 112.356 0.502 . . . . 75.15 112.356 -174.948 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 69.3 m -81.36 13.33 3.0 Favored 'General case' 0 N--CA 1.478 0.942 0 N-CA-C 113.329 0.863 . . . . 61.03 113.329 -175.552 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . -104.45 172.28 20.18 Favored Glycine 0 CA--C 1.529 0.912 0 C-N-CA 120.908 -0.663 . . . . 22.22 113.973 -175.983 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 48' ' ' THR . . . . . 0.575 ' O ' ' HG ' ' A' ' 52' ' ' LEU . 43.4 p -77.0 169.23 18.71 Favored 'General case' 0 N--CA 1.473 0.707 0 O-C-N 122.504 -0.41 . . . . 71.23 110.87 176.785 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 49' ' ' LYS . . . . . 0.512 ' HE2' HD11 ' A' ' 53' ' ' ILE . 23.7 tptm -42.22 -51.15 4.81 Favored 'General case' 0 N--CA 1.475 0.776 0 CA-C-O 120.942 0.401 . . . . 73.43 111.598 176.818 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 50' ' ' THR . . . . . . . . . . . . . 31.1 m -60.88 -47.07 88.08 Favored 'General case' 0 CA--C 1.539 0.548 0 CA-C-N 116.01 -0.541 . . . . 71.35 111.769 -179.919 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 42.4 mt-10 -64.44 -38.13 89.96 Favored 'General case' 0 N--CA 1.472 0.637 0 CA-C-O 120.798 0.332 . . . . 73.41 111.789 -177.018 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 52' ' ' LEU . . . . . 0.575 ' HG ' ' O ' ' A' ' 48' ' ' THR . 43.8 mt -61.24 -44.23 97.59 Favored 'General case' 0 N--CA 1.47 0.542 0 CA-C-O 121.309 0.576 . . . . 72.44 110.458 177.175 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 53' ' ' ILE . . . . . 0.512 HD11 ' HE2' ' A' ' 49' ' ' LYS . 70.0 mt -60.77 -55.82 22.01 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.51 0 CA-C-N 115.643 -0.708 . . . . 75.35 111.149 176.645 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 53.9 mm-40 -54.99 -41.11 70.82 Favored 'General case' 0 CA--C 1.538 0.493 0 CA-C-N 116.161 -0.472 . . . . 73.34 111.74 -179.493 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 55' ' ' ARG . . . . . 0.412 ' NH1' ' HG2' ' A' ' 44' ' ' PRO . 30.9 ttm180 -63.36 -38.12 89.9 Favored 'General case' 0 CA--C 1.541 0.625 0 CA-C-N 116.237 -0.438 . . . . 54.43 111.361 179.643 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 56' ' ' LEU . . . . . 0.678 HD22 HH21 ' A' ' 41' ' ' ARG . 68.6 mt -68.72 -46.81 67.98 Favored 'General case' 0 N--CA 1.472 0.631 0 CA-C-O 120.757 0.313 . . . . 73.41 111.452 174.563 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 57' ' ' ARG . . . . . 0.44 ' HG3' ' O ' ' A' ' 53' ' ' ILE . 69.0 mtp180 -55.79 -46.17 78.03 Favored 'General case' 0 N--CA 1.471 0.593 0 CA-C-O 121.246 0.546 . . . . 54.3 111.073 178.713 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -69.13 -40.97 77.94 Favored 'General case' 0 CA--C 1.536 0.434 0 CA-C-N 116.021 -0.536 . . . . 74.5 112.132 -179.954 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 59' ' ' TYR . . . . . . . . . . . . . 49.6 t80 -63.84 -28.47 69.88 Favored 'General case' 0 N--CA 1.469 0.508 0 CA-C-O 121.051 0.453 . . . . 75.2 110.894 177.695 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 60' ' ' GLN . . . . . . . . . . . . . 17.4 tm0? -78.36 -44.8 24.1 Favored 'General case' 0 CA--C 1.542 0.663 0 CA-C-N 116.196 -0.456 . . . . 75.31 110.355 176.381 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 61' ' ' ASP . . . . . . . . . . . . . 17.1 t70 -55.17 -45.97 75.78 Favored 'General case' 0 CA--C 1.542 0.642 0 N-CA-C 112.36 0.504 . . . . 62.12 112.36 179.359 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 62' ' ' GLN . . . . . . . . . . . . . 17.7 pt20 . . . . . 0 CA--C 1.542 0.671 0 N-CA-C 112.588 0.588 . . . . 71.1 112.588 -177.36 . . . . . . . . 0 0 . 1 . 012 nuclear build core ' A' A ' 22' ' ' LEU . . . . . 0.519 HD12 ' HB2' ' A' ' 60' ' ' GLN . 88.8 mt . . . . . 0 CA--C 1.542 0.655 0 CA-C-O 120.605 0.241 . . . . 74.3 110.984 . . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 23' ' ' PRO . . . . . 0.482 ' HD3' ' HA ' ' A' ' 22' ' ' LEU . 23.3 Cg_exo -62.86 163.1 23.06 Favored 'Trans proline' 0 CA--C 1.539 0.762 0 C-N-CA 123.013 2.475 . . . . 54.34 113.942 -174.554 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -87.27 14.07 8.52 Favored 'General case' 0 N--CA 1.47 0.567 0 CA-C-O 121.269 0.557 . . . . 22.53 111.289 176.293 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 12.0 m120 -104.13 9.27 36.36 Favored 'General case' 0 CA--C 1.536 0.432 0 CA-C-N 116.0 -0.545 . . . . 74.44 111.739 -177.639 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 26' ' ' LEU . . . . . 0.457 HD23 ' SD ' ' A' ' 29' ' ' MET . 63.3 mt -56.39 -27.04 55.1 Favored 'General case' 0 N--CA 1.475 0.812 0 CA-C-O 121.052 0.453 . . . . 53.53 111.849 -174.811 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 5.1 m-20 -61.73 -53.21 59.06 Favored 'General case' 0 CA--C 1.543 0.681 0 CA-C-N 116.07 -0.514 . . . . 60.53 111.158 174.825 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 12.2 m-20 -73.48 -32.55 64.38 Favored 'General case' 0 N--CA 1.471 0.586 0 CA-C-N 116.188 -0.46 . . . . 65.05 111.696 179.484 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 29' ' ' MET . . . . . 0.457 ' SD ' HD23 ' A' ' 26' ' ' LEU . 87.7 mtp -57.13 123.01 13.77 Favored 'General case' 0 N--CA 1.468 0.426 0 CA-C-O 121.049 0.452 . . . . 61.11 110.67 178.461 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 30' ' ' LYS . . . . . 0.451 ' HB2' ' OE1' ' A' ' 33' ' ' GLU . 59.8 mtpt -70.22 167.1 18.62 Favored 'General case' 0 CA--C 1.541 0.624 0 N-CA-C 113.098 0.777 . . . . 75.03 113.098 -170.722 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 46.5 t -50.66 -55.47 6.55 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.681 0 N-CA-C 112.726 0.639 . . . . 64.4 112.726 -174.46 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -60.47 -40.15 90.21 Favored 'General case' 0 N--CA 1.471 0.587 0 CA-C-O 120.979 0.419 . . . . 62.32 111.717 -179.378 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 33' ' ' GLU . . . . . 0.451 ' OE1' ' HB2' ' A' ' 30' ' ' LYS . 0.9 OUTLIER -58.49 -46.19 87.17 Favored 'General case' 0 CA--C 1.541 0.62 0 CA-C-N 115.838 -0.619 . . . . 71.34 111.412 177.113 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 91.6 mt -64.77 -46.43 82.17 Favored 'General case' 0 N--CA 1.471 0.594 0 CA-C-O 121.305 0.574 . . . . 74.43 111.019 176.756 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 35' ' ' LYS . . . . . 0.401 ' HA ' HD12 ' A' ' 38' ' ' LEU . 9.0 mtpm? -60.94 -29.36 69.57 Favored 'General case' 0 CA--C 1.538 0.519 0 CA-C-N 115.882 -0.599 . . . . 71.45 111.929 179.112 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 54.2 tp60 -62.48 -47.63 83.17 Favored 'General case' 0 CA--C 1.538 0.496 0 CA-C-O 120.838 0.352 . . . . 74.1 110.849 176.95 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 29.9 mm-40 -61.92 -45.22 94.67 Favored 'General case' 0 N--CA 1.47 0.555 0 CA-C-O 121.104 0.478 . . . . 75.0 111.129 175.446 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 38' ' ' LEU . . . . . 0.479 ' CD1' HD22 ' A' ' 52' ' ' LEU . 97.3 mt -57.63 -53.95 52.33 Favored 'General case' 0 CA--C 1.541 0.626 0 CA-C-N 116.092 -0.503 . . . . 73.23 112.342 -178.781 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 19.3 ptpt -57.25 -38.25 73.57 Favored 'General case' 0 N--CA 1.474 0.743 0 CA-C-O 120.823 0.344 . . . . 72.35 111.745 -176.975 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 95.8 mt -65.78 -24.34 66.91 Favored 'General case' 0 CA--C 1.538 0.514 0 CA-C-O 121.187 0.518 . . . . 65.34 111.493 178.279 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 41' ' ' ARG . . . . . . . . . . . . . 80.4 mtt-85 -107.13 13.84 26.93 Favored 'General case' 0 CA--C 1.539 0.549 0 CA-C-N 116.143 -0.48 . . . . 73.35 111.754 -177.454 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 69.0 m 62.78 21.75 12.97 Favored 'General case' 0 N--CA 1.478 0.926 0 CA-C-O 121.022 0.439 . . . . 71.14 112.176 178.937 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 57.1 mt -88.57 147.81 40.5 Favored Pre-proline 0 CA--C 1.54 0.575 0 CA-C-N 116.224 -0.443 . . . . 74.03 111.516 -179.563 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 44' ' ' PRO . . . . . 0.527 ' HD2' ' HD3' ' A' ' 55' ' ' ARG . 51.8 Cg_exo -55.47 117.48 4.09 Favored 'Trans proline' 0 C--N 1.353 0.799 0 C-N-CA 122.888 2.392 . . . . 71.01 113.607 177.176 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 33.4 m -92.21 -18.38 7.25 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.579 0 CA-C-N 116.251 -0.431 . . . . 71.02 112.007 -179.944 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 57.2 m -84.51 50.44 1.89 Allowed 'General case' 0 N--CA 1.473 0.705 0 CA-C-O 120.993 0.425 . . . . 71.5 112.025 -177.634 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . -125.16 165.71 18.19 Favored Glycine 0 CA--C 1.526 0.722 0 C-N-CA 121.406 -0.426 . . . . 51.43 112.58 175.486 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 48' ' ' THR . . . . . 0.516 ' O ' ' HG ' ' A' ' 52' ' ' LEU . 68.7 p -76.09 165.05 25.5 Favored 'General case' 0 N--CA 1.472 0.64 0 O-C-N 122.517 -0.402 . . . . 54.15 111.801 178.808 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 49' ' ' LYS . . . . . 0.434 ' O ' HG13 ' A' ' 53' ' ' ILE . 26.7 tptp -44.97 -53.77 7.31 Favored 'General case' 0 N--CA 1.474 0.728 0 C-N-CA 123.234 0.614 . . . . 65.34 112.549 -174.994 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 50' ' ' THR . . . . . . . . . . . . . 60.1 m -62.0 -42.97 99.73 Favored 'General case' 0 N--CA 1.47 0.575 0 CA-C-N 116.617 -0.265 . . . . 72.02 111.703 -179.841 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 44.2 mt-10 -57.4 -41.87 81.13 Favored 'General case' 0 N--CA 1.471 0.622 0 CA-C-O 120.927 0.394 . . . . 72.0 110.933 177.88 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 52' ' ' LEU . . . . . 0.516 ' HG ' ' O ' ' A' ' 48' ' ' THR . 39.1 mt -63.7 -43.21 97.27 Favored 'General case' 0 CA--C 1.539 0.549 0 CA-C-N 116.194 -0.457 . . . . 71.44 111.152 179.376 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 53' ' ' ILE . . . . . 0.434 HG13 ' O ' ' A' ' 49' ' ' LYS . 68.2 mt -65.2 -51.72 61.87 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.524 0 CA-C-N 116.281 -0.418 . . . . 72.15 111.529 -179.917 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 43.7 mt-10 -57.69 -44.47 85.85 Favored 'General case' 0 N--CA 1.47 0.553 0 CA-C-O 120.968 0.413 . . . . 65.32 110.997 177.663 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 55' ' ' ARG . . . . . 0.527 ' HD3' ' HD2' ' A' ' 44' ' ' PRO . 37.2 ttm180 -57.42 -46.49 83.48 Favored 'General case' 0 CA--C 1.539 0.53 0 CA-C-N 115.847 -0.615 . . . . 71.23 111.955 179.496 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 56' ' ' LEU . . . . . 0.449 ' HB3' HD13 ' A' ' 22' ' ' LEU . 77.8 mt -63.78 -49.1 74.28 Favored 'General case' 0 CA--C 1.538 0.485 0 CA-C-O 120.773 0.32 . . . . 52.12 111.725 177.647 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 57' ' ' ARG . . . . . 0.42 ' O ' ' HB2' ' A' ' 61' ' ' ASP . 32.8 mtm180 -64.54 -37.58 88.05 Favored 'General case' 0 CA--C 1.539 0.529 0 N-CA-C 111.83 0.307 . . . . 75.54 111.83 -178.698 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -73.71 -34.57 64.87 Favored 'General case' 0 N--CA 1.47 0.542 0 CA-C-O 121.165 0.507 . . . . 71.14 111.393 178.933 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 59' ' ' TYR . . . . . . . . . . . . . 85.3 t80 -64.43 -55.83 18.31 Favored 'General case' 0 CA--C 1.537 0.453 0 CA-C-O 121.034 0.445 . . . . 74.32 110.701 175.983 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 60' ' ' GLN . . . . . 0.519 ' HB2' HD12 ' A' ' 22' ' ' LEU . 57.0 tp60 -59.99 -38.53 82.84 Favored 'General case' 0 CA--C 1.539 0.544 0 CA-C-N 116.087 -0.506 . . . . 63.34 111.426 178.049 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 61' ' ' ASP . . . . . 0.42 ' HB2' ' O ' ' A' ' 57' ' ' ARG . 15.8 t70 -54.54 -56.71 16.07 Favored 'General case' 0 CA--C 1.541 0.626 0 CA-C-N 116.107 -0.497 . . . . 64.33 112.086 179.107 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 62' ' ' GLN . . . . . . . . . . . . . 11.3 pt20 . . . . . 0 CA--C 1.541 0.619 0 N-CA-C 112.941 0.719 . . . . 65.13 112.941 -173.473 . . . . . . . . 0 0 . 1 . 013 nuclear build core ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 88.5 mt . . . . . 0 CA--C 1.542 0.648 0 N-CA-C 111.675 0.25 . . . . 72.31 111.675 . . . . . . . . . 0 0 . 1 . 013 nuclear build core ' A' A ' 23' ' ' PRO . . . . . 0.473 ' O ' ' HG ' ' A' ' 26' ' ' LEU . 15.6 Cg_exo -68.74 114.21 3.46 Favored 'Trans proline' 0 CA--C 1.541 0.84 0 C-N-CA 122.418 2.079 . . . . 72.33 111.767 172.612 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -47.02 -30.68 2.77 Favored 'General case' 0 N--CA 1.474 0.771 0 N-CA-C 113.122 0.786 . . . . 71.13 113.122 -176.781 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 25' ' ' ASN . . . . . 0.484 ' HB3' ' HB3' ' A' ' 28' ' ' ASP . 14.4 m120 -82.34 33.84 0.41 Allowed 'General case' 0 CA--C 1.545 0.786 0 N-CA-C 112.465 0.542 . . . . 74.44 112.465 -178.719 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 26' ' ' LEU . . . . . 0.473 ' HG ' ' O ' ' A' ' 23' ' ' PRO . 85.6 mt -50.75 -56.84 10.17 Favored 'General case' 0 N--CA 1.476 0.829 0 N-CA-C 112.221 0.452 . . . . 52.21 112.221 179.128 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 15.5 t70 -64.59 -22.54 67.0 Favored 'General case' 0 CA--C 1.544 0.741 0 CA-C-O 120.893 0.378 . . . . 75.23 111.753 -177.768 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 28' ' ' ASP . . . . . 0.484 ' HB3' ' HB3' ' A' ' 25' ' ' ASN . 26.0 t70 -74.56 -34.18 62.86 Favored 'General case' 0 CA--C 1.54 0.591 0 CA-C-N 116.385 -0.371 . . . . 73.42 111.431 178.885 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 29' ' ' MET . . . . . . . . . . . . . 49.4 mtm -73.92 150.97 40.53 Favored 'General case' 0 CA--C 1.537 0.448 0 CA-C-O 121.048 0.451 . . . . 74.31 111.486 -179.694 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 52.0 mtmt -69.12 153.77 43.17 Favored 'General case' 0 CA--C 1.537 0.479 0 CA-C-N 116.162 -0.472 . . . . 73.24 111.822 -178.049 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 31' ' ' VAL . . . . . 0.423 HG13 HD11 ' A' ' 52' ' ' LEU . 91.7 t -49.09 -43.37 15.53 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.679 0 N-CA-C 112.316 0.488 . . . . 72.13 112.316 -177.75 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -58.96 -44.03 91.39 Favored 'General case' 0 N--CA 1.47 0.574 0 CA-C-O 120.814 0.34 . . . . 75.52 111.756 176.687 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 47.3 mt-10 -63.61 -36.36 83.57 Favored 'General case' 0 N--CA 1.47 0.56 0 CA-C-O 120.928 0.394 . . . . 71.25 111.079 178.73 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 34' ' ' LEU . . . . . 0.457 HD21 ' O ' ' A' ' 26' ' ' LEU . 89.4 mt -69.06 -40.83 78.28 Favored 'General case' 0 CA--C 1.539 0.537 0 CA-C-O 120.923 0.392 . . . . 73.51 111.339 176.372 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 94.6 mttt -67.56 -28.15 67.55 Favored 'General case' 0 CA--C 1.536 0.433 0 CA-C-O 120.873 0.368 . . . . 50.31 110.82 174.844 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 53.2 tp60 -64.68 -44.12 91.36 Favored 'General case' 0 N--CA 1.469 0.512 0 N-CA-C 109.89 -0.411 . . . . 70.12 109.89 172.912 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 37' ' ' GLU . . . . . 0.455 ' HB3' ' NH2' ' A' ' 41' ' ' ARG . 55.9 mm-40 -53.23 -40.9 64.89 Favored 'General case' 0 N--CA 1.471 0.607 0 CA-C-N 115.971 -0.559 . . . . 75.12 111.473 174.636 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 38' ' ' LEU . . . . . 0.525 HD13 ' O ' ' A' ' 44' ' ' PRO . 96.6 mt -70.53 -57.48 4.72 Favored 'General case' 0 CA--C 1.538 0.499 0 CA-C-N 115.958 -0.564 . . . . 71.43 112.129 -179.874 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 17.8 ptpt -59.54 -39.13 82.96 Favored 'General case' 0 N--CA 1.472 0.648 0 N-CA-C 112.265 0.469 . . . . 74.13 112.265 -173.99 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 86.0 mt -64.62 -13.6 54.32 Favored 'General case' 0 N--CA 1.473 0.691 0 N-CA-C 112.1 0.408 . . . . 73.52 112.1 179.826 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 41' ' ' ARG . . . . . 0.455 ' NH2' ' HB3' ' A' ' 37' ' ' GLU . 39.0 mtm-85 -124.83 25.59 7.35 Favored 'General case' 0 CA--C 1.543 0.679 0 CA-C-O 120.838 0.351 . . . . 61.45 111.526 179.506 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 73.3 m 63.58 32.44 14.05 Favored 'General case' 0 N--CA 1.48 1.035 0 N-CA-C 113.118 0.785 . . . . 54.44 113.118 174.175 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 43' ' ' LEU . . . . . 0.42 ' HA ' ' HD3' ' A' ' 44' ' ' PRO . 71.6 mt -104.02 145.41 30.6 Favored Pre-proline 0 CA--C 1.544 0.741 0 CA-C-O 120.712 0.292 . . . . 53.13 111.731 178.226 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 44' ' ' PRO . . . . . 0.525 ' O ' HD13 ' A' ' 38' ' ' LEU . 32.1 Cg_exo -62.44 135.59 54.36 Favored 'Trans proline' 0 C--N 1.354 0.849 0 C-N-CA 122.724 2.283 . . . . 54.4 112.898 178.662 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 45' ' ' VAL . . . . . 0.465 HG12 ' HB2' ' A' ' 38' ' ' LEU . 33.1 m -109.39 12.1 8.8 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.853 0 N-CA-C 112.55 0.574 . . . . 71.3 112.55 -176.524 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 46.8 m -79.7 9.17 5.4 Favored 'General case' 0 N--CA 1.476 0.841 0 N-CA-C 113.22 0.822 . . . . 54.31 113.22 -173.869 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . -106.21 170.82 17.0 Favored Glycine 0 CA--C 1.529 0.909 0 C-N-CA 120.797 -0.716 . . . . 43.41 113.911 -178.966 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 48' ' ' THR . . . . . 0.614 ' O ' ' HG ' ' A' ' 52' ' ' LEU . 74.9 p -83.21 178.04 8.27 Favored 'General case' 0 N--CA 1.472 0.645 0 C-N-CA 122.494 0.318 . . . . 73.23 111.446 176.627 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 88.5 tttt -46.42 -47.02 19.05 Favored 'General case' 0 CA--C 1.545 0.782 0 N-CA-C 112.755 0.65 . . . . 71.03 112.755 -175.903 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 50' ' ' THR . . . . . . . . . . . . . 56.7 m -64.43 -44.53 90.87 Favored 'General case' 0 N--CA 1.474 0.775 0 CA-C-O 120.714 0.292 . . . . 75.21 111.243 178.752 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 23.4 mm-40 -55.75 -44.64 77.78 Favored 'General case' 0 N--CA 1.473 0.717 0 CA-C-O 121.167 0.508 . . . . 74.11 111.28 177.101 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 52' ' ' LEU . . . . . 0.614 ' HG ' ' O ' ' A' ' 48' ' ' THR . 28.9 mt -57.63 -51.83 67.89 Favored 'General case' 0 N--CA 1.469 0.491 0 CA-C-N 115.773 -0.649 . . . . 70.33 111.607 -177.771 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 53' ' ' ILE . . . . . 0.401 ' O ' ' HG3' ' A' ' 57' ' ' ARG . 68.2 mt -60.47 -52.54 60.29 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.457 0 CA-C-N 116.352 -0.385 . . . . 65.44 111.772 179.887 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 33.7 mt-10 -60.73 -34.01 73.77 Favored 'General case' 0 N--CA 1.471 0.586 0 CA-C-O 120.931 0.396 . . . . 63.14 111.595 -178.949 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -64.82 -42.87 94.62 Favored 'General case' 0 CA--C 1.54 0.573 0 CA-C-O 121.221 0.534 . . . . 75.14 110.408 177.87 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 56' ' ' LEU . . . . . 0.413 HD22 HH21 ' A' ' 41' ' ' ARG . 97.3 mt -61.45 -46.13 91.37 Favored 'General case' 0 N--CA 1.47 0.53 0 CA-C-N 115.988 -0.551 . . . . 74.31 111.001 174.214 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 57' ' ' ARG . . . . . 0.401 ' HG3' ' O ' ' A' ' 53' ' ' ILE . 66.8 mtp180 -60.67 -36.04 77.73 Favored 'General case' 0 CA--C 1.544 0.73 0 CA-C-N 116.382 -0.372 . . . . 74.23 111.707 179.563 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -67.76 -39.02 84.19 Favored 'General case' 0 N--CA 1.472 0.654 0 CA-C-O 121.1 0.476 . . . . 65.3 111.12 175.797 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 59' ' ' TYR . . . . . . . . . . . . . 75.2 t80 -62.74 -44.82 95.22 Favored 'General case' 0 CA--C 1.542 0.661 0 CA-C-N 116.215 -0.448 . . . . 71.23 111.154 175.772 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 60' ' ' GLN . . . . . . . . . . . . . 15.5 mm100 -65.18 -45.78 83.45 Favored 'General case' 0 N--CA 1.471 0.584 0 CA-C-O 121.12 0.486 . . . . 74.25 111.501 177.494 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 61' ' ' ASP . . . . . . . . . . . . . 27.1 t70 -47.13 -38.83 12.26 Favored 'General case' 0 CA--C 1.543 0.704 0 CA-C-N 115.565 -0.743 . . . . 70.24 112.892 -178.231 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 62' ' ' GLN . . . . . . . . . . . . . 9.6 pt20 . . . . . 0 CA--C 1.544 0.725 0 N-CA-C 112.954 0.724 . . . . 74.13 112.954 -175.612 . . . . . . . . 0 0 . 1 . 014 nuclear build core ' A' A ' 22' ' ' LEU . . . . . 0.548 ' HG ' ' HG3' ' A' ' 60' ' ' GLN . 94.3 mt . . . . . 0 N--CA 1.47 0.568 0 N-CA-C 111.955 0.354 . . . . 72.42 111.955 . . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 23' ' ' PRO . . . . . 0.62 ' O ' ' HG ' ' A' ' 26' ' ' LEU . 22.9 Cg_exo -64.85 125.51 14.9 Favored 'Trans proline' 0 CA--C 1.538 0.701 0 C-N-CA 122.626 2.217 . . . . 71.53 111.773 173.269 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -56.27 -23.96 39.82 Favored 'General case' 0 CA--C 1.542 0.656 0 N-CA-C 112.934 0.716 . . . . 72.31 112.934 -176.339 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 3.7 m-20 -82.23 19.21 1.23 Allowed 'General case' 0 CA--C 1.545 0.772 0 N-CA-C 113.314 0.857 . . . . 72.24 113.314 -177.063 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 26' ' ' LEU . . . . . 0.62 ' HG ' ' O ' ' A' ' 23' ' ' PRO . 77.8 mt -50.32 -47.77 55.61 Favored 'General case' 0 N--CA 1.479 0.996 0 O-C-N 121.946 -0.471 . . . . 74.24 111.771 176.86 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 27' ' ' ASP . . . . . 0.442 ' HB3' HD13 ' A' ' 53' ' ' ILE . 1.0 OUTLIER -71.59 -28.7 64.0 Favored 'General case' 0 CA--C 1.539 0.551 0 N-CA-C 112.246 0.461 . . . . 62.3 112.246 179.055 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 34.6 t70 -77.31 -24.15 50.94 Favored 'General case' 0 CA--C 1.544 0.745 0 N-CA-C 111.725 0.268 . . . . 63.11 111.725 -179.784 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 29' ' ' MET . . . . . . . . . . . . . 68.8 mtm -79.07 -178.26 6.04 Favored 'General case' 0 CA--C 1.539 0.55 0 CA-C-O 121.296 0.569 . . . . 70.43 111.95 178.484 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 28.2 mtpp -87.37 165.23 15.75 Favored 'General case' 0 CA--C 1.539 0.523 0 CA-C-O 121.225 0.536 . . . . 71.14 112.094 -177.206 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 42.3 t -62.16 -42.63 95.88 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.556 0 CA-C-N 116.215 -0.448 . . . . 71.23 111.218 179.574 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -54.98 -39.03 68.55 Favored 'General case' 0 CA--C 1.539 0.542 0 CA-C-N 116.163 -0.471 . . . . 73.0 112.193 179.004 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 22.5 mm-40 -60.34 -48.43 81.76 Favored 'General case' 0 N--CA 1.469 0.507 0 CA-C-O 120.933 0.397 . . . . 72.03 111.177 177.954 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 34' ' ' LEU . . . . . 0.434 ' O ' ' HG ' ' A' ' 38' ' ' LEU . 67.8 mt -58.89 -47.04 86.36 Favored 'General case' 0 N--CA 1.468 0.438 0 CA-C-O 121.174 0.511 . . . . 73.52 111.169 178.289 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 35' ' ' LYS . . . . . 0.531 ' HA ' HD12 ' A' ' 38' ' ' LEU . 7.4 mtpm? -58.02 -37.75 74.91 Favored 'General case' 0 CA--C 1.541 0.619 0 CA-C-N 115.969 -0.559 . . . . 65.13 111.258 177.745 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 19.6 tm0? -68.88 -42.73 76.58 Favored 'General case' 0 CA--C 1.544 0.731 0 CA-C-O 120.957 0.408 . . . . 73.24 110.209 177.053 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 37' ' ' GLU . . . . . 0.471 ' HB3' HH21 ' A' ' 41' ' ' ARG . 36.9 mm-40 -58.57 -29.88 66.73 Favored 'General case' 0 N--CA 1.474 0.738 0 CA-C-N 116.287 -0.415 . . . . 64.14 111.937 176.166 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 38' ' ' LEU . . . . . 0.547 HD11 HD22 ' A' ' 52' ' ' LEU . 78.7 mt -73.95 -54.85 7.02 Favored 'General case' 0 CA--C 1.541 0.62 0 CA-C-N 116.137 -0.483 . . . . 74.33 112.126 -179.051 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -57.04 -31.16 64.87 Favored 'General case' 0 N--CA 1.476 0.854 0 N-CA-C 112.423 0.527 . . . . 52.32 112.423 -176.57 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 98.6 mt -61.34 -36.16 79.4 Favored 'General case' 0 N--CA 1.471 0.608 0 CA-C-O 121.235 0.54 . . . . 73.55 111.427 177.366 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 41' ' ' ARG . . . . . 0.471 HH21 ' HB3' ' A' ' 37' ' ' GLU . 13.9 mtm180 -109.03 27.24 9.71 Favored 'General case' 0 CA--C 1.542 0.649 0 CA-C-N 116.002 -0.545 . . . . 73.02 112.307 -175.949 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 38.3 t 68.98 12.63 8.67 Favored 'General case' 0 N--CA 1.48 1.059 0 N-CA-C 112.578 0.585 . . . . 72.1 112.578 173.566 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 71.9 mt -87.47 148.11 43.53 Favored Pre-proline 0 CA--C 1.542 0.661 0 O-C-N 122.333 -0.23 . . . . 72.42 111.137 -179.971 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 44' ' ' PRO . . . . . 0.444 ' O ' HD13 ' A' ' 38' ' ' LEU . 67.9 Cg_endo -70.73 125.35 11.55 Favored 'Trans proline' 0 C--N 1.352 0.752 0 C-N-CA 122.284 1.989 . . . . 71.14 112.637 -177.895 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 45' ' ' VAL . . . . . 0.451 HG12 ' O ' ' A' ' 35' ' ' LYS . 30.5 m -76.72 27.42 0.04 OUTLIER 'Isoleucine or valine' 0 CA--C 1.546 0.808 0 N-CA-C 112.936 0.717 . . . . 74.41 112.936 -176.108 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 68.7 m -123.65 130.51 52.77 Favored 'General case' 0 N--CA 1.471 0.595 0 CA-C-O 121.231 0.539 . . . . 75.24 111.777 -178.428 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 152.29 164.12 12.1 Favored Glycine 0 CA--C 1.528 0.906 0 CA-C-N 115.363 -0.835 . . . . 73.54 112.045 -179.182 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 48' ' ' THR . . . . . 0.424 ' O ' ' HG ' ' A' ' 52' ' ' LEU . 44.1 p -77.09 162.16 27.7 Favored 'General case' 0 N--CA 1.475 0.806 0 CA-C-N 117.629 0.714 . . . . 73.0 111.786 -179.8 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 49' ' ' LYS . . . . . 0.499 ' O ' HG13 ' A' ' 53' ' ' ILE . 24.2 tptm -44.26 -61.57 1.46 Allowed 'General case' 0 N--CA 1.472 0.651 0 CA-C-N 116.032 -0.531 . . . . 72.12 112.154 -178.883 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 50' ' ' THR . . . . . 0.474 ' HA ' HD12 ' A' ' 53' ' ' ILE . 34.6 m -56.59 -45.48 81.37 Favored 'General case' 0 N--CA 1.472 0.643 0 N-CA-C 112.129 0.418 . . . . 73.21 112.129 -176.718 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 48.0 mt-10 -66.09 -41.0 91.24 Favored 'General case' 0 CA--C 1.536 0.433 0 N-CA-C 112.248 0.462 . . . . 75.31 112.248 -176.441 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 52' ' ' LEU . . . . . 0.547 HD22 HD11 ' A' ' 38' ' ' LEU . 62.6 mt -62.8 -42.02 99.54 Favored 'General case' 0 N--CA 1.469 0.517 0 CA-C-O 121.046 0.45 . . . . 70.24 111.24 179.024 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 53' ' ' ILE . . . . . 0.499 HG13 ' O ' ' A' ' 49' ' ' LYS . 35.1 mt -58.02 -54.64 29.38 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.435 0 CA-C-O 121.365 0.603 . . . . 62.24 110.914 176.68 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 54.1 mm-40 -67.23 -24.64 65.84 Favored 'General case' 0 CA--C 1.535 0.39 0 CA-C-N 115.935 -0.575 . . . . 70.42 111.876 179.363 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 37.1 ttm180 -67.06 -45.83 76.2 Favored 'General case' 0 N--CA 1.467 0.419 0 CA-C-O 120.991 0.424 . . . . 73.44 110.408 175.637 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 83.0 mt -60.72 -48.65 80.85 Favored 'General case' 0 CA--C 1.539 0.522 0 CA-C-O 121.125 0.488 . . . . 74.44 111.079 174.925 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 65.7 mtt180 -62.03 -38.25 87.99 Favored 'General case' 0 N--CA 1.469 0.5 0 CA-C-N 116.194 -0.457 . . . . 74.42 111.555 178.246 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -66.08 -40.56 90.94 Favored 'General case' 0 CA--C 1.534 0.328 0 CA-C-O 120.884 0.373 . . . . 73.51 111.068 177.352 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 59' ' ' TYR . . . . . 0.436 ' O ' ' HG2' ' A' ' 62' ' ' GLN . 71.1 t80 -58.91 -48.42 81.53 Favored 'General case' 0 CA--C 1.538 0.494 0 CA-C-N 116.144 -0.48 . . . . 73.24 110.987 177.457 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 60' ' ' GLN . . . . . 0.548 ' HG3' ' HG ' ' A' ' 22' ' ' LEU . 86.4 mm-40 -63.35 -42.54 98.93 Favored 'General case' 0 CA--C 1.539 0.537 0 CA-C-O 120.747 0.308 . . . . 71.25 111.275 175.861 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 61' ' ' ASP . . . . . . . . . . . . . 27.0 t70 -56.81 -47.69 79.68 Favored 'General case' 0 CA--C 1.541 0.6 0 N-CA-C 112.022 0.379 . . . . 74.53 112.022 179.498 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 62' ' ' GLN . . . . . 0.436 ' HG2' ' O ' ' A' ' 59' ' ' TYR . 14.2 pt20 . . . . . 0 CA--C 1.539 0.544 0 N-CA-C 112.026 0.38 . . . . 75.22 112.026 -177.343 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 22' ' ' LEU . . . . . 0.426 ' HA ' ' HD3' ' A' ' 23' ' ' PRO . 99.4 mt . . . . . 0 CA--C 1.536 0.436 0 N-CA-C 111.943 0.349 . . . . 65.23 111.943 . . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 23' ' ' PRO . . . . . 0.54 ' O ' ' HG ' ' A' ' 26' ' ' LEU . 11.4 Cg_exo -73.69 152.34 47.69 Favored 'Trans proline' 0 CA--C 1.543 0.937 0 C-N-CA 122.985 2.456 . . . . 72.21 112.681 173.685 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -73.81 -19.44 60.75 Favored 'General case' 0 N--CA 1.471 0.619 0 CA-C-O 121.279 0.562 . . . . 72.54 111.088 175.567 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 83.9 m-20 -84.41 24.12 1.02 Allowed 'General case' 0 CA--C 1.541 0.625 0 N-CA-C 112.986 0.736 . . . . 72.15 112.986 -179.486 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 26' ' ' LEU . . . . . 0.54 ' HG ' ' O ' ' A' ' 23' ' ' PRO . 67.2 mt -52.88 -37.4 60.44 Favored 'General case' 0 N--CA 1.479 1.018 0 CA-C-N 118.327 0.512 . . . . 52.41 111.615 179.221 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 4.3 m-20 -68.55 -36.31 78.62 Favored 'General case' 0 CA--C 1.544 0.722 0 CA-C-O 121.278 0.561 . . . . 74.44 111.544 177.707 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 9.1 m-20 -76.32 -37.47 57.35 Favored 'General case' 0 CA--C 1.538 0.509 0 CA-C-N 116.165 -0.471 . . . . 75.23 111.681 179.202 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 29' ' ' MET . . . . . . . . . . . . . 81.4 mtp -59.68 141.78 54.38 Favored 'General case' 0 N--CA 1.466 0.373 0 CA-C-N 115.871 -0.604 . . . . 72.41 112.546 -175.07 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 30' ' ' LYS . . . . . 0.566 ' HB2' ' HG2' ' A' ' 33' ' ' GLU . 48.3 mtmt -68.94 149.38 48.91 Favored 'General case' 0 CA--C 1.539 0.52 0 CA-C-N 115.545 -0.752 . . . . 71.0 111.992 -179.725 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 90.0 t -48.24 -44.47 12.67 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.724 0 CA-C-N 115.868 -0.606 . . . . 62.25 112.194 -179.797 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -61.25 -39.67 91.21 Favored 'General case' 0 N--CA 1.469 0.523 0 N-CA-C 112.12 0.415 . . . . 41.42 112.12 179.252 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 33' ' ' GLU . . . . . 0.566 ' HG2' ' HB2' ' A' ' 30' ' ' LYS . 16.3 mm-40 -68.23 -37.32 80.7 Favored 'General case' 0 N--CA 1.467 0.424 0 CA-C-O 120.971 0.415 . . . . 74.43 111.23 -178.779 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 83.2 mt -61.49 -45.99 91.88 Favored 'General case' 0 CA--C 1.538 0.481 0 CA-C-O 121.23 0.538 . . . . 75.43 110.5 175.56 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 35' ' ' LYS . . . . . 0.469 ' HA ' HD12 ' A' ' 38' ' ' LEU . 96.6 mttt -64.82 -29.13 70.08 Favored 'General case' 0 CA--C 1.539 0.532 0 CA-C-N 116.293 -0.412 . . . . 71.3 111.398 176.684 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 36' ' ' GLN . . . . . 0.505 ' HA ' ' HE3' ' A' ' 39' ' ' LYS . 55.9 tp60 -61.95 -37.39 84.55 Favored 'General case' 0 CA--C 1.539 0.552 0 CA-C-N 116.334 -0.394 . . . . 62.22 111.297 178.256 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 36.6 mt-10 -81.49 -30.2 33.38 Favored 'General case' 0 CA--C 1.539 0.531 0 O-C-N 122.166 -0.334 . . . . 72.13 111.698 176.06 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 38' ' ' LEU . . . . . 0.469 HD12 ' HA ' ' A' ' 35' ' ' LYS . 89.2 mt -58.71 -54.35 48.05 Favored 'General case' 0 N--CA 1.472 0.655 0 CA-C-O 120.741 0.305 . . . . 53.21 111.377 174.94 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 39' ' ' LYS . . . . . 0.505 ' HE3' ' HA ' ' A' ' 36' ' ' GLN . 17.5 ptpt -55.36 -37.13 67.12 Favored 'General case' 0 CA--C 1.543 0.687 0 CA-C-N 116.463 -0.335 . . . . 54.22 111.553 -179.781 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 40' ' ' LEU . . . . . 0.43 ' HG ' ' O ' ' A' ' 36' ' ' GLN . 94.2 mt -69.03 -29.39 67.54 Favored 'General case' 0 CA--C 1.538 0.49 0 N-CA-C 112.002 0.371 . . . . 65.51 112.002 -179.086 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 41' ' ' ARG . . . . . 0.61 HH21 HD23 ' A' ' 56' ' ' LEU . 61.5 mtm180 -105.92 22.82 14.98 Favored 'General case' 0 CA--C 1.542 0.659 0 N-CA-C 112.118 0.414 . . . . 71.44 112.118 -177.78 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 31.1 t 62.69 28.96 16.79 Favored 'General case' 0 N--CA 1.482 1.156 0 CA-C-O 121.33 0.586 . . . . 60.02 112.046 176.133 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 65.3 mt -100.6 148.63 35.24 Favored Pre-proline 0 CA--C 1.543 0.692 0 CA-C-N 116.056 -0.52 . . . . 74.4 111.182 179.125 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 44' ' ' PRO . . . . . . . . . . . . . 56.8 Cg_endo -69.36 130.27 19.53 Favored 'Trans proline' 0 CA--C 1.541 0.852 0 C-N-CA 122.364 2.043 . . . . 55.33 113.094 179.644 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 34.8 m -76.06 -21.77 15.63 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.533 0 CA-C-N 116.153 -0.476 . . . . 52.51 111.618 179.339 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 31.5 t -62.22 101.57 0.23 Allowed 'General case' 0 N--CA 1.473 0.721 0 CA-C-N 116.36 -0.382 . . . . 72.1 111.902 178.501 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 176.89 154.03 11.47 Favored Glycine 0 CA--C 1.532 1.119 0 C-N-CA 120.854 -0.689 . . . . 55.43 114.063 177.516 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 48' ' ' THR . . . . . 0.575 ' O ' ' HG ' ' A' ' 52' ' ' LEU . 44.0 p -76.82 174.06 10.96 Favored 'General case' 0 N--CA 1.476 0.871 0 O-C-N 122.633 -0.333 . . . . 72.13 110.87 174.133 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 49' ' ' LYS . . . . . 0.407 ' HE2' HD11 ' A' ' 53' ' ' ILE . 24.5 tptm -49.85 -49.59 48.64 Favored 'General case' 0 N--CA 1.474 0.745 0 CA-C-O 120.84 0.353 . . . . 75.35 111.357 -179.566 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 50' ' ' THR . . . . . . . . . . . . . 82.7 m -58.27 -50.33 73.98 Favored 'General case' 0 N--CA 1.475 0.783 0 CA-C-O 120.954 0.407 . . . . 70.41 111.317 176.832 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 15.6 mm-40 -54.1 -46.76 72.19 Favored 'General case' 0 N--CA 1.469 0.484 0 CA-C-N 115.846 -0.615 . . . . 64.3 111.803 -179.71 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 52' ' ' LEU . . . . . 0.575 ' HG ' ' O ' ' A' ' 48' ' ' THR . 50.9 mt -63.03 -48.63 77.93 Favored 'General case' 0 CA--C 1.537 0.476 0 CA-C-N 116.304 -0.407 . . . . 73.32 111.309 -178.167 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 53' ' ' ILE . . . . . 0.407 HD11 ' HE2' ' A' ' 49' ' ' LYS . 74.3 mt -59.13 -48.07 88.03 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.568 0 N-CA-C 111.998 0.37 . . . . 61.0 111.998 -179.609 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 54' ' ' GLU . . . . . 0.754 ' HG2' HH21 ' A' ' 57' ' ' ARG . 27.2 mt-10 -68.87 -38.4 79.67 Favored 'General case' 0 CA--C 1.537 0.455 0 O-C-N 122.243 -0.286 . . . . 75.44 111.341 179.49 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 39.7 ttm180 -62.41 -43.83 97.89 Favored 'General case' 0 CA--C 1.539 0.554 0 CA-C-O 120.98 0.419 . . . . 73.33 111.14 177.591 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 56' ' ' LEU . . . . . 0.61 HD23 HH21 ' A' ' 41' ' ' ARG . 48.7 mt -58.76 -51.55 69.51 Favored 'General case' 0 C--O 1.237 0.415 0 CA-C-N 116.206 -0.452 . . . . 75.41 111.057 174.029 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 57' ' ' ARG . . . . . 0.754 HH21 ' HG2' ' A' ' 54' ' ' GLU . 79.0 mtm180 -60.62 -47.59 85.56 Favored 'General case' 0 CA--C 1.538 0.513 0 N-CA-C 112.205 0.446 . . . . 75.31 112.205 -178.761 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -55.12 -51.3 66.88 Favored 'General case' 0 N--CA 1.472 0.646 0 CA-C-O 120.863 0.363 . . . . 63.33 111.936 -178.348 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 59' ' ' TYR . . . . . . . . . . . . . 76.9 t80 -57.56 -41.34 80.84 Favored 'General case' 0 CA--C 1.54 0.596 0 CA-C-O 121.183 0.516 . . . . 61.34 111.59 179.222 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 60' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -74.61 -30.57 61.72 Favored 'General case' 0 N--CA 1.472 0.635 0 CA-C-O 121.381 0.61 . . . . 64.14 110.573 178.857 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 61' ' ' ASP . . . . . . . . . . . . . 8.0 t70 -64.62 -37.16 86.61 Favored 'General case' 0 CA--C 1.541 0.625 0 CA-C-N 115.891 -0.595 . . . . 53.54 111.491 -176.338 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 62' ' ' GLN . . . . . . . . . . . . . 51.5 mt-30 . . . . . 0 CA--C 1.541 0.604 0 N-CA-C 112.129 0.418 . . . . 55.23 112.129 178.872 . . . . . . . . 0 0 . 1 . 016 nuclear build core ' A' A ' 22' ' ' LEU . . . . . 0.449 HD13 ' HB3' ' A' ' 56' ' ' LEU . 94.3 mt . . . . . 0 CA--C 1.538 0.501 0 CA-C-O 120.434 0.159 . . . . 71.44 110.61 . . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 23' ' ' PRO . . . . . 0.468 ' O ' ' HG ' ' A' ' 26' ' ' LEU . 37.8 Cg_endo -64.92 139.22 60.96 Favored 'Trans proline' 0 CA--C 1.54 0.805 0 C-N-CA 122.605 2.204 . . . . 64.11 113.134 -178.386 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -72.15 -2.83 20.12 Favored 'General case' 0 CA--C 1.543 0.694 0 CA-C-O 121.04 0.448 . . . . 71.51 111.874 179.124 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 11.2 m120 -82.54 18.73 1.42 Allowed 'General case' 0 CA--C 1.542 0.658 0 N-CA-C 112.183 0.438 . . . . 73.13 112.183 -178.768 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 26' ' ' LEU . . . . . 0.468 ' HG ' ' O ' ' A' ' 23' ' ' PRO . 90.7 mt -58.18 -40.12 80.67 Favored 'General case' 0 N--CA 1.471 0.612 0 CA-C-O 120.842 0.353 . . . . 70.11 111.84 -178.632 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 7.3 m-20 -63.28 -34.81 78.49 Favored 'General case' 0 CA--C 1.539 0.534 0 CA-C-O 120.978 0.418 . . . . 71.15 111.206 175.283 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 36.6 t70 -72.45 -42.55 64.89 Favored 'General case' 0 CA--C 1.542 0.66 0 CA-C-N 116.255 -0.43 . . . . 74.52 111.533 -178.649 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 29' ' ' MET . . . . . . . . . . . . . 50.2 mtm -68.92 159.81 31.95 Favored 'General case' 0 N--CA 1.471 0.606 0 CA-C-O 121.092 0.472 . . . . 71.23 111.608 179.279 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 54.5 mtpt -88.9 171.43 9.91 Favored 'General case' 0 CA--C 1.54 0.583 0 N-CA-C 112.689 0.626 . . . . 73.25 112.689 -173.623 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 31' ' ' VAL . . . . . 0.474 HG22 ' HD3' ' A' ' 49' ' ' LYS . 86.5 t -56.66 -47.89 81.59 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.615 0 CA-C-N 115.798 -0.637 . . . . 41.11 112.372 -176.74 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -58.67 -38.52 78.37 Favored 'General case' 0 CA--C 1.536 0.426 0 CA-C-N 116.448 -0.342 . . . . 53.25 111.871 -179.353 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 37.4 mt-10 -69.73 -41.86 74.73 Favored 'General case' 0 CA--C 1.537 0.469 0 CA-C-O 121.114 0.483 . . . . 73.44 111.192 179.42 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 95.4 mt -63.34 -47.21 83.11 Favored 'General case' 0 CA--C 1.54 0.559 0 CA-C-N 116.346 -0.388 . . . . 52.43 111.305 178.171 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 35' ' ' LYS . . . . . 0.473 ' HE2' ' O ' ' A' ' 45' ' ' VAL . 98.5 mttt -61.31 -35.66 77.98 Favored 'General case' 0 CA--C 1.537 0.464 0 CA-C-N 116.577 -0.283 . . . . 72.01 111.513 177.598 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 36' ' ' GLN . . . . . 0.499 ' NE2' HD11 ' A' ' 40' ' ' LEU . 22.4 tm0? -60.59 -44.52 96.16 Favored 'General case' 0 CA--C 1.539 0.536 0 CA-C-O 120.868 0.366 . . . . 72.13 110.771 177.38 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 37' ' ' GLU . . . . . 0.594 ' HB3' ' NH2' ' A' ' 41' ' ' ARG . 24.8 mm-40 -64.31 -41.03 97.03 Favored 'General case' 0 CA--C 1.543 0.698 0 CA-C-N 116.329 -0.396 . . . . 74.23 111.884 175.04 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 38' ' ' LEU . . . . . 0.482 ' HB2' HG12 ' A' ' 45' ' ' VAL . 88.5 mt -62.24 -56.01 22.81 Favored 'General case' 0 N--CA 1.472 0.628 0 N-CA-C 112.164 0.431 . . . . 70.34 112.164 179.552 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 18.6 ptpt -57.03 -34.75 68.52 Favored 'General case' 0 N--CA 1.473 0.683 0 N-CA-C 112.582 0.586 . . . . 75.11 112.582 -174.475 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 40' ' ' LEU . . . . . 0.499 HD11 ' NE2' ' A' ' 36' ' ' GLN . 92.7 mt -63.55 -33.5 75.72 Favored 'General case' 0 N--CA 1.473 0.679 0 CA-C-O 120.904 0.383 . . . . 70.53 111.694 177.91 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 41' ' ' ARG . . . . . 0.764 HH21 HD22 ' A' ' 56' ' ' LEU . 70.0 mtm-85 -105.69 23.11 14.4 Favored 'General case' 0 CA--C 1.54 0.565 0 CA-C-N 116.44 -0.346 . . . . 71.42 111.923 -178.013 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 23.2 t 64.48 22.81 12.79 Favored 'General case' 0 N--CA 1.478 0.959 0 N-CA-C 112.317 0.488 . . . . 64.22 112.317 173.134 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 72.5 mt -92.12 134.39 28.65 Favored Pre-proline 0 CA--C 1.546 0.805 0 CA-C-N 116.626 -0.261 . . . . 62.21 111.611 -178.482 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 44' ' ' PRO . . . . . 0.513 ' HD2' ' HD3' ' A' ' 55' ' ' ARG . 77.8 Cg_exo -52.06 115.37 2.12 Favored 'Trans proline' 0 C--N 1.356 0.949 0 C-N-CA 122.994 2.463 . . . . 53.31 113.71 178.638 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 45' ' ' VAL . . . . . 0.482 HG12 ' HB2' ' A' ' 38' ' ' LEU . 33.0 m -85.5 -10.77 11.4 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.608 0 N-CA-C 112.523 0.564 . . . . 71.45 112.523 -178.955 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 33.2 t -80.9 32.3 0.32 Allowed 'General case' 0 N--CA 1.481 1.1 0 N-CA-C 113.064 0.764 . . . . 70.03 113.064 -173.424 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . -107.8 176.45 20.67 Favored Glycine 0 CA--C 1.527 0.833 0 C-N-CA 121.028 -0.606 . . . . 72.24 113.471 179.459 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 48' ' ' THR . . . . . 0.556 ' O ' ' HG ' ' A' ' 52' ' ' LEU . 72.3 p -76.31 163.14 27.3 Favored 'General case' 0 N--CA 1.475 0.812 0 O-C-N 122.668 -0.313 . . . . 72.44 111.372 176.829 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 49' ' ' LYS . . . . . 0.474 ' HD3' HG22 ' A' ' 31' ' ' VAL . 29.6 tptp -44.37 -44.24 8.14 Favored 'General case' 0 N--CA 1.473 0.721 0 CA-C-O 120.962 0.41 . . . . 63.24 111.795 178.169 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 50' ' ' THR . . . . . . . . . . . . . 30.5 m -68.2 -44.79 75.06 Favored 'General case' 0 CA--C 1.538 0.504 0 CA-C-N 116.213 -0.449 . . . . 65.32 111.675 179.037 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 44.0 mt-10 -60.7 -42.47 97.24 Favored 'General case' 0 N--CA 1.471 0.611 0 N-CA-C 111.952 0.352 . . . . 71.2 111.952 179.446 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 52' ' ' LEU . . . . . 0.556 ' HG ' ' O ' ' A' ' 48' ' ' THR . 46.7 mt -54.81 -39.2 68.26 Favored 'General case' 0 N--CA 1.469 0.523 0 CA-C-O 121.504 0.669 . . . . 75.12 110.325 178.457 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 53' ' ' ILE . . . . . . . . . . . . . 88.5 mt -70.25 -58.09 6.34 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.517 0 CA-C-N 115.184 -0.916 . . . . 70.44 111.911 179.287 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 40.6 mt-10 -61.29 -31.7 71.53 Favored 'General case' 0 N--CA 1.468 0.469 0 N-CA-C 111.897 0.332 . . . . 53.34 111.897 -178.019 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 55' ' ' ARG . . . . . 0.513 ' HD3' ' HD2' ' A' ' 44' ' ' PRO . 35.2 ttm180 -65.53 -41.22 93.3 Favored 'General case' 0 CA--C 1.538 0.486 0 CA-C-O 120.76 0.314 . . . . 65.41 111.258 177.187 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 56' ' ' LEU . . . . . 0.764 HD22 HH21 ' A' ' 41' ' ' ARG . 79.6 mt -63.72 -47.7 80.07 Favored 'General case' 0 CA--C 1.537 0.46 0 CA-C-O 121.023 0.44 . . . . 52.01 111.043 174.015 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 74.6 mtp180 -61.67 -43.12 99.45 Favored 'General case' 0 CA--C 1.54 0.583 0 CA-C-N 116.098 -0.501 . . . . 72.12 111.466 179.328 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -64.8 -39.51 93.71 Favored 'General case' 0 N--CA 1.469 0.507 0 CA-C-N 116.419 -0.355 . . . . 33.01 111.673 179.456 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 59' ' ' TYR . . . . . . . . . . . . . 84.8 t80 -64.56 -47.29 79.28 Favored 'General case' 0 CA--C 1.537 0.468 0 CA-C-O 120.977 0.418 . . . . 71.32 110.677 176.371 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 60' ' ' GLN . . . . . . . . . . . . . 61.7 tp60 -60.15 -41.35 92.56 Favored 'General case' 0 CA--C 1.54 0.564 0 CA-C-O 121.092 0.472 . . . . 73.41 110.914 176.664 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 61' ' ' ASP . . . . . . . . . . . . . 26.9 t70 -59.86 -49.4 77.87 Favored 'General case' 0 CA--C 1.543 0.704 0 CA-C-N 115.895 -0.593 . . . . 65.44 111.959 179.863 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 62' ' ' GLN . . . . . . . . . . . . . 10.8 pt20 . . . . . 0 CA--C 1.542 0.64 0 N-CA-C 112.681 0.623 . . . . 65.2 112.681 -176.573 . . . . . . . . 0 0 . 1 . 017 nuclear build core ' A' A ' 22' ' ' LEU . . . . . 0.489 ' HB3' HD11 ' A' ' 26' ' ' LEU . 59.0 mt . . . . . 0 N--CA 1.469 0.486 0 CA-C-O 120.685 0.279 . . . . 73.45 111.714 . . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 23' ' ' PRO . . . . . 0.477 ' O ' ' HG ' ' A' ' 26' ' ' LEU . 53.6 Cg_exo -54.74 143.3 70.71 Favored 'Trans proline' 0 CA--C 1.541 0.833 0 C-N-CA 122.68 2.253 . . . . 74.23 112.523 173.899 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -72.02 -23.47 61.4 Favored 'General case' 0 CA--C 1.538 0.51 0 N-CA-C 112.36 0.504 . . . . 63.11 112.36 -177.547 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 25' ' ' ASN . . . . . 0.561 ' HB3' ' HB3' ' A' ' 28' ' ' ASP . 47.8 m-80 -102.13 27.13 6.91 Favored 'General case' 0 CA--C 1.543 0.702 0 N-CA-C 113.063 0.764 . . . . 75.15 113.063 -175.964 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 26' ' ' LEU . . . . . 0.489 HD11 ' HB3' ' A' ' 22' ' ' LEU . 71.5 mt -49.83 -42.37 47.13 Favored 'General case' 0 N--CA 1.479 1.017 0 CA-C-O 120.976 0.417 . . . . 65.12 111.973 177.738 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 3.7 m-20 -66.81 -35.11 79.31 Favored 'General case' 0 CA--C 1.543 0.676 0 CA-C-O 121.13 0.49 . . . . 75.22 111.286 178.402 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 28' ' ' ASP . . . . . 0.561 ' HB3' ' HB3' ' A' ' 25' ' ' ASN . 21.5 t70 -73.07 -31.49 64.42 Favored 'General case' 0 CA--C 1.542 0.649 0 CA-C-N 116.18 -0.464 . . . . 63.43 111.239 -179.732 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 29' ' ' MET . . . . . 0.463 ' HG3' ' O ' ' A' ' 25' ' ' ASN . 86.9 mtp -63.84 156.31 27.85 Favored 'General case' 0 CA--C 1.541 0.604 0 CA-C-O 121.434 0.635 . . . . 52.55 112.288 -177.531 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 30' ' ' LYS . . . . . 0.454 ' HB2' ' HG3' ' A' ' 33' ' ' GLU . 55.3 mtpt -80.82 157.78 25.62 Favored 'General case' 0 CA--C 1.538 0.515 0 CA-C-N 116.012 -0.54 . . . . 74.14 111.836 -178.643 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 31' ' ' VAL . . . . . 0.584 HG22 ' HB2' ' A' ' 49' ' ' LYS . 16.0 t -52.14 -50.77 34.61 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.614 0 CA-C-N 115.961 -0.563 . . . . 74.14 112.188 -176.61 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -64.1 -27.69 69.26 Favored 'General case' 0 CA--C 1.539 0.546 0 N-CA-C 112.435 0.532 . . . . 75.42 112.435 -179.714 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 33' ' ' GLU . . . . . 0.454 ' HG3' ' HB2' ' A' ' 30' ' ' LYS . 40.6 mt-10 -72.92 -42.36 63.6 Favored 'General case' 0 N--CA 1.469 0.51 0 CA-C-O 120.899 0.381 . . . . 74.44 110.809 179.248 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 84.8 mt -59.94 -35.22 74.46 Favored 'General case' 0 N--CA 1.469 0.522 0 CA-C-O 121.308 0.575 . . . . 65.41 110.805 174.898 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 35' ' ' LYS . . . . . 0.499 ' HE3' HG12 ' A' ' 31' ' ' VAL . 99.3 mttt -64.89 -30.14 71.12 Favored 'General case' 0 CA--C 1.537 0.473 0 CA-C-N 115.998 -0.546 . . . . 62.32 111.668 176.262 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 57.2 tp60 -66.73 -44.15 82.32 Favored 'General case' 0 CA--C 1.539 0.545 0 CA-C-O 120.934 0.397 . . . . 72.4 110.402 173.954 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 14.1 mm-40 -54.8 -51.9 64.34 Favored 'General case' 0 N--CA 1.471 0.575 0 CA-C-O 121.425 0.631 . . . . 65.31 110.895 173.887 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 38' ' ' LEU . . . . . 0.452 ' CD1' HD22 ' A' ' 52' ' ' LEU . 90.6 mt -58.74 -53.46 58.08 Favored 'General case' 0 CA--C 1.541 0.628 0 N-CA-C 113.207 0.817 . . . . 61.11 113.207 -176.773 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 18.2 ptpt -59.09 -33.67 71.1 Favored 'General case' 0 N--CA 1.474 0.768 0 N-CA-C 112.511 0.559 . . . . 72.11 112.511 -174.462 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 97.4 mt -67.8 -10.83 56.16 Favored 'General case' 0 N--CA 1.471 0.603 0 CA-C-O 121.072 0.463 . . . . 75.22 111.532 178.264 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 41' ' ' ARG . . . . . . . . . . . . . 33.8 mtt180 -123.1 15.77 9.91 Favored 'General case' 0 CA--C 1.54 0.564 0 CA-C-N 116.182 -0.463 . . . . 75.54 111.121 -177.058 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 69.8 m 60.85 31.56 20.04 Favored 'General case' 0 N--CA 1.476 0.862 0 CA-C-N 116.192 -0.458 . . . . 45.43 111.868 -179.224 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 43' ' ' LEU . . . . . 0.404 ' HB3' HD22 ' A' ' 38' ' ' LEU . 83.7 mt -98.6 137.2 20.61 Favored Pre-proline 0 CA--C 1.543 0.676 0 CA-C-N 116.488 -0.324 . . . . 74.42 111.378 179.443 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 44' ' ' PRO . . . . . . . . . . . . . 32.0 Cg_endo -64.06 130.12 26.42 Favored 'Trans proline' 0 CA--C 1.543 0.971 0 C-N-CA 122.941 2.427 . . . . 72.41 113.122 -178.746 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 45' ' ' VAL . . . . . 0.415 HG12 ' HB2' ' A' ' 38' ' ' LEU . 23.0 m -102.34 15.04 5.69 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.725 0 CA-C-N 115.953 -0.567 . . . . 71.2 112.027 -176.154 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 29.6 t -68.47 -43.12 77.68 Favored 'General case' 0 N--CA 1.474 0.733 0 N-CA-C 113.479 0.918 . . . . 73.51 113.479 -174.053 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . -71.52 179.97 32.41 Favored Glycine 0 CA--C 1.528 0.903 0 N-CA-C 115.393 0.917 . . . . 43.14 115.393 -170.898 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 48' ' ' THR . . . . . 0.575 ' O ' ' HG ' ' A' ' 52' ' ' LEU . 69.4 p -77.05 170.6 16.24 Favored 'General case' 0 N--CA 1.471 0.582 0 C-N-CA 122.86 0.464 . . . . 74.43 111.647 178.365 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 49' ' ' LYS . . . . . 0.584 ' HB2' HG22 ' A' ' 31' ' ' VAL . 88.2 tttt -50.53 -51.82 44.25 Favored 'General case' 0 N--CA 1.47 0.563 0 N-CA-C 112.41 0.522 . . . . 75.43 112.41 -176.794 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 50' ' ' THR . . . . . . . . . . . . . 91.5 m -54.9 -44.77 74.43 Favored 'General case' 0 N--CA 1.471 0.6 0 CA-C-O 120.79 0.329 . . . . 71.13 111.141 178.157 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 49.3 mt-10 -59.38 -42.25 91.25 Favored 'General case' 0 N--CA 1.47 0.554 0 CA-C-O 120.973 0.416 . . . . 63.23 111.319 177.066 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 52' ' ' LEU . . . . . 0.575 ' HG ' ' O ' ' A' ' 48' ' ' THR . 32.9 mt -65.38 -47.04 77.73 Favored 'General case' 0 CA--C 1.539 0.545 0 CA-C-N 116.312 -0.404 . . . . 64.43 111.141 -179.655 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 53' ' ' ILE . . . . . . . . . . . . . 66.9 mt -58.14 -50.46 78.16 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.545 0 CA-C-O 120.84 0.352 . . . . 71.51 111.117 178.235 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 47.3 mt-10 -58.35 -41.81 85.52 Favored 'General case' 0 CA--C 1.536 0.413 0 CA-C-N 116.347 -0.388 . . . . 73.33 111.181 177.702 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 41.7 ttm180 -63.3 -40.19 96.67 Favored 'General case' 0 CA--C 1.543 0.703 0 CA-C-N 116.586 -0.279 . . . . 63.42 111.471 178.592 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 78.9 mt -62.13 -51.27 68.54 Favored 'General case' 0 N--CA 1.47 0.544 0 CA-C-O 121.098 0.475 . . . . 53.33 111.366 175.113 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 55.1 mtt180 -74.4 -18.42 60.66 Favored 'General case' 0 CA--C 1.542 0.639 0 CA-C-N 116.268 -0.424 . . . . 70.24 111.999 -178.267 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -76.03 -42.68 47.12 Favored 'General case' 0 N--CA 1.468 0.464 0 CA-C-O 121.162 0.505 . . . . 74.34 110.333 170.596 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 59' ' ' TYR . . . . . . . . . . . . . 48.6 t80 -62.91 -27.35 69.31 Favored 'General case' 0 CA--C 1.54 0.577 0 CA-C-N 115.932 -0.576 . . . . 70.41 110.452 175.32 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 60' ' ' GLN . . . . . 0.478 ' HB2' HD11 ' A' ' 22' ' ' LEU . 59.6 tp60 -76.45 -40.43 50.53 Favored 'General case' 0 CA--C 1.542 0.635 0 CA-C-N 115.919 -0.582 . . . . 65.52 111.664 177.009 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 61' ' ' ASP . . . . . . . . . . . . . 26.8 t70 -56.44 -26.66 54.38 Favored 'General case' 0 CA--C 1.547 0.837 0 N-CA-C 112.211 0.448 . . . . 63.32 112.211 -176.888 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 62' ' ' GLN . . . . . . . . . . . . . 14.1 pt20 . . . . . 0 CA--C 1.546 0.797 0 N-CA-C 112.345 0.498 . . . . 74.22 112.345 -178.791 . . . . . . . . 0 0 . 1 . 018 nuclear build core ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 92.1 mt . . . . . 0 CA--C 1.541 0.602 0 CA-C-O 120.498 0.19 . . . . 75.24 110.989 . . . . . . . . . 0 0 . 1 . 018 nuclear build core ' A' A ' 23' ' ' PRO . . . . . . . . . . . . . 19.2 Cg_endo -59.21 142.24 98.96 Favored 'Trans proline' 0 CA--C 1.54 0.82 0 C-N-CA 122.692 2.261 . . . . 70.02 112.931 -179.818 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -75.26 -24.41 57.61 Favored 'General case' 0 N--CA 1.469 0.49 0 CA-C-O 120.861 0.363 . . . . 54.2 111.833 -179.853 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 85.5 m-20 -86.49 36.67 0.71 Allowed 'General case' 0 CA--C 1.544 0.715 0 N-CA-C 112.873 0.694 . . . . 63.13 112.873 -175.705 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 26' ' ' LEU . . . . . 0.539 HD23 ' SD ' ' A' ' 29' ' ' MET . 87.5 mt -55.74 -29.28 59.29 Favored 'General case' 0 N--CA 1.475 0.795 0 CA-C-O 121.111 0.482 . . . . 65.22 110.856 175.433 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 3.6 m-20 -64.47 -35.33 80.58 Favored 'General case' 0 CA--C 1.541 0.627 0 CA-C-N 116.073 -0.512 . . . . 65.05 111.343 176.019 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 31.3 m-20 -81.71 -22.28 37.48 Favored 'General case' 0 CA--C 1.537 0.467 0 CA-C-O 121.062 0.458 . . . . 65.31 111.306 177.452 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 29' ' ' MET . . . . . 0.539 ' SD ' HD23 ' A' ' 26' ' ' LEU . 85.1 mtp -72.47 124.42 25.15 Favored 'General case' 0 CA--C 1.536 0.436 0 CA-C-O 120.958 0.409 . . . . 75.42 110.512 175.104 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 61.1 mtpt -72.42 170.53 14.08 Favored 'General case' 0 CA--C 1.537 0.459 0 CA-C-O 120.988 0.423 . . . . 72.22 111.807 -177.04 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 45.8 t -53.19 -46.76 56.41 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.659 0 CA-C-N 116.039 -0.528 . . . . 72.04 111.8 -175.475 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -61.45 -40.55 94.89 Favored 'General case' 0 N--CA 1.469 0.507 0 N-CA-C 112.064 0.394 . . . . 64.1 112.064 179.441 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 39.7 mt-10 -64.28 -46.39 83.87 Favored 'General case' 0 CA--C 1.537 0.471 0 CA-C-O 120.991 0.424 . . . . 73.15 111.117 179.42 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 92.9 mt -63.81 -49.17 73.93 Favored 'General case' 0 N--CA 1.47 0.53 0 CA-C-N 116.159 -0.473 . . . . 63.31 111.646 178.18 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 35' ' ' LYS . . . . . 0.427 ' HG2' ' HB ' ' A' ' 45' ' ' VAL . 56.1 mtpt -52.83 -45.18 67.18 Favored 'General case' 0 N--CA 1.473 0.678 0 CA-C-O 121.203 0.525 . . . . 71.21 111.149 175.252 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 36' ' ' GLN . . . . . 0.548 ' O ' ' HG ' ' A' ' 40' ' ' LEU . 1.0 OUTLIER -57.75 -49.6 76.02 Favored 'General case' 0 CA--C 1.541 0.632 0 CA-C-N 115.761 -0.654 . . . . 65.35 110.673 177.553 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 37' ' ' GLU . . . . . 0.416 ' HB3' ' NH2' ' A' ' 41' ' ' ARG . 55.8 mm-40 -62.47 -35.14 78.39 Favored 'General case' 0 N--CA 1.471 0.578 0 N-CA-C 112.183 0.438 . . . . 73.05 112.183 178.743 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 38' ' ' LEU . . . . . 0.49 ' HB2' HG12 ' A' ' 45' ' ' VAL . 91.9 mt -66.53 -54.6 21.97 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-O 120.929 0.395 . . . . 63.41 111.591 177.88 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 17.6 ptmt -63.87 -24.2 67.65 Favored 'General case' 0 CA--C 1.541 0.616 0 N-CA-C 112.337 0.495 . . . . 60.14 112.337 -174.229 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 40' ' ' LEU . . . . . 0.548 ' HG ' ' O ' ' A' ' 36' ' ' GLN . 78.6 mt -58.03 -38.52 76.39 Favored 'General case' 0 N--CA 1.472 0.661 0 CA-C-O 121.421 0.629 . . . . 75.11 111.017 172.804 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 41' ' ' ARG . . . . . 0.416 ' NH2' ' HB3' ' A' ' 37' ' ' GLU . 41.6 mtm-85 -108.72 25.27 11.94 Favored 'General case' 0 CA--C 1.539 0.54 0 CA-C-N 115.514 -0.766 . . . . 73.13 111.724 -175.831 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 48.7 m 64.88 15.77 10.1 Favored 'General case' 0 N--CA 1.48 1.045 0 N-CA-C 112.877 0.695 . . . . 53.41 112.877 175.619 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 75.4 mt -79.57 140.52 55.55 Favored Pre-proline 0 CA--C 1.54 0.579 0 C-N-CA 122.029 0.132 . . . . 74.3 111.221 178.998 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 44' ' ' PRO . . . . . 0.458 ' HD2' ' HD3' ' A' ' 55' ' ' ARG . 41.4 Cg_endo -66.0 126.1 15.28 Favored 'Trans proline' 0 CA--C 1.538 0.717 0 C-N-CA 122.227 1.951 . . . . 73.2 112.452 -178.829 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 45' ' ' VAL . . . . . 0.49 HG12 ' HB2' ' A' ' 38' ' ' LEU . 21.5 m -94.04 -8.23 9.92 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.476 0 CA-C-O 121.103 0.478 . . . . 73.11 111.767 -177.352 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 38.6 m -76.7 74.85 3.37 Favored 'General case' 0 N--CA 1.47 0.534 0 CA-C-O 121.119 0.485 . . . . 60.52 111.938 -177.615 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . -166.89 177.2 41.71 Favored Glycine 0 CA--C 1.524 0.62 0 C-N-CA 121.298 -0.477 . . . . 71.54 112.909 176.2 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 48' ' ' THR . . . . . 0.552 ' O ' ' HG ' ' A' ' 52' ' ' LEU . 31.1 p -72.04 159.06 34.83 Favored 'General case' 0 N--CA 1.471 0.614 0 O-C-N 122.535 -0.391 . . . . 73.52 110.957 179.178 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 49' ' ' LYS . . . . . 0.424 ' HE3' ' O ' ' A' ' 29' ' ' MET . 87.4 tttt -48.84 -35.98 15.82 Favored 'General case' 0 N--CA 1.471 0.585 0 CA-C-O 121.174 0.511 . . . . 73.2 110.897 176.481 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 50' ' ' THR . . . . . 0.427 ' O ' ' HG3' ' A' ' 54' ' ' GLU . 10.1 m -58.24 -53.87 53.36 Favored 'General case' 0 N--CA 1.467 0.399 0 CA-C-N 115.726 -0.67 . . . . 64.53 110.979 176.367 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 41.1 mt-10 -58.16 -40.38 81.25 Favored 'General case' 0 N--CA 1.468 0.467 0 CA-C-N 116.076 -0.511 . . . . 64.21 111.66 178.526 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 52' ' ' LEU . . . . . 0.552 ' HG ' ' O ' ' A' ' 48' ' ' THR . 22.4 mt -60.68 -43.49 97.66 Favored 'General case' 0 CA--C 1.542 0.638 0 CA-C-O 121.155 0.502 . . . . 62.31 111.123 -179.843 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 53' ' ' ILE . . . . . . . . . . . . . 78.7 mt -65.5 -52.03 56.25 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.686 0 CA-C-N 116.162 -0.472 . . . . 65.45 111.36 177.065 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 54' ' ' GLU . . . . . 0.427 ' HG3' ' O ' ' A' ' 50' ' ' THR . 45.5 mt-10 -55.88 -42.54 76.09 Favored 'General case' 0 N--CA 1.471 0.622 0 CA-C-O 121.204 0.526 . . . . 65.31 111.068 178.966 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 55' ' ' ARG . . . . . 0.458 ' HD3' ' HD2' ' A' ' 44' ' ' PRO . 30.0 ttm180 -65.22 -43.89 90.02 Favored 'General case' 0 CA--C 1.539 0.55 0 CA-C-N 115.681 -0.69 . . . . 75.42 112.187 -177.171 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 51.1 mt -62.35 -47.28 84.91 Favored 'General case' 0 CA--C 1.54 0.561 0 O-C-N 122.249 -0.282 . . . . 74.23 111.288 175.881 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 98.3 mtt180 -57.92 -51.46 69.52 Favored 'General case' 0 N--CA 1.471 0.577 0 CA-C-O 120.971 0.415 . . . . 72.22 111.139 176.788 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -61.36 -37.87 84.92 Favored 'General case' 0 N--CA 1.47 0.563 0 CA-C-N 116.143 -0.48 . . . . 70.04 112.276 -178.854 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 59' ' ' TYR . . . . . . . . . . . . . 69.7 t80 -68.98 -44.34 73.08 Favored 'General case' 0 CA--C 1.538 0.507 0 CA-C-O 120.765 0.317 . . . . 62.23 111.523 179.069 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 60' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -65.62 -41.92 92.13 Favored 'General case' 0 CA--C 1.542 0.655 0 CA-C-O 121.596 0.712 . . . . 74.11 109.993 177.403 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 61' ' ' ASP . . . . . . . . . . . . . 21.6 t70 -60.16 -29.91 68.97 Favored 'General case' 0 CA--C 1.543 0.684 0 CA-C-N 115.486 -0.779 . . . . 75.34 112.189 -178.762 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 62' ' ' GLN . . . . . . . . . . . . . 10.9 pt20 . . . . . 0 N--CA 1.473 0.723 0 N-CA-C 112.468 0.544 . . . . 65.45 112.468 -178.33 . . . . . . . . 0 0 . 1 . 019 nuclear build core ' A' A ' 22' ' ' LEU . . . . . 0.405 ' HA ' ' HD3' ' A' ' 23' ' ' PRO . 86.9 mt . . . . . 0 CA--C 1.536 0.411 0 CA-C-O 120.38 0.133 . . . . 53.31 110.957 . . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 23' ' ' PRO . . . . . 0.592 ' O ' ' HG ' ' A' ' 26' ' ' LEU . 28.0 Cg_exo -62.03 147.19 95.61 Favored 'Trans proline' 0 CA--C 1.537 0.67 0 C-N-CA 122.213 1.942 . . . . 74.24 112.109 176.448 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -67.18 -20.16 65.68 Favored 'General case' 0 CA--C 1.538 0.511 0 CA-C-O 121.166 0.507 . . . . 64.15 111.33 177.563 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 25' ' ' ASN . . . . . 0.45 ' O ' ' HG3' ' A' ' 29' ' ' MET . 8.1 m120 -89.33 23.3 2.57 Favored 'General case' 0 CA--C 1.547 0.85 0 N-CA-C 112.694 0.628 . . . . 71.34 112.694 -174.875 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 26' ' ' LEU . . . . . 0.592 ' HG ' ' O ' ' A' ' 23' ' ' PRO . 67.7 mt -48.04 -56.61 7.31 Favored 'General case' 0 N--CA 1.478 0.952 0 N-CA-C 112.851 0.686 . . . . 74.13 112.851 -177.151 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 8.2 p-10 -77.48 -7.91 56.95 Favored 'General case' 0 CA--C 1.541 0.614 0 N-CA-C 112.294 0.479 . . . . 54.25 112.294 -176.226 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 16.4 m-20 -90.85 -26.87 19.17 Favored 'General case' 0 CA--C 1.542 0.637 0 N-CA-C 111.75 0.278 . . . . 71.32 111.75 177.604 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 29' ' ' MET . . . . . 0.45 ' HG3' ' O ' ' A' ' 25' ' ' ASN . 59.1 mtm -70.65 169.26 14.73 Favored 'General case' 0 N--CA 1.472 0.659 0 CA-C-O 121.366 0.603 . . . . 75.03 112.194 -178.558 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 30' ' ' LYS . . . . . 0.455 ' HB2' ' HG2' ' A' ' 33' ' ' GLU . 52.1 mtpt -76.98 157.66 31.1 Favored 'General case' 0 CA--C 1.536 0.427 0 CA-C-N 115.99 -0.55 . . . . 74.41 111.441 177.118 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 87.9 t -57.58 -40.17 73.59 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.5 0 CA-C-O 121.024 0.44 . . . . 63.44 110.643 175.451 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -59.51 -36.19 75.61 Favored 'General case' 0 CA--C 1.539 0.542 0 CA-C-N 116.135 -0.484 . . . . 75.43 111.775 177.04 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 33' ' ' GLU . . . . . 0.455 ' HG2' ' HB2' ' A' ' 30' ' ' LYS . 16.8 mm-40 -70.72 -40.99 72.47 Favored 'General case' 0 N--CA 1.47 0.536 0 CA-C-O 120.995 0.426 . . . . 63.01 110.73 178.309 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 34' ' ' LEU . . . . . 0.442 HD13 ' HB2' ' A' ' 52' ' ' LEU . 94.9 mt -59.07 -47.19 86.15 Favored 'General case' 0 CA--C 1.538 0.499 0 CA-C-O 121.021 0.439 . . . . 74.44 110.578 174.471 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 35' ' ' LYS . . . . . 0.57 ' HA ' HD12 ' A' ' 38' ' ' LEU . 95.5 mttt -59.72 -33.76 72.04 Favored 'General case' 0 N--CA 1.47 0.545 0 CA-C-N 116.295 -0.411 . . . . 74.13 111.469 176.253 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 36' ' ' GLN . . . . . 0.416 ' O ' ' HG ' ' A' ' 40' ' ' LEU . 22.8 tm0? -60.93 -47.99 83.85 Favored 'General case' 0 CA--C 1.537 0.448 0 CA-C-N 116.385 -0.37 . . . . 73.32 110.936 178.261 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 37' ' ' GLU . . . . . 0.468 ' HB3' ' NH2' ' A' ' 41' ' ' ARG . 29.5 mt-10 -67.86 -39.39 83.78 Favored 'General case' 0 CA--C 1.54 0.576 0 CA-C-O 120.824 0.345 . . . . 71.31 111.904 176.616 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 38' ' ' LEU . . . . . 0.57 HD12 ' HA ' ' A' ' 35' ' ' LYS . 83.9 mt -57.42 -55.42 34.99 Favored 'General case' 0 N--CA 1.471 0.606 0 N-CA-C 111.921 0.341 . . . . 70.42 111.921 179.189 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 17.7 ptpt -57.35 -30.6 64.97 Favored 'General case' 0 CA--C 1.542 0.645 0 N-CA-C 112.251 0.463 . . . . 75.13 112.251 -176.72 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 40' ' ' LEU . . . . . 0.416 ' HG ' ' O ' ' A' ' 36' ' ' GLN . 89.3 mt -68.2 -38.98 82.55 Favored 'General case' 0 N--CA 1.469 0.524 0 CA-C-O 120.926 0.393 . . . . 55.3 111.389 177.29 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 41' ' ' ARG . . . . . 0.685 HH21 HD22 ' A' ' 56' ' ' LEU . 0.0 OUTLIER -100.32 22.2 11.93 Favored 'General case' 0 CA--C 1.543 0.696 0 N-CA-C 112.055 0.391 . . . . 74.34 112.055 -179.211 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 44.1 t 62.32 27.96 16.67 Favored 'General case' 0 N--CA 1.481 1.087 0 N-CA-C 112.462 0.542 . . . . 74.43 112.462 174.619 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 70.6 mt -93.37 143.41 26.64 Favored Pre-proline 0 CA--C 1.543 0.705 0 CA-C-N 116.385 -0.371 . . . . 44.05 111.915 -179.312 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 44' ' ' PRO . . . . . 0.489 ' HD2' ' HD3' ' A' ' 55' ' ' ARG . 41.4 Cg_exo -57.07 119.54 6.86 Favored 'Trans proline' 0 CA--C 1.542 0.901 0 C-N-CA 122.743 2.295 . . . . 62.11 112.954 177.51 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 45' ' ' VAL . . . . . 0.469 ' O ' ' HE2' ' A' ' 35' ' ' LYS . 35.6 m -86.17 -16.73 9.59 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.675 0 N-CA-C 112.574 0.583 . . . . 62.41 112.574 -178.802 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 52.0 m -77.24 36.01 0.18 Allowed 'General case' 0 N--CA 1.478 0.952 0 N-CA-C 113.628 0.973 . . . . 73.04 113.628 -173.498 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . -112.15 176.34 17.88 Favored Glycine 0 CA--C 1.528 0.89 0 C-N-CA 120.892 -0.67 . . . . 73.5 112.912 177.71 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 48' ' ' THR . . . . . 0.58 ' O ' ' HG ' ' A' ' 52' ' ' LEU . 59.3 p -82.6 169.74 15.95 Favored 'General case' 0 N--CA 1.473 0.719 0 O-C-N 122.462 -0.434 . . . . 74.23 111.727 178.039 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 49' ' ' LYS . . . . . 0.43 ' O ' HG13 ' A' ' 53' ' ' ILE . 24.0 tptm -44.21 -59.64 2.27 Favored 'General case' 0 N--CA 1.473 0.713 0 C-N-CA 122.994 0.518 . . . . 70.42 112.227 -179.583 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 50' ' ' THR . . . . . 0.525 ' HA ' HD12 ' A' ' 53' ' ' ILE . 86.6 m -65.73 -38.19 88.46 Favored 'General case' 0 CA--C 1.541 0.598 0 N-CA-C 112.328 0.492 . . . . 71.33 112.328 -177.42 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 42.5 mt-10 -58.0 -50.83 72.07 Favored 'General case' 0 N--CA 1.473 0.699 0 CA-C-O 120.82 0.343 . . . . 74.43 111.533 177.613 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 52' ' ' LEU . . . . . 0.58 ' HG ' ' O ' ' A' ' 48' ' ' THR . 26.1 mt -59.1 -38.08 78.7 Favored 'General case' 0 CA--C 1.538 0.504 0 CA-C-N 116.435 -0.348 . . . . 75.14 111.441 -177.73 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 53' ' ' ILE . . . . . 0.525 HD12 ' HA ' ' A' ' 50' ' ' THR . 71.8 mt -57.69 -58.08 7.7 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.515 0 CA-C-O 121.093 0.473 . . . . 73.43 111.11 175.899 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 54' ' ' GLU . . . . . 0.445 ' HG2' HH11 ' A' ' 57' ' ' ARG . 44.4 mt-10 -65.7 -24.53 67.01 Favored 'General case' 0 N--CA 1.469 0.504 0 CA-C-N 116.207 -0.451 . . . . 71.41 111.864 179.697 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 55' ' ' ARG . . . . . 0.489 ' HD3' ' HD2' ' A' ' 44' ' ' PRO . 38.6 ttm180 -71.77 -44.46 63.98 Favored 'General case' 0 CA--C 1.54 0.57 0 CA-C-O 120.92 0.39 . . . . 70.13 110.912 177.329 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 56' ' ' LEU . . . . . 0.685 HD22 HH21 ' A' ' 41' ' ' ARG . 85.9 mt -58.96 -46.33 88.32 Favored 'General case' 0 N--CA 1.47 0.557 0 CA-C-O 121.236 0.541 . . . . 74.45 110.396 171.367 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 57' ' ' ARG . . . . . 0.445 HH11 ' HG2' ' A' ' 54' ' ' GLU . 48.6 mtp180 -59.47 -41.56 90.02 Favored 'General case' 0 CA--C 1.535 0.376 0 CA-C-N 115.499 -0.773 . . . . 70.22 111.419 177.58 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -59.55 -43.82 93.42 Favored 'General case' 0 CA--C 1.537 0.461 0 CA-C-N 116.472 -0.331 . . . . 54.21 111.663 179.218 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 59' ' ' TYR . . . . . . . . . . . . . 57.4 t80 -65.42 -48.28 73.33 Favored 'General case' 0 CA--C 1.54 0.56 0 CA-C-O 120.994 0.426 . . . . 64.13 110.918 178.368 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 60' ' ' GLN . . . . . . . . . . . . . 54.8 tp60 -59.89 -39.44 85.37 Favored 'General case' 0 CA--C 1.539 0.545 0 CA-C-O 121.347 0.594 . . . . 63.12 110.845 178.395 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 61' ' ' ASP . . . . . . . . . . . . . 24.2 t70 -56.21 -27.63 55.46 Favored 'General case' 0 CA--C 1.542 0.636 0 CA-C-N 115.459 -0.791 . . . . 72.21 111.821 178.048 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 62' ' ' GLN . . . . . . . . . . . . . 74.0 mt-30 . . . . . 0 CA--C 1.542 0.639 0 N-CA-C 112.41 0.522 . . . . 75.32 112.41 -177.775 . . . . . . . . 0 0 . 1 . 020 nuclear build core ' A' A ' 22' ' ' LEU . . . . . 0.524 ' HG ' ' HG3' ' A' ' 60' ' ' GLN . 82.4 mt . . . . . 0 CA--C 1.537 0.464 0 N-CA-C 111.713 0.264 . . . . 53.33 111.713 . . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 23' ' ' PRO . . . . . 0.532 ' HD2' HD21 ' A' ' 26' ' ' LEU . 52.0 Cg_exo -57.77 150.52 61.92 Favored 'Trans proline' 0 CA--C 1.543 0.968 0 C-N-CA 122.403 2.069 . . . . 73.42 112.84 171.645 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -83.4 -9.45 59.02 Favored 'General case' 0 CA--C 1.539 0.54 0 N-CA-C 112.203 0.445 . . . . 42.4 112.203 -178.285 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 25' ' ' ASN . . . . . 0.524 ' HB3' ' HB3' ' A' ' 28' ' ' ASP . 15.4 m120 -112.67 24.98 11.89 Favored 'General case' 0 CA--C 1.541 0.632 0 N-CA-C 112.477 0.547 . . . . 71.44 112.477 -176.096 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 26' ' ' LEU . . . . . 0.532 HD21 ' HD2' ' A' ' 23' ' ' PRO . 95.1 mt -45.67 -47.29 15.05 Favored 'General case' 0 N--CA 1.48 1.033 0 N-CA-C 112.242 0.46 . . . . 60.23 112.242 -178.67 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 19.7 t70 -71.58 -30.9 66.36 Favored 'General case' 0 CA--C 1.539 0.526 0 CA-C-O 121.0 0.429 . . . . 75.42 111.533 -179.648 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 28' ' ' ASP . . . . . 0.524 ' HB3' ' HB3' ' A' ' 25' ' ' ASN . 20.9 t70 -78.23 -23.69 47.31 Favored 'General case' 0 CA--C 1.542 0.655 0 CA-C-O 121.193 0.52 . . . . 75.42 110.927 -179.89 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 29' ' ' MET . . . . . . . . . . . . . 71.5 mtp -73.23 -179.52 3.39 Favored 'General case' 0 CA--C 1.539 0.526 0 CA-C-N 115.823 -0.626 . . . . 72.52 111.966 -179.805 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 49.8 mtmt -95.76 153.81 17.55 Favored 'General case' 0 CA--C 1.54 0.562 0 CA-C-N 116.242 -0.435 . . . . 72.34 111.723 -176.654 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 31' ' ' VAL . . . . . 0.401 ' O ' ' HG3' ' A' ' 35' ' ' LYS . 57.7 t -51.55 -47.85 36.43 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.751 0 CA-C-N 116.196 -0.457 . . . . 74.51 111.924 -179.463 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -54.65 -45.37 73.79 Favored 'General case' 0 N--CA 1.473 0.679 0 CA-C-O 120.807 0.337 . . . . 43.45 111.752 178.687 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 13.8 mm-40 -53.58 -50.66 65.1 Favored 'General case' 0 N--CA 1.47 0.528 0 CA-C-O 121.193 0.52 . . . . 64.23 111.294 178.417 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 62.1 mt -62.63 -46.58 87.58 Favored 'General case' 0 CA--C 1.536 0.413 0 CA-C-N 115.497 -0.774 . . . . 53.23 111.422 -179.896 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 35' ' ' LYS . . . . . 0.401 ' HG3' ' O ' ' A' ' 31' ' ' VAL . 59.2 mtpt -56.22 -38.77 71.49 Favored 'General case' 0 CA--C 1.535 0.384 0 CA-C-N 116.284 -0.416 . . . . 73.51 111.549 179.834 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 90.0 mm-40 -64.55 -51.34 63.37 Favored 'General case' 0 CA--C 1.537 0.468 0 CA-C-N 116.546 -0.297 . . . . 62.24 111.581 178.197 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 45.4 mt-10 -62.64 -20.75 65.11 Favored 'General case' 0 N--CA 1.473 0.71 0 CA-C-O 120.915 0.388 . . . . 75.55 111.86 179.893 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 38' ' ' LEU . . . . . 0.442 HD11 ' HA ' ' A' ' 52' ' ' LEU . 77.0 mt -76.18 -62.27 1.67 Allowed 'General case' 0 N--CA 1.47 0.527 0 CA-C-O 120.827 0.346 . . . . 72.15 111.211 170.734 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 14.1 ptmm? -62.41 -33.33 74.56 Favored 'General case' 0 CA--C 1.542 0.641 0 N-CA-C 112.31 0.485 . . . . 64.31 112.31 -173.861 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 95.2 mt -62.54 -27.28 69.05 Favored 'General case' 0 N--CA 1.473 0.707 0 CA-C-O 120.924 0.392 . . . . 65.24 111.164 174.765 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 41' ' ' ARG . . . . . 0.706 HH21 HD23 ' A' ' 56' ' ' LEU . 55.8 mtm180 -104.7 19.04 21.16 Favored 'General case' 0 CA--C 1.543 0.698 0 CA-C-N 116.418 -0.355 . . . . 75.5 111.132 179.386 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 25.7 m 68.72 13.26 8.87 Favored 'General case' 0 N--CA 1.479 1.008 0 C-N-CA 123.309 0.643 . . . . 42.44 112.715 177.154 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 80.6 mt -83.67 136.86 41.72 Favored Pre-proline 0 CA--C 1.54 0.572 0 O-C-N 122.316 -0.24 . . . . 72.41 111.085 178.33 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 44' ' ' PRO . . . . . . . . . . . . . 72.6 Cg_endo -74.94 126.83 10.26 Favored 'Trans proline' 0 CA--C 1.54 0.811 0 C-N-CA 122.55 2.167 . . . . 73.05 113.545 -178.621 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 26.1 m -85.48 20.93 0.3 Allowed 'Isoleucine or valine' 0 CA--C 1.544 0.736 0 CA-C-N 116.069 -0.514 . . . . 73.33 112.114 179.751 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 15.1 m -78.48 62.77 3.17 Favored 'General case' 0 N--CA 1.47 0.573 0 CA-C-O 120.821 0.343 . . . . 64.03 111.724 -176.308 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . -169.75 -177.34 40.13 Favored Glycine 0 CA--C 1.528 0.855 0 C-N-CA 120.598 -0.811 . . . . 72.21 113.961 -179.819 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 48' ' ' THR . . . . . 0.537 ' O ' ' HG ' ' A' ' 52' ' ' LEU . 47.6 p -82.25 171.65 14.02 Favored 'General case' 0 N--CA 1.473 0.677 0 C-N-CA 122.491 0.317 . . . . 70.21 111.38 179.705 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 79.8 tttt -48.0 -46.74 33.18 Favored 'General case' 0 N--CA 1.476 0.826 0 CA-C-O 120.999 0.428 . . . . 61.33 111.513 177.995 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 50' ' ' THR . . . . . 0.4 ' O ' ' HG3' ' A' ' 54' ' ' GLU . 13.6 m -58.77 -46.69 86.92 Favored 'General case' 0 CA--C 1.535 0.394 0 CA-C-N 116.053 -0.522 . . . . 45.45 111.229 179.726 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 74.8 mm-40 -59.09 -41.69 88.66 Favored 'General case' 0 N--CA 1.47 0.559 0 CA-C-O 120.915 0.388 . . . . 73.22 111.401 179.559 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 52' ' ' LEU . . . . . 0.537 ' HG ' ' O ' ' A' ' 48' ' ' THR . 30.1 mt -57.71 -50.39 73.37 Favored 'General case' 0 CA--C 1.538 0.486 0 CA-C-O 121.334 0.588 . . . . 74.42 110.767 179.371 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 53' ' ' ILE . . . . . . . . . . . . . 67.9 mt -60.46 -53.72 44.94 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.44 0 CA-C-N 115.607 -0.724 . . . . 65.23 111.541 178.7 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 54' ' ' GLU . . . . . 0.4 ' HG3' ' O ' ' A' ' 50' ' ' THR . 85.6 mt-10 -60.69 -37.91 83.22 Favored 'General case' 0 CA--C 1.537 0.468 0 CA-C-N 115.795 -0.639 . . . . 74.42 112.123 -177.084 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 55' ' ' ARG . . . . . 0.426 HH11 ' HD2' ' A' ' 55' ' ' ARG . 14.9 ttt180 -73.78 -37.77 64.87 Favored 'General case' 0 CA--C 1.539 0.528 0 O-C-N 122.14 -0.35 . . . . 73.41 111.21 179.863 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 56' ' ' LEU . . . . . 0.706 HD23 HH21 ' A' ' 41' ' ' ARG . 51.1 mt -53.03 -47.64 68.2 Favored 'General case' 0 N--CA 1.47 0.539 0 CA-C-O 121.028 0.442 . . . . 71.23 109.951 170.355 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 16.3 mtp180 -64.5 -57.02 10.37 Favored 'General case' 0 CA--C 1.539 0.548 0 CA-C-N 115.452 -0.794 . . . . 72.51 112.03 179.386 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -52.5 -44.85 65.93 Favored 'General case' 0 N--CA 1.472 0.666 0 CA-C-O 121.02 0.438 . . . . 21.31 112.074 -178.713 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 59' ' ' TYR . . . . . . . . . . . . . 79.4 t80 -67.28 -41.16 85.93 Favored 'General case' 0 CA--C 1.541 0.606 0 CA-C-N 116.397 -0.365 . . . . 73.42 111.793 178.952 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 60' ' ' GLN . . . . . 0.524 ' HG3' ' HG ' ' A' ' 22' ' ' LEU . 19.3 tm0? -70.56 -33.97 71.71 Favored 'General case' 0 CA--C 1.54 0.573 0 CA-C-O 121.207 0.527 . . . . 61.01 110.692 179.958 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 61' ' ' ASP . . . . . . . . . . . . . 24.8 t70 -66.92 -48.21 69.36 Favored 'General case' 0 CA--C 1.541 0.615 0 CA-C-N 115.993 -0.549 . . . . 74.35 111.801 179.304 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 62' ' ' GLN . . . . . . . . . . . . . 19.7 pt20 . . . . . 0 N--CA 1.474 0.761 0 N-CA-C 111.829 0.307 . . . . 55.44 111.829 -179.025 . . . . . . . . 0 0 . 1 . 001 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 90.2 mmm . . . . . 0 N--CA 1.489 1.518 0 CA-C-O 120.57 0.224 . . . . 72.25 110.738 . . . . . . . . . 0 0 . 1 . 001 nuclear build full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . -152.39 172.02 31.6 Favored Glycine 0 CA--C 1.525 0.691 0 C-N-CA 121.077 -0.582 . . . . 24.4 113.279 -177.907 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 3' ' ' HIS . . . . . . . . . . . . . 21.4 p-80 -79.41 78.17 5.94 Favored 'General case' 0 CA--C 1.543 0.702 0 CA-C-O 121.244 0.545 . . . . 75.13 111.765 -177.209 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 4' ' ' HIS . . . . . . . . . . . . . 27.8 p-80 -93.0 101.04 13.37 Favored 'General case' 0 N--CA 1.472 0.639 0 CA-C-O 121.075 0.464 . . . . 73.14 112.071 -178.366 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 5' ' ' HIS . . . . . . . . . . . . . 16.9 p80 -158.82 144.21 16.33 Favored 'General case' 0 N--CA 1.472 0.633 0 CA-C-N 116.417 -0.356 . . . . 74.02 110.993 179.821 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 52.9 p-80 -141.03 129.8 22.94 Favored 'General case' 0 N--CA 1.47 0.563 0 N-CA-C 112.521 0.563 . . . . 73.42 112.521 -176.489 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 58.4 t-80 -176.6 136.11 0.25 Allowed 'General case' 0 N--CA 1.471 0.585 0 CA-C-N 116.202 -0.453 . . . . 73.02 110.446 176.109 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 8' ' ' HIS . . . . . . . . . . . . . 19.4 t60 -154.78 145.2 22.11 Favored 'General case' 0 CA--C 1.543 0.679 0 O-C-N 122.22 -0.3 . . . . 74.22 111.338 -177.999 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 93.2 p -149.85 158.65 44.38 Favored 'General case' 0 N--CA 1.478 0.959 0 CA-C-O 120.695 0.283 . . . . 74.25 111.561 178.436 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 17.2 p80 -175.08 151.05 1.26 Allowed 'General case' 0 N--CA 1.475 0.803 0 C-N-CA 122.46 0.304 . . . . 74.14 110.631 178.365 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 11' ' ' MET . . . . . . . . . . . . . 13.1 tpt -154.03 150.42 28.22 Favored 'General case' 0 N--CA 1.471 0.623 0 CA-C-O 121.036 0.446 . . . . 71.54 111.782 177.417 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 43.7 p -160.91 113.33 1.93 Allowed 'General case' 0 N--CA 1.471 0.616 0 CA-C-N 116.268 -0.424 . . . . 72.22 111.283 -178.829 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 13' ' ' THR . . . . . . . . . . . . . 64.6 p -97.32 138.02 21.17 Favored Pre-proline 0 N--CA 1.474 0.765 0 N-CA-C 111.923 0.342 . . . . 62.12 111.923 -179.065 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 14' ' ' PRO . . . . . . . . . . . . . 35.1 Cg_exo -59.04 121.57 10.16 Favored 'Trans proline' 0 CA--C 1.543 0.964 0 C-N-CA 122.686 2.258 . . . . 72.32 112.677 175.89 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 84.4 mt -99.85 169.07 9.48 Favored 'General case' 0 N--CA 1.473 0.714 0 CA-C-O 120.949 0.404 . . . . 65.11 112.045 -176.688 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 16' ' ' THR . . . . . . . . . . . . . 12.0 t -94.4 -170.1 2.19 Favored 'General case' 0 CA--C 1.544 0.715 0 CA-C-N 116.424 -0.353 . . . . 71.22 111.195 176.717 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . 90.11 88.5 1.31 Allowed Glycine 0 CA--C 1.522 0.496 0 N-CA-C 111.12 -0.792 . . . . 52.21 111.12 -172.616 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 20.1 ptmt -137.96 144.48 44.03 Favored Pre-proline 0 CA--C 1.538 0.519 0 N-CA-C 112.769 0.655 . . . . 73.51 112.769 -165.234 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 97.6 Cg_endo -83.96 -158.49 0.09 OUTLIER 'Trans proline' 0 CA--C 1.544 0.993 0 C-N-CA 122.754 2.303 . . . . 70.24 112.092 170.838 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . 171.28 -97.73 0.12 Allowed Glycine 0 CA--C 1.529 0.918 0 C-N-CA 120.847 -0.692 . . . . 41.04 113.126 177.598 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -77.08 152.95 34.8 Favored 'General case' 0 N--CA 1.467 0.398 0 CA-C-O 121.187 0.518 . . . . 72.32 111.826 -179.161 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 83.4 mt -70.05 157.69 89.19 Favored Pre-proline 0 CA--C 1.543 0.692 0 CA-C-N 116.326 -0.397 . . . . 74.12 111.559 179.62 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 23' ' ' PRO . . . . . 0.49 ' O ' ' HG ' ' A' ' 26' ' ' LEU . 38.7 Cg_exo -61.26 125.3 16.62 Favored 'Trans proline' 0 CA--C 1.541 0.84 0 C-N-CA 122.353 2.035 . . . . 74.52 112.459 177.364 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -77.73 -2.52 36.61 Favored 'General case' 0 N--CA 1.472 0.629 0 N-CA-C 112.087 0.403 . . . . 72.51 112.087 -178.122 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 23.0 m120 -101.93 31.37 3.92 Favored 'General case' 0 CA--C 1.54 0.562 0 N-CA-C 112.108 0.411 . . . . 73.15 112.108 179.94 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 26' ' ' LEU . . . . . 0.49 ' HG ' ' O ' ' A' ' 23' ' ' PRO . 92.5 mt -56.94 -44.29 82.37 Favored 'General case' 0 N--CA 1.471 0.578 0 CA-C-O 120.98 0.419 . . . . 71.53 111.122 177.307 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 5.4 m-20 -63.14 -31.8 73.03 Favored 'General case' 0 CA--C 1.54 0.579 0 CA-C-N 116.078 -0.51 . . . . 65.21 111.728 178.046 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 22.3 m-20 -75.59 -23.15 56.46 Favored 'General case' 0 CA--C 1.536 0.431 0 CA-C-N 116.244 -0.435 . . . . 65.01 112.13 -177.966 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 29' ' ' MET . . . . . . . . . . . . . 65.8 mtm -85.86 179.36 7.04 Favored 'General case' 0 CA--C 1.538 0.482 0 CA-C-O 121.498 0.666 . . . . 62.34 112.325 -177.278 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 30' ' ' LYS . . . . . 0.567 ' HB2' ' HG2' ' A' ' 33' ' ' GLU . 45.7 mtpt -85.69 158.71 19.99 Favored 'General case' 0 CA--C 1.538 0.493 0 CA-C-N 115.647 -0.706 . . . . 54.11 111.246 -179.255 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 60.9 t -57.04 -40.98 76.52 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.506 0 CA-C-O 121.055 0.455 . . . . 63.41 110.76 177.669 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -56.94 -43.98 82.05 Favored 'General case' 0 CA--C 1.538 0.494 0 CA-C-N 115.871 -0.604 . . . . 71.05 111.875 177.759 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 33' ' ' GLU . . . . . 0.567 ' HG2' ' HB2' ' A' ' 30' ' ' LYS . 5.4 mm-40 -60.13 -41.58 92.97 Favored 'General case' 0 N--CA 1.47 0.562 0 CA-C-O 121.112 0.482 . . . . 75.33 110.649 179.928 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 70.6 mt -62.95 -45.63 91.56 Favored 'General case' 0 N--CA 1.468 0.446 0 CA-C-N 115.952 -0.567 . . . . 64.43 110.685 176.88 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 28.1 mtpp -60.52 -34.12 73.64 Favored 'General case' 0 CA--C 1.542 0.635 0 CA-C-N 115.974 -0.557 . . . . 73.54 110.979 176.449 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 8.2 tp-100 -64.76 -50.31 67.34 Favored 'General case' 0 CA--C 1.541 0.6 0 CA-C-O 121.024 0.44 . . . . 73.11 111.057 175.711 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 37' ' ' GLU . . . . . 0.402 ' O ' ' HG3' ' A' ' 41' ' ' ARG . 23.2 mm-40 -58.64 -40.0 82.15 Favored 'General case' 0 CA--C 1.539 0.546 0 CA-C-N 116.293 -0.412 . . . . 75.51 111.832 177.199 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 38' ' ' LEU . . . . . 0.5 ' HB2' HG12 ' A' ' 45' ' ' VAL . 92.3 mt -64.36 -56.04 17.07 Favored 'General case' 0 CA--C 1.538 0.49 0 N-CA-C 112.089 0.403 . . . . 74.01 112.089 178.422 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 19.8 ptpt -55.51 -40.88 72.35 Favored 'General case' 0 N--CA 1.473 0.703 0 N-CA-C 112.02 0.378 . . . . 72.03 112.02 -175.367 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 93.4 mt -66.13 -22.72 66.39 Favored 'General case' 0 N--CA 1.471 0.596 0 CA-C-O 120.883 0.373 . . . . 63.31 111.85 -179.255 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 41' ' ' ARG . . . . . 0.402 ' HG3' ' O ' ' A' ' 37' ' ' GLU . 75.7 mtt-85 -104.22 18.24 22.49 Favored 'General case' 0 CA--C 1.541 0.61 0 CA-C-O 120.73 0.3 . . . . 75.12 111.441 -179.676 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 33.1 t 67.0 16.57 10.38 Favored 'General case' 0 N--CA 1.478 0.932 0 C-N-CA 122.949 0.5 . . . . 63.24 112.315 178.458 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 65.6 mt -90.52 143.38 29.12 Favored Pre-proline 0 CA--C 1.542 0.641 0 N-CA-C 111.947 0.351 . . . . 64.13 111.947 -178.851 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 44' ' ' PRO . . . . . . . . . . . . . 42.9 Cg_endo -67.89 132.41 26.47 Favored 'Trans proline' 0 CA--C 1.542 0.891 0 C-N-CA 122.622 2.215 . . . . 63.54 113.008 176.812 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 45' ' ' VAL . . . . . 0.5 HG12 ' HB2' ' A' ' 38' ' ' LEU . 33.6 m -96.49 36.47 0.13 Allowed 'Isoleucine or valine' 0 N--CA 1.471 0.622 0 CA-C-N 116.122 -0.49 . . . . 61.32 111.806 -177.375 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 17.4 m -80.65 -61.67 1.9 Allowed 'General case' 0 CA--C 1.542 0.657 0 N-CA-C 114.064 1.135 . . . . 61.54 114.064 -168.777 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . -66.91 -170.82 4.4 Favored Glycine 0 CA--C 1.53 0.976 0 N-CA-C 115.996 1.159 . . . . 64.33 115.996 -166.944 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 48' ' ' THR . . . . . 0.586 ' O ' ' HG ' ' A' ' 52' ' ' LEU . 62.4 p -74.38 175.5 7.62 Favored 'General case' 0 N--CA 1.471 0.584 0 CA-C-N 115.295 -0.453 . . . . 51.12 111.749 -178.337 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 49' ' ' LYS . . . . . 0.423 ' O ' HG13 ' A' ' 53' ' ' ILE . 87.8 tttt -49.96 -53.79 24.11 Favored 'General case' 0 CA--C 1.543 0.677 0 N-CA-C 111.847 0.314 . . . . 53.51 111.847 -178.868 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 50' ' ' THR . . . . . . . . . . . . . 47.8 m -59.24 -43.28 92.39 Favored 'General case' 0 N--CA 1.473 0.705 0 CA-C-O 120.799 0.333 . . . . 71.25 111.595 179.351 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 51' ' ' GLU . . . . . 0.422 ' CD ' HH21 ' A' ' 55' ' ' ARG . 0.7 OUTLIER -53.61 -54.5 36.72 Favored 'General case' 0 CA--C 1.539 0.542 0 CA-C-O 120.941 0.401 . . . . 73.43 110.512 176.632 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 52' ' ' LEU . . . . . 0.586 ' HG ' ' O ' ' A' ' 48' ' ' THR . 25.7 mt -57.2 -47.62 80.81 Favored 'General case' 0 CA--C 1.54 0.586 0 CA-C-N 116.024 -0.534 . . . . 55.34 111.199 -179.718 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 53' ' ' ILE . . . . . 0.423 HG13 ' O ' ' A' ' 49' ' ' LYS . 91.2 mt -54.52 -52.73 37.57 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.616 0 CA-C-O 121.304 0.573 . . . . 52.5 111.678 177.951 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 54' ' ' GLU . . . . . 0.415 ' HA ' ' HE ' ' A' ' 57' ' ' ARG . 35.0 mt-10 -70.95 -24.86 62.51 Favored 'General case' 0 CA--C 1.536 0.432 0 N-CA-C 112.164 0.431 . . . . 74.34 112.164 -178.253 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 55' ' ' ARG . . . . . 0.422 HH21 ' CD ' ' A' ' 51' ' ' GLU . 46.6 ttm-85 -68.52 -36.45 78.88 Favored 'General case' 0 CA--C 1.538 0.502 0 CA-C-O 121.095 0.474 . . . . 73.41 110.257 175.639 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 89.9 mt -61.4 -44.73 96.65 Favored 'General case' 0 N--CA 1.469 0.495 0 CA-C-N 116.176 -0.466 . . . . 64.11 110.81 172.556 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 57' ' ' ARG . . . . . 0.415 ' HE ' ' HA ' ' A' ' 54' ' ' GLU . 40.3 mtm180 -62.89 -42.42 99.77 Favored 'General case' 0 N--CA 1.471 0.582 0 CA-C-O 121.027 0.442 . . . . 72.44 111.061 176.751 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -61.65 -39.45 91.39 Favored 'General case' 0 N--CA 1.469 0.495 0 CA-C-O 121.113 0.483 . . . . 51.13 111.482 178.027 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 59' ' ' TYR . . . . . . . . . . . . . 63.2 t80 -62.78 -47.17 84.63 Favored 'General case' 0 CA--C 1.537 0.462 0 CA-C-O 121.094 0.474 . . . . 75.51 110.806 176.021 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 60' ' ' GLN . . . . . . . . . . . . . 7.5 tp-100 -58.44 -44.62 89.26 Favored 'General case' 0 N--CA 1.468 0.468 0 CA-C-N 116.027 -0.533 . . . . 74.24 110.941 176.163 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 61' ' ' ASP . . . . . . . . . . . . . 31.9 t70 -59.03 -23.0 61.59 Favored 'General case' 0 CA--C 1.545 0.774 0 CA-C-O 121.208 0.527 . . . . 71.14 111.699 -178.401 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 62' ' ' GLN . . . . . . . . . . . . . 49.2 mt-30 -88.87 -52.29 5.18 Favored 'General case' 0 CA--C 1.54 0.592 0 CA-C-N 116.299 -0.409 . . . . 75.13 111.683 178.675 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 63' ' ' ILE . . . . . . . . . . . . . 36.3 pt -72.58 -21.66 19.99 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.58 0 N-CA-C 112.343 0.497 . . . . 74.31 112.343 -178.04 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 40.0 t -167.81 91.82 0.67 Allowed Pre-proline 0 CA--C 1.541 0.629 0 CA-C-N 116.338 -0.392 . . . . 74.32 111.279 -178.573 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 65' ' ' PRO . . . . . . . . . . . . . 94.2 Cg_endo -76.52 32.84 0.41 Allowed 'Trans proline' 0 CA--C 1.543 0.932 0 C-N-CA 122.847 2.365 . . . . 62.21 113.926 -176.426 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 66' ' ' VAL . . . . . . . . . . . . . 34.0 m -121.2 161.6 39.96 Favored Pre-proline 0 CA--C 1.542 0.644 0 O-C-N 122.321 -0.237 . . . . 54.32 111.199 -179.035 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 67' ' ' PRO . . . . . . . . . . . . . 16.1 Cg_exo -69.32 30.33 0.17 Allowed 'Trans proline' 0 CA--C 1.547 1.13 0 C-N-CA 123.144 2.563 . . . . 74.13 114.18 -179.524 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 92.42 77.29 1.36 Allowed Glycine 0 CA--C 1.528 0.856 0 C-N-CA 121.067 -0.587 . . . . 61.31 112.766 -177.653 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 69' ' ' ALA . . . . . 0.412 ' HA ' ' HD3' ' A' ' 70' ' ' PRO . . . -157.59 146.41 14.62 Favored Pre-proline 0 CA--C 1.539 0.54 0 O-C-N 122.745 -0.268 . . . . 61.11 111.304 -178.799 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 70' ' ' PRO . . . . . 0.412 ' HD3' ' HA ' ' A' ' 69' ' ' ALA . 27.9 Cg_exo -62.2 126.49 18.75 Favored 'Trans proline' 0 CA--C 1.541 0.851 0 C-N-CA 122.449 2.099 . . . . 71.54 112.262 177.405 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 53.6 mtmt -77.35 30.22 0.15 Allowed 'General case' 0 N--CA 1.474 0.75 0 N-CA-C 112.405 0.52 . . . . 71.51 112.405 -176.627 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -163.67 145.53 7.46 Favored Pre-proline 0 CA--C 1.539 0.535 0 C-N-CA 122.689 0.395 . . . . 55.43 110.714 -179.451 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 73' ' ' PRO . . . . . . . . . . . . . 22.2 Cg_exo -64.72 80.41 0.18 Allowed 'Trans proline' 0 CA--C 1.543 0.958 0 C-N-CA 122.421 2.08 . . . . 53.03 112.61 177.838 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -164.71 -173.37 2.97 Favored 'General case' 0 CA--C 1.537 0.443 0 CA-C-N 116.281 -0.418 . . . . 45.25 111.312 -178.396 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.253 1.25 0 CA-C-O 118.887 -0.578 . . . . 65.32 111.938 179.956 . . . . . . . . 0 0 . 1 . 002 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 62.8 mtt . . . . . 0 N--CA 1.494 1.767 0 CA-C-O 120.925 0.393 . . . . 71.41 111.529 . . . . . . . . . 0 0 . 1 . 002 nuclear build full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . -85.49 140.14 17.92 Favored Glycine 0 CA--C 1.525 0.692 0 CA-C-N 116.147 -0.479 . . . . 60.33 112.578 177.046 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 3' ' ' HIS . . . . . . . . . . . . . 58.8 t-80 -65.38 92.46 0.13 Allowed 'General case' 0 CA--C 1.543 0.695 0 CA-C-O 120.896 0.379 . . . . 71.4 111.804 -178.061 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 4' ' ' HIS . . . . . . . . . . . . . 39.7 p-80 -117.9 131.82 56.48 Favored 'General case' 0 N--CA 1.473 0.689 0 CA-C-O 120.919 0.39 . . . . 62.42 111.409 -179.884 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 5' ' ' HIS . . . . . . . . . . . . . 36.1 t-80 -107.94 144.71 34.83 Favored 'General case' 0 CA--C 1.539 0.524 0 CA-C-O 120.891 0.377 . . . . 43.3 111.711 -176.869 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 13.7 p80 -134.44 137.5 44.04 Favored 'General case' 0 CA--C 1.539 0.55 0 CA-C-O 120.883 0.373 . . . . 74.53 110.759 175.582 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 22.9 p80 -66.48 122.72 18.19 Favored 'General case' 0 CA--C 1.542 0.651 0 CA-C-O 121.027 0.441 . . . . 73.35 112.14 -176.653 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 8' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -84.04 154.3 23.33 Favored 'General case' 0 N--CA 1.47 0.553 0 CA-C-N 116.52 -0.309 . . . . 73.42 111.317 176.302 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 35.1 t -81.17 141.71 33.95 Favored 'General case' 0 N--CA 1.47 0.556 0 CA-C-O 121.109 0.481 . . . . 73.14 112.061 -178.414 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 23.4 t-80 -79.11 103.31 8.97 Favored 'General case' 0 CA--C 1.541 0.617 0 CA-C-N 116.142 -0.481 . . . . 73.14 111.075 177.835 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 11' ' ' MET . . . . . . . . . . . . . 62.8 mtt -115.57 96.27 5.55 Favored 'General case' 0 CA--C 1.54 0.585 0 CA-C-O 121.231 0.539 . . . . 71.23 112.375 -177.449 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 44.9 p -108.88 83.49 1.77 Allowed 'General case' 0 N--CA 1.469 0.488 0 CA-C-O 121.242 0.544 . . . . 51.34 110.176 174.432 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 13' ' ' THR . . . . . . . . . . . . . 69.3 p -99.26 155.01 37.02 Favored Pre-proline 0 N--CA 1.472 0.664 0 CA-C-N 116.062 -0.517 . . . . 63.25 112.328 -173.677 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 14' ' ' PRO . . . . . . . . . . . . . 28.2 Cg_endo -62.4 116.18 3.34 Favored 'Trans proline' 0 C--N 1.354 0.861 0 C-N-CA 122.52 2.147 . . . . 72.22 111.815 174.887 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 87.9 mt -85.62 134.54 33.99 Favored 'General case' 0 CA--C 1.536 0.42 0 CA-C-O 121.317 0.579 . . . . 65.1 112.375 -173.749 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 16' ' ' THR . . . . . . . . . . . . . 65.4 p -105.64 146.77 29.27 Favored 'General case' 0 N--CA 1.472 0.667 0 CA-C-N 115.721 -0.672 . . . . 55.45 111.195 178.046 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . -135.54 178.09 18.92 Favored Glycine 0 CA--C 1.53 1.005 0 C-N-CA 121.172 -0.537 . . . . 51.35 113.446 -179.257 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 75.6 mmtt -74.54 119.84 78.56 Favored Pre-proline 0 CA--C 1.546 0.822 0 N-CA-C 111.958 0.355 . . . . 75.11 111.958 179.484 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 91.1 Cg_endo -83.28 129.01 5.04 Favored 'Trans proline' 0 CA--C 1.545 1.061 0 C-N-CA 122.744 2.296 . . . . 63.11 113.127 177.946 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . -77.59 70.56 2.44 Favored Glycine 0 CA--C 1.529 0.967 0 C-N-CA 121.146 -0.55 . . . . 64.01 113.131 179.589 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -142.84 167.07 22.95 Favored 'General case' 0 CA--C 1.541 0.6 0 CA-C-O 120.933 0.397 . . . . 74.03 111.711 -178.889 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 22' ' ' LEU . . . . . 0.577 ' HG ' ' HG3' ' A' ' 60' ' ' GLN . 97.0 mt -115.4 155.64 46.82 Favored Pre-proline 0 N--CA 1.473 0.72 0 N-CA-C 112.331 0.493 . . . . 72.2 112.331 -178.229 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 23' ' ' PRO . . . . . . . . . . . . . 5.3 Cg_endo -85.97 149.14 9.51 Favored 'Trans proline' 0 CA--C 1.542 0.88 0 C-N-CA 123.133 2.555 . . . . 74.21 111.764 171.987 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -74.96 -10.33 59.38 Favored 'General case' 0 N--CA 1.471 0.59 0 N-CA-C 112.108 0.41 . . . . 54.21 112.108 -179.081 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 14.1 m120 -84.97 28.75 0.68 Allowed 'General case' 0 CA--C 1.546 0.81 0 N-CA-C 112.586 0.587 . . . . 64.32 112.586 -177.554 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 85.5 mt -57.75 -62.23 1.95 Allowed 'General case' 0 N--CA 1.473 0.711 0 N-CA-C 112.606 0.595 . . . . 74.24 112.606 -177.059 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 27' ' ' ASP . . . . . 0.518 ' HA ' ' HE2' ' A' ' 49' ' ' LYS . 29.9 t70 -71.61 -20.23 62.01 Favored 'General case' 0 N--CA 1.471 0.589 0 CA-C-O 121.012 0.434 . . . . 70.24 111.13 -179.127 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 5.6 m-20 -67.77 -29.02 68.12 Favored 'General case' 0 CA--C 1.538 0.504 0 CA-C-N 116.49 -0.323 . . . . 73.24 110.941 175.087 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 29' ' ' MET . . . . . 0.485 ' O ' ' HE3' ' A' ' 49' ' ' LYS . 59.8 mtm -83.25 164.32 20.19 Favored 'General case' 0 CA--C 1.539 0.521 0 CA-C-O 120.739 0.304 . . . . 63.32 110.57 172.04 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 59.2 mtpt -86.45 166.25 15.67 Favored 'General case' 0 CA--C 1.54 0.587 0 CA-C-O 121.441 0.639 . . . . 65.14 112.676 -177.08 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 31' ' ' VAL . . . . . 0.506 HG13 HD11 ' A' ' 52' ' ' LEU . 61.4 t -53.34 -47.94 57.02 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.798 0 CA-C-N 115.694 -0.685 . . . . 62.32 112.096 -177.812 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -61.33 -27.28 68.38 Favored 'General case' 0 CA--C 1.539 0.526 0 N-CA-C 112.221 0.452 . . . . 60.1 112.221 -179.598 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 33' ' ' GLU . . . . . 0.43 ' O ' ' HB3' ' A' ' 36' ' ' GLN . 40.9 mt-10 -78.79 -39.58 35.41 Favored 'General case' 0 N--CA 1.47 0.574 0 CA-C-O 121.035 0.445 . . . . 72.04 111.334 -179.925 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 92.9 mt -66.74 -40.87 88.5 Favored 'General case' 0 CA--C 1.538 0.513 0 CA-C-O 120.703 0.287 . . . . 71.13 111.385 177.478 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 35' ' ' LYS . . . . . 0.518 ' HA ' HD12 ' A' ' 38' ' ' LEU . 96.3 mttt -61.23 -30.28 70.35 Favored 'General case' 0 CA--C 1.538 0.518 0 CA-C-O 120.872 0.368 . . . . 63.12 111.218 176.194 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 36' ' ' GLN . . . . . 0.43 ' HB3' ' O ' ' A' ' 33' ' ' GLU . 0.2 OUTLIER -61.82 -54.15 46.2 Favored 'General case' 0 CA--C 1.538 0.514 0 CA-C-O 121.125 0.488 . . . . 75.11 110.115 171.694 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 36.6 mm-40 -57.57 -26.22 61.14 Favored 'General case' 0 CA--C 1.54 0.594 0 CA-C-N 115.916 -0.583 . . . . 62.33 112.133 177.575 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 38' ' ' LEU . . . . . 0.518 HD12 ' HA ' ' A' ' 35' ' ' LYS . 93.7 mt -72.5 -56.91 4.64 Favored 'General case' 0 CA--C 1.535 0.381 0 CA-C-O 120.931 0.396 . . . . 52.43 111.571 175.182 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 39' ' ' LYS . . . . . 0.414 ' HE2' ' HB3' ' A' ' 39' ' ' LYS . 16.9 ptpt -61.86 -30.13 70.65 Favored 'General case' 0 CA--C 1.539 0.557 0 N-CA-C 112.197 0.443 . . . . 61.52 112.197 -175.734 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 75.8 mt -58.05 -25.6 61.41 Favored 'General case' 0 N--CA 1.473 0.676 0 CA-C-O 120.891 0.377 . . . . 73.23 111.754 174.867 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 41' ' ' ARG . . . . . . . . . . . . . 13.7 mtm180 -121.71 24.55 9.69 Favored 'General case' 0 CA--C 1.539 0.539 0 CA-C-O 120.778 0.323 . . . . 70.24 111.761 -178.567 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 23.2 t 62.46 33.51 16.08 Favored 'General case' 0 N--CA 1.475 0.807 0 N-CA-C 112.336 0.495 . . . . 73.32 112.336 174.935 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 43' ' ' LEU . . . . . 0.408 ' HB3' HD22 ' A' ' 38' ' ' LEU . 76.3 mt -97.01 147.56 33.09 Favored Pre-proline 0 CA--C 1.542 0.661 0 CA-C-O 120.72 0.295 . . . . 64.22 111.596 178.546 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 44' ' ' PRO . . . . . . . . . . . . . 35.6 Cg_endo -64.16 122.81 10.92 Favored 'Trans proline' 0 CA--C 1.541 0.844 0 C-N-CA 122.859 2.373 . . . . 71.4 113.445 -178.04 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 33.7 m -98.93 31.19 0.41 Allowed 'Isoleucine or valine' 0 CA--C 1.545 0.767 0 CA-C-N 116.184 -0.462 . . . . 74.33 112.027 -177.498 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 78.5 p -93.94 -41.08 9.79 Favored 'General case' 0 N--CA 1.473 0.716 0 N-CA-C 112.754 0.65 . . . . 75.43 112.754 -175.514 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . -66.69 -179.33 10.68 Favored Glycine 0 CA--C 1.534 1.254 0 N-CA-C 115.078 0.791 . . . . 73.41 115.078 -174.021 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 48' ' ' THR . . . . . 0.618 ' O ' ' HG ' ' A' ' 52' ' ' LEU . 50.8 p -85.39 179.56 7.14 Favored 'General case' 0 N--CA 1.475 0.791 0 C-N-CA 122.811 0.444 . . . . 72.2 112.164 -178.254 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 49' ' ' LYS . . . . . 0.518 ' HE2' ' HA ' ' A' ' 27' ' ' ASP . 24.1 tptm -41.82 -58.7 1.93 Allowed 'General case' 0 N--CA 1.476 0.831 0 C-N-CA 123.418 0.687 . . . . 73.42 112.561 179.506 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 50' ' ' THR . . . . . . . . . . . . . 24.1 m -60.96 -38.32 85.5 Favored 'General case' 0 CA--C 1.537 0.467 0 CA-C-O 120.866 0.365 . . . . 73.21 111.583 -178.315 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 51' ' ' GLU . . . . . 0.461 ' O ' ' HB2' ' A' ' 55' ' ' ARG . 57.4 mm-40 -60.95 -42.44 98.23 Favored 'General case' 0 N--CA 1.469 0.524 0 CA-C-N 116.445 -0.343 . . . . 71.03 111.08 178.542 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 52' ' ' LEU . . . . . 0.618 ' HG ' ' O ' ' A' ' 48' ' ' THR . 14.3 mt -61.68 -45.48 93.8 Favored 'General case' 0 N--CA 1.467 0.406 0 CA-C-O 121.085 0.469 . . . . 74.32 110.628 179.15 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 53' ' ' ILE . . . . . . . . . . . . . 68.3 mt -58.5 -53.85 41.06 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.49 0 CA-C-N 115.746 -0.661 . . . . 72.41 111.332 178.341 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 40.5 mt-10 -65.07 -32.64 74.45 Favored 'General case' 0 CA--C 1.536 0.419 0 CA-C-N 116.394 -0.367 . . . . 71.34 111.38 -179.76 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 55' ' ' ARG . . . . . 0.473 ' HB3' HD21 ' A' ' 38' ' ' LEU . 0.0 OUTLIER -60.1 -53.23 60.25 Favored 'General case' 0 CA--C 1.537 0.45 0 CA-C-O 121.19 0.519 . . . . 74.14 110.588 177.573 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 98.3 mt -57.29 -50.93 71.36 Favored 'General case' 0 CA--C 1.537 0.444 0 CA-C-N 115.834 -0.621 . . . . 73.12 111.363 176.269 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 19.9 mtp180 -63.81 -30.49 71.58 Favored 'General case' 0 CA--C 1.541 0.602 0 N-CA-C 112.187 0.44 . . . . 75.53 112.187 -178.487 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -71.46 -48.08 51.6 Favored 'General case' 0 N--CA 1.469 0.516 0 CA-C-O 121.216 0.531 . . . . 72.31 110.921 175.896 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 59' ' ' TYR . . . . . . . . . . . . . 74.1 t80 -61.21 -42.66 98.98 Favored 'General case' 0 CA--C 1.539 0.527 0 CA-C-O 121.074 0.464 . . . . 73.33 111.234 177.841 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 60' ' ' GLN . . . . . 0.577 ' HG3' ' HG ' ' A' ' 22' ' ' LEU . 21.7 tm0? -71.82 -36.83 70.34 Favored 'General case' 0 CA--C 1.538 0.516 0 CA-C-N 116.255 -0.43 . . . . 75.04 111.145 -178.528 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 61' ' ' ASP . . . . . . . . . . . . . 20.7 t70 -56.33 -40.77 74.98 Favored 'General case' 0 N--CA 1.47 0.556 0 CA-C-O 121.306 0.574 . . . . 71.24 111.064 178.984 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 62' ' ' GLN . . . . . . . . . . . . . 47.4 mt-30 -65.3 -32.32 73.92 Favored 'General case' 0 CA--C 1.542 0.644 0 CA-C-N 115.377 -0.829 . . . . 70.14 112.148 -179.331 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 63' ' ' ILE . . . . . . . . . . . . . 30.7 pt -104.36 8.97 9.47 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.66 0 CA-C-O 120.753 0.311 . . . . 72.24 111.72 179.697 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 35.4 t -98.39 139.47 21.19 Favored Pre-proline 0 N--CA 1.473 0.681 0 CA-C-N 116.504 -0.317 . . . . 52.32 111.343 -179.386 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 65' ' ' PRO . . . . . . . . . . . . . 12.8 Cg_endo -54.5 133.26 55.62 Favored 'Trans proline' 0 CA--C 1.542 0.878 0 C-N-CA 122.882 2.388 . . . . 75.35 112.951 -179.357 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 66' ' ' VAL . . . . . . . . . . . . . 35.7 m -104.83 143.3 26.42 Favored Pre-proline 0 CA--C 1.539 0.537 0 CA-C-N 116.375 -0.375 . . . . 73.22 111.155 178.835 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 67' ' ' PRO . . . . . . . . . . . . . 98.8 Cg_endo -76.3 37.37 0.54 Allowed 'Trans proline' 0 CA--C 1.543 0.952 0 C-N-CA 122.844 2.363 . . . . 63.04 113.248 -178.605 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 96.56 11.95 52.3 Favored Glycine 0 CA--C 1.528 0.886 0 C-N-CA 121.228 -0.511 . . . . 74.02 113.091 -177.076 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 69' ' ' ALA . . . . . 0.405 ' HA ' ' HD3' ' A' ' 70' ' ' PRO . . . -83.48 124.67 75.37 Favored Pre-proline 0 CA--C 1.54 0.58 0 C-N-CA 122.351 0.261 . . . . 71.43 111.457 178.559 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 70' ' ' PRO . . . . . 0.405 ' HD3' ' HA ' ' A' ' 69' ' ' ALA . 40.3 Cg_exo -57.86 105.19 0.19 Allowed 'Trans proline' 0 CA--C 1.545 1.033 0 C-N-CA 122.883 2.389 . . . . 63.45 113.625 -179.266 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 32.0 mmtp -125.68 178.99 5.36 Favored 'General case' 0 N--CA 1.47 0.561 0 CA-C-N 116.165 -0.47 . . . . 71.31 111.26 177.172 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -71.53 138.65 83.55 Favored Pre-proline 0 CA--C 1.541 0.635 0 CA-C-N 116.253 -0.43 . . . . 51.23 110.873 174.783 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 73' ' ' PRO . . . . . . . . . . . . . 44.6 Cg_exo -56.94 97.12 0.07 OUTLIER 'Trans proline' 0 CA--C 1.541 0.839 0 C-N-CA 122.392 2.062 . . . . 73.41 112.939 -179.498 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -60.68 94.96 0.03 OUTLIER 'General case' 0 CA--C 1.537 0.465 0 CA-C-O 121.085 0.469 . . . . 64.12 111.718 179.222 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.251 1.153 0 CA-C-O 118.689 -0.672 . . . . 64.22 111.165 -179.395 . . . . . . . . 0 0 . 1 . 003 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 61.7 mtt . . . . . 0 N--CA 1.489 1.497 0 CA-C-O 120.788 0.328 . . . . 75.22 111.17 . . . . . . . . . 0 0 . 1 . 003 nuclear build full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . 81.53 -57.21 4.91 Favored Glycine 0 CA--C 1.527 0.823 0 C-N-CA 121.062 -0.59 . . . . 74.01 112.808 -179.763 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 3' ' ' HIS . . . . . . . . . . . . . 20.9 t-160 64.01 41.05 6.75 Favored 'General case' 0 CA--C 1.544 0.744 0 CA-C-O 121.192 0.52 . . . . 73.2 112.022 174.959 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 4' ' ' HIS . . . . . . . . . . . . . 20.6 t-80 -70.37 85.91 0.6 Allowed 'General case' 0 CA--C 1.539 0.521 0 CA-C-O 121.215 0.531 . . . . 65.33 110.878 178.302 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 5' ' ' HIS . . . . . . . . . . . . . 13.3 p-80 -64.53 135.3 55.87 Favored 'General case' 0 CA--C 1.539 0.531 0 CA-C-N 115.974 -0.557 . . . . 70.33 111.477 179.22 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 6.7 p-80 -128.74 93.55 3.65 Favored 'General case' 0 CA--C 1.538 0.51 0 CA-C-O 121.431 0.634 . . . . 74.13 111.436 -178.736 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 38.7 t-80 -99.62 123.8 44.23 Favored 'General case' 0 CA--C 1.538 0.486 0 CA-C-N 115.779 -0.646 . . . . 60.51 110.617 179.638 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 8' ' ' HIS . . . . . . . . . . . . . 23.3 p-80 -144.56 137.83 27.06 Favored 'General case' 0 N--CA 1.472 0.653 0 CA-C-O 121.203 0.525 . . . . 74.4 111.998 -178.279 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 36.0 p -142.63 134.09 26.4 Favored 'General case' 0 N--CA 1.47 0.527 0 CA-C-N 115.775 -0.648 . . . . 52.43 110.664 177.228 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 72.5 t60 -164.02 134.4 4.25 Favored 'General case' 0 CA--C 1.54 0.563 0 CA-C-O 120.866 0.365 . . . . 71.13 111.818 -178.553 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 11' ' ' MET . . . . . . . . . . . . . 25.7 ptm -131.91 177.66 7.37 Favored 'General case' 0 N--CA 1.473 0.699 0 CA-C-N 116.443 -0.344 . . . . 74.31 110.688 174.222 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 87.1 p -115.46 147.37 40.69 Favored 'General case' 0 N--CA 1.473 0.691 0 CA-C-O 120.89 0.376 . . . . 74.31 111.097 177.872 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 13' ' ' THR . . . . . . . . . . . . . 68.8 p -130.77 109.19 15.68 Favored Pre-proline 0 N--CA 1.471 0.621 0 CA-C-N 116.583 -0.281 . . . . 51.44 111.574 179.597 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 14' ' ' PRO . . . . . . . . . . . . . 75.0 Cg_endo -75.93 -177.99 4.03 Favored 'Trans proline' 0 CA--C 1.54 0.802 0 C-N-CA 122.624 2.216 . . . . 73.22 112.54 175.331 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 70.7 mt -73.26 104.93 4.46 Favored 'General case' 0 CA--C 1.537 0.446 0 CA-C-O 121.157 0.504 . . . . 72.31 111.394 179.132 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 16' ' ' THR . . . . . . . . . . . . . 70.3 p -77.02 108.39 10.05 Favored 'General case' 0 N--CA 1.467 0.401 0 CA-C-O 121.282 0.563 . . . . 74.51 111.212 179.724 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . -164.21 -144.26 3.98 Favored Glycine 0 CA--C 1.523 0.532 0 CA-C-N 115.975 -0.557 . . . . 73.14 112.756 -179.624 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 45.6 mmtm 69.06 141.8 0.08 OUTLIER Pre-proline 0 CA--C 1.545 0.767 0 C-N-CA 123.218 0.607 . . . . 74.11 112.163 179.61 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 89.7 Cg_endo -84.11 103.03 0.96 Allowed 'Trans proline' 0 CA--C 1.543 0.944 0 C-N-CA 122.634 2.223 . . . . 60.44 113.257 179.825 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . -72.92 67.57 1.37 Allowed Glycine 0 CA--C 1.525 0.718 0 C-N-CA 121.287 -0.482 . . . . 71.03 112.253 173.995 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -124.2 -158.32 0.81 Allowed 'General case' 0 CA--C 1.539 0.524 0 C-N-CA 122.679 0.392 . . . . 72.23 111.693 -175.793 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 22' ' ' LEU . . . . . 0.622 ' HG ' ' HG3' ' A' ' 60' ' ' GLN . 91.6 mt -95.58 158.86 33.78 Favored Pre-proline 0 N--CA 1.472 0.655 0 N-CA-C 111.916 0.339 . . . . 75.44 111.916 179.741 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 23' ' ' PRO . . . . . . . . . . . . . 32.9 Cg_exo -62.19 166.61 12.42 Favored 'Trans proline' 0 CA--C 1.541 0.844 0 C-N-CA 122.656 2.237 . . . . 73.52 111.845 169.233 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -76.36 -65.07 0.97 Allowed 'General case' 0 CA--C 1.54 0.577 0 CA-C-O 120.963 0.411 . . . . 62.45 112.053 -177.532 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 25' ' ' ASN . . . . . 0.594 ' HB3' ' HB2' ' A' ' 28' ' ' ASP . 1.8 m-20 -81.27 67.54 7.25 Favored 'General case' 0 CA--C 1.541 0.613 0 CA-C-O 121.086 0.47 . . . . 70.44 111.85 -175.578 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 26' ' ' LEU . . . . . 0.445 HD21 ' HB3' ' A' ' 22' ' ' LEU . 95.4 mt -58.87 -51.75 68.66 Favored 'General case' 0 CA--C 1.542 0.635 0 N-CA-C 112.834 0.679 . . . . 72.12 112.834 -176.284 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 35.4 t70 -71.81 -17.01 62.19 Favored 'General case' 0 CA--C 1.54 0.578 0 CA-C-O 121.03 0.443 . . . . 71.41 111.622 -177.975 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 28' ' ' ASP . . . . . 0.594 ' HB2' ' HB3' ' A' ' 25' ' ' ASN . 6.0 m-20 -80.5 -25.26 38.85 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-O 120.775 0.322 . . . . 73.15 110.986 174.802 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 29' ' ' MET . . . . . 0.434 ' HG3' ' O ' ' A' ' 25' ' ' ASN . 87.4 mtp -67.74 139.95 56.69 Favored 'General case' 0 CA--C 1.537 0.448 0 CA-C-O 121.129 0.49 . . . . 73.11 110.575 173.835 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 49.9 mtmt -66.41 151.96 46.07 Favored 'General case' 0 CA--C 1.538 0.484 0 CA-C-O 121.023 0.439 . . . . 73.5 111.769 -176.514 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 31' ' ' VAL . . . . . 0.48 HG12 ' HE3' ' A' ' 35' ' ' LYS . 39.8 t -49.67 -42.74 17.87 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.684 0 CA-C-N 116.085 -0.507 . . . . 74.54 112.288 -176.842 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -63.04 -37.54 87.6 Favored 'General case' 0 CA--C 1.539 0.556 0 N-CA-C 111.854 0.316 . . . . 53.15 111.854 178.041 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 38.2 mt-10 -64.29 -40.55 96.17 Favored 'General case' 0 N--CA 1.469 0.518 0 CA-C-O 120.987 0.423 . . . . 75.31 111.114 179.114 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 88.1 mt -61.96 -46.17 90.47 Favored 'General case' 0 N--CA 1.468 0.47 0 CA-C-N 116.111 -0.495 . . . . 72.12 110.911 176.487 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 35' ' ' LYS . . . . . 0.48 ' HE3' HG12 ' A' ' 31' ' ' VAL . 98.0 mttt -63.8 -32.74 74.34 Favored 'General case' 0 CA--C 1.539 0.538 0 CA-C-N 116.199 -0.455 . . . . 71.12 111.602 177.311 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 36' ' ' GLN . . . . . 0.474 ' O ' ' HG ' ' A' ' 40' ' ' LEU . 25.6 tm0? -62.92 -41.75 99.57 Favored 'General case' 0 CA--C 1.538 0.502 0 CA-C-O 120.844 0.354 . . . . 74.14 110.704 176.744 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 52.9 mm-40 -67.18 -46.69 73.2 Favored 'General case' 0 CA--C 1.542 0.641 0 CA-C-O 120.907 0.384 . . . . 61.13 111.513 174.219 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 38' ' ' LEU . . . . . 0.405 ' CD1' HD22 ' A' ' 52' ' ' LEU . 81.1 mt -53.57 -52.51 59.52 Favored 'General case' 0 N--CA 1.47 0.574 0 N-CA-C 112.472 0.545 . . . . 64.11 112.472 179.942 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 18.4 ptpt -58.59 -40.37 82.98 Favored 'General case' 0 N--CA 1.473 0.678 0 N-CA-C 111.751 0.278 . . . . 72.42 111.751 -177.7 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 40' ' ' LEU . . . . . 0.474 ' HG ' ' O ' ' A' ' 36' ' ' GLN . 94.9 mt -59.69 -30.09 68.54 Favored 'General case' 0 N--CA 1.472 0.642 0 CA-C-O 121.341 0.591 . . . . 54.55 110.993 176.963 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 41' ' ' ARG . . . . . 0.43 ' NH1' ' OE1' ' A' ' 60' ' ' GLN . 60.2 mtt-85 -99.67 14.07 31.37 Favored 'General case' 0 CA--C 1.537 0.466 0 CA-C-N 115.695 -0.684 . . . . 74.31 111.778 -175.804 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 47.7 m 64.16 19.51 11.8 Favored 'General case' 0 N--CA 1.479 0.986 0 CA-C-O 121.066 0.46 . . . . 72.43 111.985 179.045 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 74.3 mt -91.03 146.52 33.83 Favored Pre-proline 0 CA--C 1.541 0.599 0 CA-C-N 116.085 -0.507 . . . . 62.05 111.639 -178.88 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 44' ' ' PRO . . . . . 0.528 ' HD2' ' HD3' ' A' ' 55' ' ' ARG . 33.6 Cg_exo -57.99 134.06 59.83 Favored 'Trans proline' 0 CA--C 1.545 1.03 0 C-N-CA 122.305 2.003 . . . . 75.42 112.546 174.737 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 34.0 m -105.64 -12.91 9.54 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.772 0 N-CA-C 112.57 0.581 . . . . 72.12 112.57 -175.197 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 57.4 p -85.0 37.13 0.65 Allowed 'General case' 0 N--CA 1.478 0.948 0 N-CA-C 112.802 0.667 . . . . 65.43 112.802 -174.933 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . -108.54 174.11 18.41 Favored Glycine 0 CA--C 1.529 0.92 0 C-N-CA 121.277 -0.487 . . . . 61.31 112.946 177.638 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 48' ' ' THR . . . . . 0.496 ' O ' ' HG ' ' A' ' 52' ' ' LEU . 70.6 p -80.96 162.1 24.01 Favored 'General case' 0 N--CA 1.474 0.76 0 O-C-N 122.437 -0.449 . . . . 74.31 111.476 177.811 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 49' ' ' LYS . . . . . 0.406 ' HD3' HG22 ' A' ' 31' ' ' VAL . 22.8 tptm -37.99 -60.44 0.75 Allowed 'General case' 0 N--CA 1.478 0.946 0 N-CA-C 113.106 0.78 . . . . 70.33 113.106 -177.561 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 50' ' ' THR . . . . . . . . . . . . . 60.3 m -58.99 -41.01 86.59 Favored 'General case' 0 N--CA 1.472 0.629 0 N-CA-C 112.146 0.424 . . . . 73.21 112.146 -178.072 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 47.3 mt-10 -62.54 -41.99 99.24 Favored 'General case' 0 N--CA 1.469 0.489 0 CA-C-O 120.803 0.335 . . . . 63.14 111.274 179.784 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 52' ' ' LEU . . . . . 0.496 ' HG ' ' O ' ' A' ' 48' ' ' THR . 42.4 mt -57.63 -46.94 83.49 Favored 'General case' 0 N--CA 1.47 0.527 0 CA-C-O 121.254 0.549 . . . . 70.02 110.803 179.783 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 53' ' ' ILE . . . . . . . . . . . . . 66.3 mt -63.81 -57.5 11.42 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.55 0 CA-C-N 115.578 -0.737 . . . . 71.02 111.934 -179.685 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 21.0 mm-40 -60.03 -33.14 71.61 Favored 'General case' 0 CA--C 1.538 0.485 0 CA-C-N 116.277 -0.419 . . . . 72.02 111.86 -177.918 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 55' ' ' ARG . . . . . 0.528 ' HD3' ' HD2' ' A' ' 44' ' ' PRO . 40.5 ttm180 -64.19 -44.93 90.5 Favored 'General case' 0 CA--C 1.542 0.666 0 CA-C-O 120.814 0.34 . . . . 72.25 111.161 175.576 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 81.1 mt -57.73 -45.87 85.23 Favored 'General case' 0 N--CA 1.471 0.619 0 CA-C-O 121.232 0.539 . . . . 64.53 111.184 174.561 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 81.2 mtp180 -65.26 -43.11 92.34 Favored 'General case' 0 CA--C 1.536 0.439 0 CA-C-N 115.88 -0.6 . . . . 61.34 111.442 -179.041 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 58' ' ' ALA . . . . . 0.404 ' O ' ' HG3' ' A' ' 62' ' ' GLN . . . -60.93 -40.43 93.17 Favored 'General case' 0 CA--C 1.535 0.392 0 CA-C-O 120.916 0.389 . . . . 53.4 111.269 178.775 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 59' ' ' TYR . . . . . . . . . . . . . 81.5 t80 -59.55 -49.92 75.91 Favored 'General case' 0 CA--C 1.54 0.571 0 CA-C-N 115.848 -0.615 . . . . 63.31 111.395 176.396 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 60' ' ' GLN . . . . . 0.622 ' HG3' ' HG ' ' A' ' 22' ' ' LEU . 14.3 mm100 -66.75 -30.19 70.35 Favored 'General case' 0 N--CA 1.471 0.614 0 N-CA-C 111.885 0.328 . . . . 73.42 111.885 178.969 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 61' ' ' ASP . . . . . . . . . . . . . 17.2 t70 -63.37 -40.87 98.43 Favored 'General case' 0 CA--C 1.539 0.545 0 CA-C-O 120.942 0.401 . . . . 65.44 111.437 177.799 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 62' ' ' GLN . . . . . 0.404 ' HG3' ' O ' ' A' ' 58' ' ' ALA . 51.1 mt-30 -62.65 -49.26 75.86 Favored 'General case' 0 CA--C 1.537 0.469 0 CA-C-N 116.319 -0.4 . . . . 72.21 111.768 179.389 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 63' ' ' ILE . . . . . . . . . . . . . 32.9 pt -79.51 -19.79 12.52 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.655 0 N-CA-C 111.898 0.333 . . . . 72.32 111.898 179.258 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 28.6 t 67.81 147.13 0.11 Allowed Pre-proline 0 N--CA 1.48 1.039 0 C-N-CA 123.305 0.642 . . . . 51.3 111.695 179.706 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 65' ' ' PRO . . . . . . . . . . . . . 6.8 Cg_endo -48.7 108.79 0.2 Allowed 'Trans proline' 0 CA--C 1.541 0.869 0 C-N-CA 122.576 2.184 . . . . 61.43 112.484 177.611 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 66' ' ' VAL . . . . . . . . . . . . . 33.7 m -62.7 133.65 95.07 Favored Pre-proline 0 CA--C 1.542 0.673 0 N-CA-C 112.31 0.485 . . . . 74.1 112.31 -176.099 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 67' ' ' PRO . . . . . . . . . . . . . 71.6 Cg_endo -75.56 55.45 4.24 Favored 'Trans proline' 0 CA--C 1.54 0.815 0 C-N-CA 122.793 2.328 . . . . 65.0 112.41 178.051 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 77.69 74.51 1.0 Allowed Glycine 0 CA--C 1.527 0.782 0 C-N-CA 121.277 -0.487 . . . . 53.41 113.091 -176.959 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . -164.73 128.51 1.74 Allowed Pre-proline 0 CA--C 1.539 0.526 0 O-C-N 122.752 -0.263 . . . . 73.33 111.353 -178.587 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 70' ' ' PRO . . . . . . . . . . . . . 76.0 Cg_endo -76.61 145.11 25.83 Favored 'Trans proline' 0 CA--C 1.541 0.872 0 C-N-CA 122.36 2.04 . . . . 74.05 112.884 177.863 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 41.9 mtmt -74.12 -40.76 62.44 Favored 'General case' 0 N--CA 1.469 0.509 0 CA-C-O 121.43 0.633 . . . . 74.35 110.724 179.352 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -109.15 155.48 40.91 Favored Pre-proline 0 CA--C 1.539 0.556 0 CA-C-N 115.617 -0.72 . . . . 73.11 110.575 177.393 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 73' ' ' PRO . . . . . . . . . . . . . 71.9 Cg_endo -75.45 41.33 0.77 Allowed 'Trans proline' 0 CA--C 1.545 1.07 0 C-N-CA 122.563 2.176 . . . . 72.54 113.379 179.716 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -152.98 179.57 8.56 Favored 'General case' 0 CA--C 1.538 0.499 0 CA-C-N 116.431 -0.349 . . . . 75.4 111.245 -178.585 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.252 1.219 0 CA-C-O 118.755 -0.64 . . . . 64.34 112.023 -179.145 . . . . . . . . 0 0 . 1 . 004 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 25.6 ptt? . . . . . 0 N--CA 1.489 1.478 0 CA-C-O 120.637 0.256 . . . . 75.25 111.437 . . . . . . . . . 0 0 . 1 . 004 nuclear build full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . -79.03 138.31 20.5 Favored Glycine 0 CA--C 1.529 0.963 0 C-N-CA 121.394 -0.431 . . . . 65.54 113.311 -178.329 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 3' ' ' HIS . . . . . . . . . . . . . 13.0 p80 -109.23 111.95 23.84 Favored 'General case' 0 N--CA 1.474 0.749 0 CA-C-O 121.111 0.481 . . . . 73.24 111.374 -178.922 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 4' ' ' HIS . . . . . . . . . . . . . 49.1 m-70 -131.18 168.32 17.66 Favored 'General case' 0 N--CA 1.471 0.577 0 CA-C-O 120.994 0.426 . . . . 63.04 111.55 -179.44 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 5' ' ' HIS . . . . . . . . . . . . . 99.0 m-70 -116.96 151.96 35.6 Favored 'General case' 0 N--CA 1.471 0.575 0 CA-C-N 116.263 -0.426 . . . . 72.23 111.692 -179.948 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 42.1 t-80 -140.68 134.44 30.38 Favored 'General case' 0 N--CA 1.469 0.511 0 CA-C-N 116.391 -0.368 . . . . 74.33 111.58 -175.985 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 61.1 t60 -62.78 139.04 58.67 Favored 'General case' 0 CA--C 1.544 0.73 0 N-CA-C 112.957 0.725 . . . . 62.42 112.957 -177.662 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 8' ' ' HIS . . . . . . . . . . . . . 84.7 m-70 -113.94 113.63 25.09 Favored 'General case' 0 CA--C 1.541 0.608 0 CA-C-N 115.894 -0.594 . . . . 74.1 110.623 173.334 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 67.8 m -73.49 153.97 40.11 Favored 'General case' 0 N--CA 1.47 0.536 0 CA-C-O 120.98 0.419 . . . . 60.24 111.887 -178.618 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 23.0 p-80 -160.13 129.62 5.17 Favored 'General case' 0 CA--C 1.539 0.529 0 CA-C-N 116.234 -0.439 . . . . 71.53 111.577 -178.01 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 11' ' ' MET . . . . . . . . . . . . . 83.9 mtp -128.74 177.01 7.36 Favored 'General case' 0 CA--C 1.541 0.608 0 CA-C-O 121.139 0.495 . . . . 44.34 111.682 -179.295 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 75.4 m -153.45 127.66 9.12 Favored 'General case' 0 N--CA 1.479 0.978 0 CA-C-N 116.327 -0.397 . . . . 71.11 111.456 178.253 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 13' ' ' THR . . . . . . . . . . . . . 81.8 p -110.39 146.63 34.67 Favored Pre-proline 0 N--CA 1.473 0.696 0 C-N-CA 122.293 0.237 . . . . 75.14 111.236 179.79 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 14' ' ' PRO . . . . . . . . . . . . . 71.7 Cg_endo -74.87 174.3 12.98 Favored 'Trans proline' 0 CA--C 1.54 0.782 0 C-N-CA 122.41 2.073 . . . . 74.32 112.642 179.106 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 89.9 mt -87.34 158.09 19.12 Favored 'General case' 0 N--CA 1.471 0.59 0 CA-C-O 121.151 0.5 . . . . 74.53 111.659 -179.378 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 16' ' ' THR . . . . . . . . . . . . . 81.4 p -82.69 118.14 23.13 Favored 'General case' 0 N--CA 1.471 0.601 0 CA-C-N 116.194 -0.457 . . . . 74.5 111.851 -178.274 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . 142.11 172.1 13.4 Favored Glycine 0 CA--C 1.526 0.76 0 C-N-CA 120.692 -0.766 . . . . 74.12 113.991 177.235 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 18' ' ' LYS . . . . . 0.408 ' HA ' ' HD3' ' A' ' 19' ' ' PRO . 59.0 pttt -166.43 151.25 7.3 Favored Pre-proline 0 CA--C 1.543 0.688 0 C-N-CA 122.758 0.423 . . . . 53.13 111.176 178.883 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 19' ' ' PRO . . . . . 0.408 ' HD3' ' HA ' ' A' ' 18' ' ' LYS . 24.9 Cg_exo -63.78 133.9 41.28 Favored 'Trans proline' 0 CA--C 1.542 0.92 0 C-N-CA 122.868 2.379 . . . . 74.54 114.127 -176.656 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . -94.96 -45.71 3.04 Favored Glycine 0 CA--C 1.526 0.77 0 CA-C-N 116.145 -0.48 . . . . 50.41 112.426 174.416 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -79.73 -178.65 6.5 Favored 'General case' 0 CA--C 1.54 0.595 0 CA-C-O 120.967 0.413 . . . . 52.21 111.711 178.301 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 76.2 mt -131.59 149.31 73.12 Favored Pre-proline 0 N--CA 1.472 0.644 0 CA-C-O 120.843 0.354 . . . . 51.44 111.783 178.807 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 23' ' ' PRO . . . . . . . . . . . . . 87.4 Cg_endo -83.54 171.14 11.2 Favored 'Trans proline' 0 CA--C 1.538 0.704 0 C-N-CA 122.797 2.331 . . . . 64.52 112.37 171.643 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -92.97 -2.7 55.53 Favored 'General case' 0 CA--C 1.541 0.631 0 CA-C-O 120.816 0.341 . . . . 73.12 111.481 176.31 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 1.5 m-20 -88.35 19.86 3.59 Favored 'General case' 0 N--CA 1.473 0.687 0 N-CA-C 112.203 0.446 . . . . 65.55 112.203 -177.138 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 99.1 mt -54.14 -51.83 63.0 Favored 'General case' 0 CA--C 1.545 0.767 0 N-CA-C 112.877 0.695 . . . . 64.42 112.877 -174.544 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 17.6 t70 -76.86 -16.47 59.4 Favored 'General case' 0 CA--C 1.543 0.709 0 CA-C-O 121.001 0.429 . . . . 61.55 111.571 -179.15 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 24.7 t70 -81.12 -29.14 34.87 Favored 'General case' 0 CA--C 1.543 0.694 0 CA-C-O 120.89 0.376 . . . . 74.13 111.474 179.985 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 29' ' ' MET . . . . . . . . . . . . . 58.2 mtm -81.55 172.66 13.21 Favored 'General case' 0 CA--C 1.541 0.623 0 CA-C-O 121.368 0.604 . . . . 51.0 111.989 -179.491 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 48.8 mtmt -77.95 156.04 30.47 Favored 'General case' 0 CA--C 1.539 0.544 0 CA-C-N 115.672 -0.694 . . . . 41.11 111.563 -179.402 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 59.7 t -57.79 -35.22 50.35 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.584 0 CA-C-O 120.934 0.397 . . . . 72.24 111.31 179.183 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -59.87 -37.17 78.56 Favored 'General case' 0 CA--C 1.54 0.559 0 CA-C-N 116.523 -0.308 . . . . 53.44 111.659 176.659 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 23.5 mm-40 -64.63 -45.86 85.03 Favored 'General case' 0 N--CA 1.469 0.476 0 CA-C-O 121.224 0.535 . . . . 61.1 110.824 178.046 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 63.1 mt -58.43 -51.29 70.47 Favored 'General case' 0 CA--C 1.537 0.444 0 CA-C-N 115.8 -0.636 . . . . 62.45 110.887 176.907 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 56.7 mtmt -60.82 -31.19 70.61 Favored 'General case' 0 CA--C 1.54 0.592 0 CA-C-N 116.085 -0.507 . . . . 71.23 111.374 177.183 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER -64.57 -45.62 86.29 Favored 'General case' 0 CA--C 1.54 0.571 0 CA-C-N 116.206 -0.452 . . . . 72.45 110.621 177.387 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 42.1 mm-40 -66.11 -40.91 91.08 Favored 'General case' 0 CA--C 1.538 0.488 0 CA-C-O 120.995 0.426 . . . . 54.43 111.505 176.446 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 38' ' ' LEU . . . . . 0.436 HD11 ' HB3' ' A' ' 52' ' ' LEU . 94.5 mt -58.28 -53.67 55.61 Favored 'General case' 0 CA--C 1.538 0.483 0 N-CA-C 112.07 0.396 . . . . 61.35 112.07 178.547 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 39' ' ' LYS . . . . . 0.446 ' NZ ' ' HB3' ' A' ' 39' ' ' LYS . 0.5 OUTLIER -59.59 -31.97 69.96 Favored 'General case' 0 N--CA 1.472 0.649 0 N-CA-C 112.11 0.411 . . . . 64.1 112.11 -176.224 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 78.2 mt -68.26 -28.1 66.91 Favored 'General case' 0 N--CA 1.469 0.503 0 CA-C-O 121.038 0.447 . . . . 72.44 111.364 176.584 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 41' ' ' ARG . . . . . . . . . . . . . 53.1 mtt-85 -103.23 16.18 27.26 Favored 'General case' 0 CA--C 1.539 0.537 0 CA-C-N 116.368 -0.378 . . . . 71.01 111.663 -175.91 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 51.1 m 62.45 24.69 14.71 Favored 'General case' 0 N--CA 1.48 1.028 0 CA-C-O 121.144 0.497 . . . . 75.43 111.888 -179.475 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 78.1 mt -95.2 135.8 23.12 Favored Pre-proline 0 CA--C 1.542 0.65 0 CA-C-N 116.135 -0.484 . . . . 71.43 111.592 -179.039 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 44' ' ' PRO . . . . . 0.408 ' HG2' ' NH1' ' A' ' 55' ' ' ARG . 58.6 Cg_endo -70.98 143.56 45.3 Favored 'Trans proline' 0 CA--C 1.545 1.027 0 C-N-CA 122.752 2.301 . . . . 54.2 113.57 179.392 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 27.5 m -100.26 34.92 0.26 Allowed 'Isoleucine or valine' 0 N--CA 1.475 0.776 0 CA-C-O 121.389 0.614 . . . . 61.04 111.254 -179.718 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 37.3 m -74.94 -26.33 59.53 Favored 'General case' 0 N--CA 1.473 0.712 0 N-CA-C 114.009 1.115 . . . . 74.41 114.009 -169.371 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . -94.95 -171.95 37.24 Favored Glycine 0 CA--C 1.529 0.919 0 C-N-CA 120.655 -0.783 . . . . 73.35 114.522 -175.281 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 48' ' ' THR . . . . . 0.523 ' O ' ' HG ' ' A' ' 52' ' ' LEU . 81.3 p -84.77 179.67 7.29 Favored 'General case' 0 N--CA 1.471 0.584 0 C-N-CA 122.581 0.353 . . . . 64.42 111.273 178.097 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 49' ' ' LYS . . . . . 0.429 ' O ' HG13 ' A' ' 53' ' ' ILE . 87.4 tttt -46.23 -59.92 2.62 Favored 'General case' 0 N--CA 1.475 0.812 0 N-CA-C 112.32 0.489 . . . . 74.21 112.32 -178.384 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 50' ' ' THR . . . . . . . . . . . . . 94.9 m -58.62 -39.86 81.66 Favored 'General case' 0 N--CA 1.472 0.627 0 N-CA-C 111.869 0.322 . . . . 61.02 111.869 -178.845 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -57.44 -54.08 50.91 Favored 'General case' 0 CA--C 1.536 0.433 0 CA-C-O 120.924 0.392 . . . . 71.35 110.819 176.989 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 52' ' ' LEU . . . . . 0.523 ' HG ' ' O ' ' A' ' 48' ' ' THR . 42.6 mt -54.64 -41.42 70.04 Favored 'General case' 0 CA--C 1.538 0.495 0 CA-C-O 121.229 0.538 . . . . 53.32 111.088 178.969 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 53' ' ' ILE . . . . . 0.477 HG22 ' HD3' ' A' ' 57' ' ' ARG . 77.6 mt -62.16 -47.78 91.53 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.636 0 CA-C-N 115.946 -0.57 . . . . 72.24 111.258 176.711 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 36.6 mm-40 -62.5 -35.56 79.77 Favored 'General case' 0 N--CA 1.468 0.472 0 CA-C-N 116.471 -0.332 . . . . 72.33 111.506 177.387 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 55' ' ' ARG . . . . . 0.408 ' NH1' ' HG2' ' A' ' 44' ' ' PRO . 47.9 ttm-85 -65.08 -45.09 86.71 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-O 120.953 0.406 . . . . 72.33 110.995 178.009 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 81.9 mt -59.17 -48.49 81.4 Favored 'General case' 0 CA--C 1.537 0.479 0 CA-C-O 120.99 0.424 . . . . 73.23 110.918 174.76 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 57' ' ' ARG . . . . . 0.477 ' HD3' HG22 ' A' ' 53' ' ' ILE . 7.8 mtp85 -64.37 -41.16 96.87 Favored 'General case' 0 N--CA 1.471 0.597 0 CA-C-N 116.268 -0.424 . . . . 64.34 112.139 179.859 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -67.63 -30.64 70.26 Favored 'General case' 0 N--CA 1.469 0.479 0 CA-C-O 121.147 0.499 . . . . 64.24 111.514 177.92 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 59' ' ' TYR . . . . . . . . . . . . . 77.0 t80 -74.93 -44.47 48.43 Favored 'General case' 0 CA--C 1.539 0.527 0 CA-C-O 121.069 0.462 . . . . 74.34 110.986 175.956 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 60' ' ' GLN . . . . . 0.653 ' HG3' ' HB2' ' A' ' 64' ' ' SER . 8.9 tp-100 -65.52 -36.39 83.7 Favored 'General case' 0 CA--C 1.537 0.449 0 CA-C-N 116.367 -0.379 . . . . 75.11 110.912 178.409 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 61' ' ' ASP . . . . . . . . . . . . . 14.9 t70 -49.27 -32.44 10.84 Favored 'General case' 0 CA--C 1.543 0.69 0 CA-C-O 121.35 0.595 . . . . 50.11 111.404 175.771 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 62' ' ' GLN . . . . . . . . . . . . . 60.8 mt-30 -84.62 -17.17 39.52 Favored 'General case' 0 CA--C 1.543 0.696 0 CA-C-N 115.99 -0.55 . . . . 74.0 112.457 -176.923 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 63' ' ' ILE . . . . . . . . . . . . . 34.0 pt -129.2 6.63 2.61 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.881 0 N-CA-C 113.1 0.778 . . . . 73.43 113.1 -175.521 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 64' ' ' SER . . . . . 0.653 ' HB2' ' HG3' ' A' ' 60' ' ' GLN . 40.0 t -94.25 141.85 24.13 Favored Pre-proline 0 N--CA 1.475 0.818 0 O-C-N 122.092 -0.38 . . . . 45.2 111.542 -178.864 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 65' ' ' PRO . . . . . . . . . . . . . 17.7 Cg_exo -68.09 73.73 0.75 Allowed 'Trans proline' 0 CA--C 1.543 0.927 0 C-N-CA 122.801 2.334 . . . . 75.13 112.689 176.583 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 66' ' ' VAL . . . . . . . . . . . . . 29.1 m -122.4 155.15 62.55 Favored Pre-proline 0 CA--C 1.539 0.555 0 CA-C-N 116.371 -0.377 . . . . 74.32 111.284 -178.979 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 67' ' ' PRO . . . . . . . . . . . . . 18.3 Cg_endo -59.87 -42.97 40.64 Favored 'Trans proline' 0 CA--C 1.541 0.839 0 C-N-CA 122.596 2.197 . . . . 73.02 112.686 177.973 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 161.28 29.51 0.02 OUTLIER Glycine 0 CA--C 1.527 0.816 0 C-N-CA 120.615 -0.802 . . . . 72.23 114.213 176.831 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 69' ' ' ALA . . . . . 0.61 ' HB3' ' HE2' ' A' ' 71' ' ' LYS . . . 64.95 156.38 0.12 Allowed Pre-proline 0 N--CA 1.477 0.883 0 N-CA-C 112.521 0.563 . . . . 70.02 112.521 178.686 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 70' ' ' PRO . . . . . . . . . . . . . 33.7 Cg_endo -63.86 104.15 0.45 Allowed 'Trans proline' 0 CA--C 1.539 0.741 0 C-N-CA 122.231 1.954 . . . . 73.44 112.171 177.361 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 71' ' ' LYS . . . . . 0.61 ' HE2' ' HB3' ' A' ' 69' ' ' ALA . 74.8 mmtt -110.28 113.95 27.03 Favored 'General case' 0 N--CA 1.467 0.381 0 CA-C-O 120.801 0.334 . . . . 74.14 111.252 -178.232 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -141.52 78.82 17.88 Favored Pre-proline 0 CA--C 1.538 0.481 0 CA-C-O 120.955 0.407 . . . . 55.13 111.169 176.673 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 73' ' ' PRO . . . . . . . . . . . . . 62.7 Cg_endo -90.0 10.07 3.15 Favored 'Trans proline' 0 CA--C 1.54 0.824 0 C-N-CA 122.875 2.384 . . . . 62.32 113.648 -178.601 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . 67.91 -65.69 0.24 Allowed 'General case' 0 N--CA 1.475 0.805 0 C-N-CA 122.879 0.472 . . . . 73.54 111.81 -176.733 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.252 1.234 0 CA-C-O 118.34 -0.838 . . . . 62.32 112.819 176.772 . . . . . . . . 0 0 . 1 . 005 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 58.1 mtt . . . . . 0 N--CA 1.49 1.574 0 CA-C-O 120.37 0.129 . . . . 53.14 110.863 . . . . . . . . . 0 0 . 1 . 005 nuclear build full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . 146.1 153.47 5.89 Favored Glycine 0 CA--C 1.526 0.762 0 C-N-CA 120.479 -0.867 . . . . 73.23 113.989 176.171 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 3' ' ' HIS . . . . . . . . . . . . . 66.5 m80 -134.38 114.7 13.21 Favored 'General case' 0 CA--C 1.539 0.537 0 CA-C-O 121.17 0.509 . . . . 71.3 110.953 177.371 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 4' ' ' HIS . . . . . . . . . . . . . 15.8 p80 -85.55 128.02 34.62 Favored 'General case' 0 CA--C 1.542 0.653 0 N-CA-C 113.087 0.773 . . . . 70.33 113.087 -172.09 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 5' ' ' HIS . . . . . . . . . . . . . 58.8 t-80 -94.63 136.15 35.27 Favored 'General case' 0 CA--C 1.541 0.612 0 CA-C-N 116.091 -0.504 . . . . 74.54 109.997 172.26 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 12.2 p80 -121.31 -176.75 3.36 Favored 'General case' 0 N--CA 1.471 0.599 0 CA-C-O 120.879 0.371 . . . . 74.54 111.245 -178.566 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 52.1 m80 -121.9 168.61 11.68 Favored 'General case' 0 CA--C 1.537 0.478 0 CA-C-O 121.034 0.445 . . . . 74.4 111.764 177.977 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 8' ' ' HIS . . . . . . . . . . . . . 64.9 t60 -145.17 96.68 2.88 Favored 'General case' 0 CA--C 1.538 0.515 0 CA-C-N 116.051 -0.522 . . . . 72.44 110.664 173.6 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 47.0 m -79.36 171.35 15.29 Favored 'General case' 0 N--CA 1.472 0.647 0 CA-C-O 121.368 0.604 . . . . 74.22 112.594 -175.205 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 57.0 p-80 -152.95 152.05 31.01 Favored 'General case' 0 CA--C 1.539 0.545 0 CA-C-N 115.785 -0.643 . . . . 71.31 110.668 176.581 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 11' ' ' MET . . . . . . . . . . . . . 86.2 mtp -120.89 134.24 55.29 Favored 'General case' 0 N--CA 1.472 0.644 0 CA-C-O 120.789 0.328 . . . . 64.12 111.37 179.154 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 45.5 m -73.15 119.09 16.91 Favored 'General case' 0 N--CA 1.469 0.5 0 CA-C-N 116.446 -0.343 . . . . 61.11 111.076 177.491 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 13' ' ' THR . . . . . . . . . . . . . 45.1 p -82.65 131.92 53.48 Favored Pre-proline 0 CA--C 1.542 0.65 0 CA-C-O 120.679 0.275 . . . . 72.31 111.713 -179.542 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 14' ' ' PRO . . . . . . . . . . . . . 64.0 Cg_endo -70.82 154.49 63.52 Favored 'Trans proline' 0 CA--C 1.542 0.878 0 C-N-CA 122.969 2.446 . . . . 73.14 113.81 -176.673 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 2.0 pp -119.2 -178.38 3.56 Favored 'General case' 0 N--CA 1.474 0.728 0 CA-C-N 116.027 -0.533 . . . . 71.0 112.137 -178.435 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 16' ' ' THR . . . . . . . . . . . . . 13.9 t -151.85 173.75 14.41 Favored 'General case' 0 N--CA 1.471 0.61 0 CA-C-N 116.425 -0.352 . . . . 75.22 111.081 178.373 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . -63.75 137.66 41.89 Favored Glycine 0 CA--C 1.528 0.882 0 N-CA-C 114.253 0.461 . . . . 53.3 114.253 -177.183 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 18' ' ' LYS . . . . . 0.511 ' HA ' ' HE2' ' A' ' 18' ' ' LYS . 8.9 mmpt? -127.3 128.42 24.06 Favored Pre-proline 0 CA--C 1.544 0.747 0 O-C-N 122.68 -0.306 . . . . 73.41 111.019 -179.315 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 98.5 Cg_endo -77.9 -175.23 2.59 Favored 'Trans proline' 0 CA--C 1.543 0.951 0 C-N-CA 122.727 2.285 . . . . 74.22 113.31 179.734 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . -84.35 -2.05 89.22 Favored Glycine 0 CA--C 1.528 0.889 0 C-N-CA 121.283 -0.484 . . . . 63.55 113.315 178.777 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -123.91 -177.48 3.77 Favored 'General case' 0 N--CA 1.467 0.415 0 CA-C-O 120.709 0.29 . . . . 61.51 110.896 176.632 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 95.1 mt -113.0 133.92 21.91 Favored Pre-proline 0 N--CA 1.468 0.431 0 CA-C-O 120.624 0.25 . . . . 71.12 111.503 179.311 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 23' ' ' PRO . . . . . 0.488 ' O ' ' HG ' ' A' ' 26' ' ' LEU . 72.3 Cg_endo -75.61 135.58 18.15 Favored 'Trans proline' 0 CA--C 1.539 0.763 0 C-N-CA 122.333 2.022 . . . . 51.45 112.478 177.31 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -59.41 -16.42 23.19 Favored 'General case' 0 CA--C 1.542 0.647 0 CA-C-O 121.151 0.5 . . . . 75.33 111.707 178.657 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 25' ' ' ASN . . . . . 0.405 ' O ' ' HG3' ' A' ' 29' ' ' MET . 86.7 m-20 -71.94 -2.64 18.82 Favored 'General case' 0 CA--C 1.541 0.609 0 N-CA-C 113.171 0.804 . . . . 71.34 113.171 -179.565 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 26' ' ' LEU . . . . . 0.488 ' HG ' ' O ' ' A' ' 23' ' ' PRO . 89.4 mt -54.8 -31.64 59.25 Favored 'General case' 0 N--CA 1.474 0.744 0 CA-C-O 121.415 0.626 . . . . 74.12 110.531 174.392 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 13.3 t70 -62.09 -48.81 78.51 Favored 'General case' 0 CA--C 1.542 0.654 0 CA-C-N 115.697 -0.683 . . . . 74.43 110.901 173.09 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 20.7 m-20 -66.61 -35.37 80.03 Favored 'General case' 0 CA--C 1.543 0.698 0 CA-C-N 115.983 -0.553 . . . . 75.14 111.609 -179.877 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 29' ' ' MET . . . . . 0.445 ' SD ' HD23 ' A' ' 26' ' ' LEU . 83.6 mtp -62.01 146.87 48.9 Favored 'General case' 0 CA--C 1.537 0.463 0 CA-C-O 121.249 0.547 . . . . 62.31 111.935 -178.43 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 30' ' ' LYS . . . . . 0.585 ' HB2' ' HG2' ' A' ' 33' ' ' GLU . 22.1 mtpp -75.24 170.08 16.77 Favored 'General case' 0 CA--C 1.538 0.501 0 CA-C-N 115.76 -0.655 . . . . 62.01 111.682 -176.298 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 31' ' ' VAL . . . . . 0.499 HG12 ' HE3' ' A' ' 35' ' ' LYS . 45.7 t -60.48 -46.4 95.43 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.669 0 CA-C-N 116.017 -0.538 . . . . 71.42 111.796 -177.354 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -63.99 -36.66 84.71 Favored 'General case' 0 N--CA 1.47 0.532 0 N-CA-C 112.069 0.396 . . . . 51.35 112.069 -179.785 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 33' ' ' GLU . . . . . 0.585 ' HG2' ' HB2' ' A' ' 30' ' ' LYS . 3.3 mm-40 -64.21 -45.65 87.32 Favored 'General case' 0 N--CA 1.471 0.578 0 CA-C-O 121.076 0.465 . . . . 64.23 110.806 -179.032 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 87.6 mt -59.4 -44.57 92.79 Favored 'General case' 0 CA--C 1.539 0.543 0 CA-C-N 116.032 -0.531 . . . . 62.32 110.903 177.607 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 35' ' ' LYS . . . . . 0.499 ' HE3' HG12 ' A' ' 31' ' ' VAL . 99.2 mttt -59.35 -35.87 74.68 Favored 'General case' 0 N--CA 1.469 0.488 0 CA-C-N 116.267 -0.424 . . . . 75.01 111.36 176.101 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 36' ' ' GLN . . . . . 0.513 ' O ' ' HG ' ' A' ' 40' ' ' LEU . 54.4 tp60 -59.69 -43.93 93.85 Favored 'General case' 0 CA--C 1.535 0.392 0 CA-C-N 116.371 -0.377 . . . . 71.23 111.217 178.916 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 37' ' ' GLU . . . . . 0.479 ' O ' ' HG3' ' A' ' 41' ' ' ARG . 35.1 mt-10 -67.63 -42.76 81.8 Favored 'General case' 0 CA--C 1.537 0.464 0 C-N-CA 121.082 -0.247 . . . . 75.15 111.224 176.33 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 38' ' ' LEU . . . . . . . . . . . . . 78.7 mt -52.07 -58.84 5.35 Favored 'General case' 0 N--CA 1.472 0.673 0 N-CA-C 111.863 0.32 . . . . 73.34 111.863 177.295 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 39' ' ' LYS . . . . . 0.409 ' HG2' ' O ' ' A' ' 36' ' ' GLN . 16.1 ptpt -55.98 -36.63 68.07 Favored 'General case' 0 N--CA 1.473 0.692 0 N-CA-C 111.891 0.33 . . . . 75.43 111.891 -177.999 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 40' ' ' LEU . . . . . 0.513 ' HG ' ' O ' ' A' ' 36' ' ' GLN . 92.3 mt -68.72 -29.76 68.26 Favored 'General case' 0 CA--C 1.538 0.501 0 CA-C-O 121.015 0.436 . . . . 73.13 111.33 178.083 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 41' ' ' ARG . . . . . 0.479 ' HG3' ' O ' ' A' ' 37' ' ' GLU . 53.9 mtt-85 -96.01 16.04 18.98 Favored 'General case' 0 CA--C 1.541 0.617 0 CA-C-N 116.327 -0.397 . . . . 75.41 111.454 -179.921 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 50.5 m 65.66 27.52 11.35 Favored 'General case' 0 N--CA 1.48 1.067 0 CA-C-O 121.356 0.598 . . . . 61.42 112.154 178.268 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 49.1 mt -102.28 144.75 29.22 Favored Pre-proline 0 CA--C 1.544 0.734 0 CA-C-N 116.192 -0.458 . . . . 75.12 111.385 -179.916 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 44' ' ' PRO . . . . . . . . . . . . . 57.6 Cg_endo -70.13 123.84 10.36 Favored 'Trans proline' 0 CA--C 1.542 0.888 0 C-N-CA 122.479 2.12 . . . . 70.33 112.944 178.802 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 28.3 m -82.27 -15.04 12.11 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.596 0 N-CA-C 112.853 0.686 . . . . 71.15 112.853 -174.598 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 65.9 m -71.18 79.56 0.7 Allowed 'General case' 0 N--CA 1.472 0.658 0 N-CA-C 112.358 0.503 . . . . 61.22 112.358 -178.272 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . -158.05 173.41 35.27 Favored Glycine 0 CA--C 1.526 0.764 0 C-N-CA 121.239 -0.505 . . . . 74.5 113.193 177.404 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 48' ' ' THR . . . . . 0.539 ' O ' ' HG ' ' A' ' 52' ' ' LEU . 72.3 p -77.58 158.53 29.78 Favored 'General case' 0 N--CA 1.474 0.739 0 O-C-N 122.779 -0.248 . . . . 51.33 110.715 176.808 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 60.0 tttm -49.04 -40.95 33.31 Favored 'General case' 0 N--CA 1.476 0.846 0 CA-C-O 120.729 0.299 . . . . 64.32 111.596 -177.228 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 50' ' ' THR . . . . . 0.464 ' O ' ' HG2' ' A' ' 54' ' ' GLU . 89.2 m -60.63 -54.77 41.32 Favored 'General case' 0 N--CA 1.469 0.481 0 CA-C-O 120.818 0.342 . . . . 71.35 110.96 174.714 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 10.0 mm-40 -54.5 -35.15 62.81 Favored 'General case' 0 N--CA 1.47 0.541 0 CA-C-N 116.22 -0.445 . . . . 72.41 111.971 -179.564 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 52' ' ' LEU . . . . . 0.539 ' HG ' ' O ' ' A' ' 48' ' ' THR . 46.5 mt -62.36 -49.77 74.24 Favored 'General case' 0 CA--C 1.537 0.466 0 CA-C-O 120.977 0.418 . . . . 72.5 110.912 177.962 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 53' ' ' ILE . . . . . 0.512 ' O ' ' HG3' ' A' ' 57' ' ' ARG . 66.6 mt -60.71 -51.61 71.13 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.481 0 CA-C-N 116.149 -0.478 . . . . 74.12 110.847 177.757 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 54' ' ' GLU . . . . . 0.464 ' HG2' ' O ' ' A' ' 50' ' ' THR . 7.5 mm-40 -55.54 -40.75 72.26 Favored 'General case' 0 N--CA 1.47 0.548 0 CA-C-O 121.155 0.503 . . . . 74.51 111.205 178.778 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 23.7 ttm180 -67.37 -38.6 85.0 Favored 'General case' 0 CA--C 1.536 0.428 0 CA-C-N 116.048 -0.524 . . . . 71.44 111.333 -178.685 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 89.7 mt -60.63 -41.45 94.92 Favored 'General case' 0 CA--C 1.535 0.401 0 CA-C-O 120.916 0.388 . . . . 65.22 110.555 172.292 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 57' ' ' ARG . . . . . 0.512 ' HG3' ' O ' ' A' ' 53' ' ' ILE . 44.2 mtm180 -60.98 -53.99 50.42 Favored 'General case' 0 C--O 1.221 -0.41 0 CA-C-N 116.29 -0.413 . . . . 72.45 111.018 177.902 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 58' ' ' ALA . . . . . 0.437 ' O ' ' HG3' ' A' ' 62' ' ' GLN . . . -49.74 -48.82 49.85 Favored 'General case' 0 N--CA 1.471 0.582 0 N-CA-C 112.302 0.482 . . . . 71.24 112.302 -178.518 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 59' ' ' TYR . . . . . . . . . . . . . 70.1 t80 -57.63 -56.83 16.79 Favored 'General case' 0 CA--C 1.54 0.587 0 CA-C-O 120.94 0.4 . . . . 64.42 111.714 178.022 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 60' ' ' GLN . . . . . 0.511 ' NE2' ' HB2' ' A' ' 64' ' ' SER . 25.7 tm0? -66.47 -31.99 73.08 Favored 'General case' 0 CA--C 1.545 0.774 0 CA-C-N 116.131 -0.486 . . . . 62.23 111.485 -176.825 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 61' ' ' ASP . . . . . . . . . . . . . 32.6 t70 -64.34 -30.29 71.34 Favored 'General case' 0 CA--C 1.541 0.616 0 C-N-CA 123.267 0.627 . . . . 75.33 112.032 -177.622 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 62' ' ' GLN . . . . . 0.437 ' HG3' ' O ' ' A' ' 58' ' ' ALA . 57.0 mt-30 -58.22 -39.29 78.68 Favored 'General case' 0 N--CA 1.472 0.652 0 CA-C-O 120.93 0.395 . . . . 74.13 111.61 179.712 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 63' ' ' ILE . . . . . . . . . . . . . 29.7 pt -102.47 -17.3 7.05 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.607 0 N-CA-C 112.258 0.466 . . . . 71.43 112.258 -178.778 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 64' ' ' SER . . . . . 0.511 ' HB2' ' NE2' ' A' ' 60' ' ' GLN . 32.0 t -71.69 140.75 84.3 Favored Pre-proline 0 N--CA 1.472 0.664 0 N-CA-C 111.926 0.343 . . . . 43.31 111.926 -178.549 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 65' ' ' PRO . . . . . . . . . . . . . 53.0 Cg_exo -56.36 97.77 0.07 OUTLIER 'Trans proline' 0 CA--C 1.54 0.804 0 C-N-CA 122.512 2.141 . . . . 63.12 112.273 173.7 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 66' ' ' VAL . . . . . . . . . . . . . 26.7 m -81.82 148.63 61.72 Favored Pre-proline 0 CA--C 1.54 0.589 0 CA-C-N 116.437 -0.347 . . . . 52.01 111.595 -178.9 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 67' ' ' PRO . . . . . . . . . . . . . 73.8 Cg_endo -73.9 64.92 5.02 Favored 'Trans proline' 0 CA--C 1.545 1.044 0 C-N-CA 122.707 2.271 . . . . 73.24 113.182 -179.151 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 73.29 56.03 5.87 Favored Glycine 0 CA--C 1.529 0.918 0 C-N-CA 120.995 -0.621 . . . . 51.1 112.925 -178.56 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . 68.17 137.52 0.05 OUTLIER Pre-proline 0 N--CA 1.474 0.773 0 C-N-CA 123.355 0.662 . . . . 54.13 112.346 -176.459 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 70' ' ' PRO . . . . . . . . . . . . . 32.8 Cg_endo -63.3 128.77 23.49 Favored 'Trans proline' 0 CA--C 1.54 0.805 0 C-N-CA 122.364 2.043 . . . . 72.14 112.501 177.236 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 56.1 tptt -63.92 -40.96 97.67 Favored 'General case' 0 CA--C 1.539 0.535 0 CA-C-N 116.463 -0.335 . . . . 73.2 111.873 -177.668 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -83.81 121.56 76.08 Favored Pre-proline 0 CA--C 1.54 0.593 0 CA-C-O 120.609 0.242 . . . . 72.35 111.648 179.971 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 73' ' ' PRO . . . . . . . . . . . . . 37.7 Cg_endo -65.46 113.86 2.65 Favored 'Trans proline' 0 CA--C 1.542 0.877 0 C-N-CA 122.34 2.027 . . . . 63.12 112.67 179.557 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -57.43 117.52 4.22 Favored 'General case' 0 CA--C 1.538 0.511 0 N-CA-C 112.425 0.528 . . . . 72.34 112.425 -178.176 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.25 1.117 0 CA-C-O 119.08 -0.486 . . . . 65.41 111.743 178.879 . . . . . . . . 0 0 . 1 . 006 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 62.5 mtm . . . . . 0 N--CA 1.492 1.642 0 CA-C-O 120.604 0.24 . . . . 64.44 110.962 . . . . . . . . . 0 0 . 1 . 006 nuclear build full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . 147.11 157.78 7.53 Favored Glycine 0 CA--C 1.525 0.686 0 C-N-CA 120.998 -0.62 . . . . 65.24 113.388 178.103 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 3' ' ' HIS . . . . . . . . . . . . . 52.4 p-80 -163.53 117.17 1.55 Allowed 'General case' 0 CA--C 1.537 0.453 0 CA-C-O 120.744 0.307 . . . . 73.21 111.226 179.456 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 4' ' ' HIS . . . . . . . . . . . . . 9.8 p80 -64.87 127.55 32.03 Favored 'General case' 0 CA--C 1.539 0.526 0 O-C-N 122.25 -0.281 . . . . 64.21 110.383 176.868 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 5' ' ' HIS . . . . . . . . . . . . . 29.0 t-80 -62.12 112.89 2.55 Favored 'General case' 0 CA--C 1.54 0.585 0 CA-C-O 120.638 0.256 . . . . 72.13 111.639 -177.672 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 9.4 p-80 -107.65 173.08 6.48 Favored 'General case' 0 CA--C 1.54 0.579 0 CA-C-O 121.083 0.468 . . . . 75.41 111.693 178.52 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 31.6 p-80 -149.5 175.4 11.53 Favored 'General case' 0 N--CA 1.469 0.514 0 CA-C-O 120.961 0.41 . . . . 72.31 111.609 -177.916 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 8' ' ' HIS . . . . . . . . . . . . . 71.9 m80 -94.36 131.99 39.44 Favored 'General case' 0 CA--C 1.538 0.504 0 CA-C-N 116.405 -0.361 . . . . 72.2 110.894 176.127 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 70.0 m -103.16 137.33 41.45 Favored 'General case' 0 N--CA 1.473 0.685 0 CA-C-O 120.765 0.317 . . . . 62.33 111.09 178.557 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 42.7 p-80 -103.32 132.52 49.51 Favored 'General case' 0 N--CA 1.472 0.67 0 CA-C-O 120.62 0.247 . . . . 71.21 111.288 -178.457 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 11' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -125.84 179.27 5.27 Favored 'General case' 0 N--CA 1.471 0.618 0 CA-C-O 120.814 0.34 . . . . 62.13 111.581 179.682 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 65.1 p -131.02 150.49 52.12 Favored 'General case' 0 N--CA 1.475 0.821 0 CA-C-O 120.931 0.396 . . . . 64.32 111.608 -178.8 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 13' ' ' THR . . . . . . . . . . . . . 76.8 p -86.11 127.23 62.58 Favored Pre-proline 0 N--CA 1.472 0.663 0 N-CA-C 112.117 0.414 . . . . 74.53 112.117 -178.924 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 14' ' ' PRO . . . . . . . . . . . . . 30.5 Cg_endo -63.11 105.73 0.49 Allowed 'Trans proline' 0 CA--C 1.54 0.822 0 C-N-CA 122.778 2.319 . . . . 74.13 113.001 178.333 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 15' ' ' LEU . . . . . 0.408 ' HG ' ' H ' ' A' ' 15' ' ' LEU . 2.7 pp -79.11 156.22 28.39 Favored 'General case' 0 N--CA 1.472 0.657 0 CA-C-O 120.907 0.384 . . . . 65.42 111.994 179.82 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 16' ' ' THR . . . . . . . . . . . . . 63.5 p -95.37 -48.67 5.78 Favored 'General case' 0 N--CA 1.475 0.809 0 CA-C-O 121.084 0.468 . . . . 73.34 112.028 -177.844 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . 88.81 -58.32 4.04 Favored Glycine 0 CA--C 1.529 0.928 0 C-N-CA 121.313 -0.47 . . . . 54.22 113.171 179.764 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 18' ' ' LYS . . . . . 0.483 ' NZ ' ' HB3' ' A' ' 18' ' ' LYS . 0.3 OUTLIER -115.38 137.52 23.13 Favored Pre-proline 0 N--CA 1.471 0.617 0 O-C-N 122.536 -0.39 . . . . 50.53 111.62 -179.54 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 19' ' ' PRO . . . . . 0.423 ' HD3' ' HA ' ' A' ' 18' ' ' LYS . 35.7 Cg_exo -62.79 134.23 45.91 Favored 'Trans proline' 0 CA--C 1.543 0.933 0 C-N-CA 123.173 2.582 . . . . 72.42 113.558 -179.359 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . -83.94 88.26 1.53 Allowed Glycine 0 CA--C 1.531 1.051 0 C-N-CA 121.515 -0.374 . . . . 61.24 113.186 178.797 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -126.1 -170.39 2.18 Favored 'General case' 0 N--CA 1.47 0.565 0 CA-C-O 120.86 0.362 . . . . 71.13 111.572 -179.123 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 22' ' ' LEU . . . . . 0.446 ' HG ' ' HG3' ' A' ' 60' ' ' GLN . 95.9 mt -105.24 156.5 36.12 Favored Pre-proline 0 N--CA 1.471 0.615 0 CA-C-N 116.417 -0.356 . . . . 75.33 111.378 176.29 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 23' ' ' PRO . . . . . 0.412 ' HD2' HD21 ' A' ' 26' ' ' LEU . 39.3 Cg_exo -62.44 140.41 81.97 Favored 'Trans proline' 0 CA--C 1.543 0.97 0 C-N-CA 122.195 1.93 . . . . 73.43 112.249 171.562 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -60.66 -55.35 34.32 Favored 'General case' 0 CA--C 1.541 0.6 0 N-CA-C 112.235 0.458 . . . . 75.14 112.235 -178.907 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 61.7 m-20 -91.84 84.84 5.44 Favored 'General case' 0 CA--C 1.536 0.43 0 CA-C-O 120.914 0.388 . . . . 71.15 111.813 -177.021 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 26' ' ' LEU . . . . . 0.412 HD21 ' HD2' ' A' ' 23' ' ' PRO . 98.6 mt -84.12 -32.98 24.42 Favored 'General case' 0 CA--C 1.538 0.496 0 CA-C-O 120.881 0.372 . . . . 62.21 111.062 176.886 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 4.7 m-20 -66.29 -40.81 90.29 Favored 'General case' 0 CA--C 1.538 0.517 0 CA-C-N 116.308 -0.406 . . . . 64.51 111.562 -179.898 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 1.9 m-20 -60.39 -44.65 95.46 Favored 'General case' 0 CA--C 1.538 0.494 0 CA-C-N 116.21 -0.45 . . . . 65.33 112.05 179.506 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 29' ' ' MET . . . . . . . . . . . . . 59.0 mtm -66.46 157.48 31.94 Favored 'General case' 0 CA--C 1.54 0.573 0 CA-C-O 120.995 0.426 . . . . 63.24 111.429 179.874 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 30' ' ' LYS . . . . . 0.477 ' HB2' ' HG2' ' A' ' 33' ' ' GLU . 46.5 mtmt -78.71 160.88 27.25 Favored 'General case' 0 N--CA 1.47 0.551 0 CA-C-O 120.978 0.418 . . . . 74.51 111.902 -174.659 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 31' ' ' VAL . . . . . 0.411 HG12 ' HE3' ' A' ' 35' ' ' LYS . 47.9 t -54.8 -40.34 51.76 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.547 0 CA-C-O 121.19 0.519 . . . . 72.11 110.941 177.011 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -59.59 -39.44 84.18 Favored 'General case' 0 CA--C 1.54 0.565 0 CA-C-N 116.043 -0.526 . . . . 41.2 111.656 176.834 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 33' ' ' GLU . . . . . 0.477 ' HG2' ' HB2' ' A' ' 30' ' ' LYS . 45.8 mm-40 -64.27 -45.89 86.11 Favored 'General case' 0 CA--C 1.537 0.444 0 CA-C-O 121.195 0.522 . . . . 62.01 110.559 178.134 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 94.3 mt -59.5 -40.78 88.16 Favored 'General case' 0 N--CA 1.468 0.442 0 CA-C-N 115.963 -0.562 . . . . 72.12 111.484 178.597 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 35' ' ' LYS . . . . . 0.436 ' HA ' HD12 ' A' ' 38' ' ' LEU . 99.6 mttt -61.6 -36.93 82.11 Favored 'General case' 0 CA--C 1.538 0.517 0 CA-C-O 121.022 0.439 . . . . 60.42 111.428 177.082 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 36' ' ' GLN . . . . . 0.428 ' O ' ' HG2' ' A' ' 39' ' ' LYS . 8.4 tm0? -63.58 -42.38 98.3 Favored 'General case' 0 CA--C 1.539 0.555 0 CA-C-O 121.105 0.479 . . . . 74.43 110.748 174.357 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 37' ' ' GLU . . . . . 0.447 ' HA ' HH21 ' A' ' 41' ' ' ARG . 18.0 mm-40 -65.16 -40.52 94.44 Favored 'General case' 0 CA--C 1.541 0.6 0 CA-C-N 116.437 -0.347 . . . . 73.24 111.775 175.433 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 38' ' ' LEU . . . . . 0.516 HD11 HD22 ' A' ' 52' ' ' LEU . 86.0 mt -57.0 -52.74 64.06 Favored 'General case' 0 N--CA 1.468 0.464 0 N-CA-C 112.142 0.423 . . . . 73.1 112.142 179.377 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 39' ' ' LYS . . . . . 0.428 ' HG2' ' O ' ' A' ' 36' ' ' GLN . 17.6 ptpt -58.3 -33.92 69.98 Favored 'General case' 0 CA--C 1.542 0.64 0 CA-C-O 120.757 0.313 . . . . 75.54 111.737 -178.135 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 65.4 mt -69.06 -22.5 64.02 Favored 'General case' 0 N--CA 1.471 0.615 0 CA-C-O 121.016 0.436 . . . . 62.14 111.373 176.119 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 41' ' ' ARG . . . . . 0.447 HH21 ' HA ' ' A' ' 37' ' ' GLU . 0.6 OUTLIER -101.8 14.16 32.77 Favored 'General case' 0 CA--C 1.543 0.687 0 CA-C-N 116.12 -0.491 . . . . 72.1 111.415 178.354 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 62.5 m 63.01 18.84 11.24 Favored 'General case' 0 N--CA 1.48 1.058 0 CA-C-O 121.107 0.48 . . . . 72.23 112.237 -179.178 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 43' ' ' LEU . . . . . 0.402 HD22 ' HG2' ' A' ' 55' ' ' ARG . 76.3 mt -93.14 146.64 32.32 Favored Pre-proline 0 CA--C 1.542 0.64 0 C-N-CA 122.714 0.406 . . . . 72.03 111.526 -179.131 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 44' ' ' PRO . . . . . . . . . . . . . 73.8 Cg_endo -73.26 145.51 38.88 Favored 'Trans proline' 0 CA--C 1.541 0.841 0 C-N-CA 122.58 2.187 . . . . 61.43 112.799 178.092 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 34.1 m -88.93 19.08 0.59 Allowed 'Isoleucine or valine' 0 CA--C 1.544 0.733 0 N-CA-C 112.583 0.586 . . . . 74.41 112.583 -175.439 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 46.7 t -100.49 104.15 15.52 Favored 'General case' 0 N--CA 1.475 0.787 0 CA-C-O 120.814 0.34 . . . . 51.34 111.724 -177.929 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 171.24 -175.22 44.9 Favored Glycine 0 CA--C 1.527 0.817 0 C-N-CA 121.052 -0.594 . . . . 54.31 113.417 178.844 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 48' ' ' THR . . . . . 0.548 ' O ' ' HG ' ' A' ' 52' ' ' LEU . 43.8 p -96.98 169.2 9.99 Favored 'General case' 0 N--CA 1.472 0.666 0 O-C-N 122.661 -0.317 . . . . 63.44 111.537 -179.957 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 49' ' ' LYS . . . . . 0.404 ' HD3' HG22 ' A' ' 31' ' ' VAL . 21.4 tptm -50.16 -55.22 15.97 Favored 'General case' 0 N--CA 1.473 0.683 0 N-CA-C 111.924 0.342 . . . . 63.45 111.924 -179.686 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 50' ' ' THR . . . . . 0.44 ' O ' ' HG2' ' A' ' 54' ' ' GLU . 91.5 m -63.64 -43.77 95.82 Favored 'General case' 0 N--CA 1.471 0.583 0 CA-C-O 120.791 0.329 . . . . 75.2 111.536 178.049 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 51' ' ' GLU . . . . . 0.424 ' HB2' ' OG1' ' A' ' 48' ' ' THR . 2.6 tm-20 -55.19 -54.74 39.53 Favored 'General case' 0 CA--C 1.539 0.557 0 C-N-CA 122.896 0.478 . . . . 64.01 111.838 -177.656 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 52' ' ' LEU . . . . . 0.548 ' HG ' ' O ' ' A' ' 48' ' ' THR . 40.8 mt -55.12 -39.39 69.34 Favored 'General case' 0 N--CA 1.471 0.583 0 CA-C-O 120.902 0.382 . . . . 75.43 111.851 -177.15 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 53' ' ' ILE . . . . . . . . . . . . . 77.9 mt -61.41 -45.01 99.5 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.442 0 CA-C-O 121.31 0.576 . . . . 73.21 110.821 175.364 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 54' ' ' GLU . . . . . 0.477 ' CD ' HH21 ' A' ' 57' ' ' ARG . 8.9 mm-40 -64.93 -35.45 81.2 Favored 'General case' 0 N--CA 1.468 0.426 0 CA-C-N 115.772 -0.649 . . . . 63.35 111.207 179.064 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 55' ' ' ARG . . . . . 0.447 HH11 ' HD3' ' A' ' 55' ' ' ARG . 13.2 ttm180 -68.61 -39.76 80.69 Favored 'General case' 0 CA--C 1.541 0.599 0 CA-C-N 116.16 -0.473 . . . . 72.03 110.647 178.165 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 59.1 mt -59.75 -53.23 60.34 Favored 'General case' 0 N--CA 1.47 0.559 0 CA-C-N 116.293 -0.412 . . . . 72.14 111.228 174.138 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 57' ' ' ARG . . . . . 0.477 HH21 ' CD ' ' A' ' 54' ' ' GLU . 40.5 mtm105 -57.38 -45.89 83.97 Favored 'General case' 0 CA--C 1.537 0.47 0 CA-C-O 120.687 0.279 . . . . 75.04 111.442 179.594 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 58' ' ' ALA . . . . . 0.427 ' O ' ' HG3' ' A' ' 62' ' ' GLN . . . -60.33 -34.39 73.75 Favored 'General case' 0 N--CA 1.47 0.531 0 N-CA-C 112.115 0.413 . . . . 51.03 112.115 -179.624 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 59' ' ' TYR . . . . . . . . . . . . . 71.2 t80 -75.27 -54.17 7.53 Favored 'General case' 0 CA--C 1.539 0.549 0 CA-C-O 120.962 0.411 . . . . 74.22 111.555 179.176 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 60' ' ' GLN . . . . . 0.446 ' HG3' ' HG ' ' A' ' 22' ' ' LEU . 24.4 tm0? -60.26 -32.57 71.29 Favored 'General case' 0 CA--C 1.542 0.66 0 CA-C-O 120.923 0.392 . . . . 73.31 111.072 -177.865 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 61' ' ' ASP . . . . . . . . . . . . . 15.8 t70 -57.53 -29.96 64.79 Favored 'General case' 0 CA--C 1.545 0.756 0 C-N-CA 122.977 0.511 . . . . 70.53 111.909 175.169 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 62' ' ' GLN . . . . . 0.427 ' HG3' ' O ' ' A' ' 58' ' ' ALA . 68.9 mt-30 -80.3 -35.37 35.84 Favored 'General case' 0 N--CA 1.473 0.68 0 CA-C-O 120.889 0.376 . . . . 64.33 112.002 -177.487 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 63' ' ' ILE . . . . . . . . . . . . . 34.1 pt -86.59 -21.45 7.4 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.576 0 CA-C-O 120.876 0.37 . . . . 61.34 111.818 -179.356 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 41.2 t -94.04 134.12 26.48 Favored Pre-proline 0 N--CA 1.471 0.604 0 CA-C-N 116.553 -0.294 . . . . 70.04 111.36 179.703 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 65' ' ' PRO . . . . . . . . . . . . . 38.1 Cg_exo -58.09 104.57 0.18 Allowed 'Trans proline' 0 C--N 1.353 0.765 0 C-N-CA 122.582 2.188 . . . . 72.42 112.857 177.868 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 66' ' ' VAL . . . . . 0.531 ' HB ' ' HD2' ' A' ' 67' ' ' PRO . 35.1 m -68.03 160.78 72.6 Favored Pre-proline 0 CA--C 1.542 0.672 0 CA-C-N 116.259 -0.428 . . . . 73.33 111.182 178.994 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 67' ' ' PRO . . . . . 0.531 ' HD2' ' HB ' ' A' ' 66' ' ' VAL . 10.9 Cg_endo -53.21 -25.31 29.45 Favored 'Trans proline' 0 CA--C 1.544 0.997 0 C-N-CA 122.488 2.125 . . . . 54.12 113.809 -178.081 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . -83.53 -20.14 60.7 Favored Glycine 0 CA--C 1.528 0.887 0 C-N-CA 121.133 -0.556 . . . . 53.45 113.358 178.237 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . -92.94 154.37 41.87 Favored Pre-proline 0 CA--C 1.542 0.639 0 O-C-N 122.49 -0.418 . . . . 72.44 111.598 -178.137 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 70' ' ' PRO . . . . . . . . . . . . . 89.8 Cg_endo -79.36 153.14 23.97 Favored 'Trans proline' 0 CA--C 1.542 0.899 0 C-N-CA 122.579 2.186 . . . . 65.25 112.785 175.921 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 4.0 mppt? -86.37 136.59 33.07 Favored 'General case' 0 N--CA 1.47 0.566 0 O-C-N 122.341 -0.224 . . . . 71.31 110.97 178.403 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . 69.79 85.74 0.13 Allowed Pre-proline 0 N--CA 1.472 0.653 0 C-N-CA 123.133 0.573 . . . . 73.42 111.747 -174.978 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 73' ' ' PRO . . . . . . . . . . . . . 94.4 Cg_endo -77.37 -154.95 0.05 OUTLIER 'Trans proline' 0 CA--C 1.541 0.864 0 C-N-CA 122.841 2.361 . . . . 64.51 112.672 178.764 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -60.83 90.78 0.02 OUTLIER 'General case' 0 CA--C 1.541 0.606 0 CA-C-O 120.977 0.418 . . . . 72.3 111.995 178.752 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.254 1.32 0 CA-C-O 118.826 -0.607 . . . . 43.23 111.685 177.765 . . . . . . . . 0 0 . 1 . 007 nuclear build full ' A' A ' 1' ' ' MET . . . . . 0.497 ' SD ' ' N ' ' A' ' 1' ' ' MET . 1.2 mpt? . . . . . 0 N--CA 1.491 1.587 0 CA-C-O 120.752 0.31 . . . . 60.55 111.248 . . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . -92.45 96.41 2.14 Favored Glycine 0 CA--C 1.528 0.853 0 C-N-CA 121.2 -0.524 . . . . 61.0 112.7 177.817 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 3' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -60.95 -21.52 63.54 Favored 'General case' 0 N--CA 1.473 0.678 0 N-CA-C 112.558 0.577 . . . . 61.25 112.558 -178.514 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 4' ' ' HIS . . . . . . . . . . . . . 86.1 m-70 -141.34 102.49 4.23 Favored 'General case' 0 N--CA 1.47 0.53 0 CA-C-O 120.967 0.413 . . . . 62.54 110.614 175.761 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 5' ' ' HIS . . . . . . . . . . . . . 58.1 m80 -74.88 113.23 11.93 Favored 'General case' 0 CA--C 1.538 0.487 0 CA-C-O 121.122 0.486 . . . . 75.32 111.726 -177.52 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 73.6 m80 -85.81 125.53 33.34 Favored 'General case' 0 CA--C 1.535 0.396 0 CA-C-N 116.185 -0.462 . . . . 72.53 111.105 -179.334 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 80.0 m80 -75.37 120.16 20.45 Favored 'General case' 0 CA--C 1.537 0.473 0 CA-C-O 121.046 0.451 . . . . 55.11 111.155 179.092 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 8' ' ' HIS . . . . . . . . . . . . . 49.6 m80 -79.87 116.1 19.83 Favored 'General case' 0 CA--C 1.538 0.509 0 CA-C-N 116.224 -0.444 . . . . 71.22 112.073 -176.489 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 32.5 t -160.68 148.5 16.02 Favored 'General case' 0 N--CA 1.469 0.495 0 CA-C-N 116.318 -0.401 . . . . 71.34 110.759 176.162 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 33.2 m80 -82.92 166.68 18.68 Favored 'General case' 0 CA--C 1.538 0.496 0 CA-C-O 121.263 0.554 . . . . 64.31 111.945 -176.048 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 11' ' ' MET . . . . . . . . . . . . . 76.7 mmm -104.53 6.3 34.59 Favored 'General case' 0 CA--C 1.54 0.572 0 CA-C-N 115.671 -0.695 . . . . 74.02 110.77 174.965 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 51.0 m -76.73 -162.01 0.24 Allowed 'General case' 0 CA--C 1.542 0.66 0 CA-C-N 116.027 -0.533 . . . . 74.2 111.921 -178.312 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 13' ' ' THR . . . . . 0.4 ' HA ' ' HD3' ' A' ' 14' ' ' PRO . 70.9 p -57.75 136.39 82.99 Favored Pre-proline 0 N--CA 1.471 0.594 0 N-CA-C 111.946 0.35 . . . . 63.15 111.946 178.984 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 14' ' ' PRO . . . . . 0.4 ' HD3' ' HA ' ' A' ' 13' ' ' THR . 32.0 Cg_exo -59.27 157.1 31.87 Favored 'Trans proline' 0 CA--C 1.54 0.785 0 C-N-CA 122.631 2.221 . . . . 72.31 112.963 177.888 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 72.4 mt -79.69 166.14 22.12 Favored 'General case' 0 CA--C 1.536 0.413 0 CA-C-O 121.02 0.438 . . . . 42.53 111.596 -179.733 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 16' ' ' THR . . . . . . . . . . . . . 9.0 t -121.4 140.6 51.92 Favored 'General case' 0 N--CA 1.471 0.589 0 CA-C-O 121.094 0.473 . . . . 73.54 111.559 179.904 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . -90.18 -179.75 44.04 Favored Glycine 0 CA--C 1.527 0.844 0 C-N-CA 120.992 -0.623 . . . . 34.45 113.53 -179.881 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 57.0 mtmt -113.31 146.28 34.98 Favored Pre-proline 0 CA--C 1.543 0.678 0 O-C-N 122.581 -0.364 . . . . 72.53 111.317 178.995 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 63.7 Cg_endo -72.4 155.13 55.81 Favored 'Trans proline' 0 CA--C 1.543 0.928 0 C-N-CA 122.652 2.235 . . . . 71.3 113.136 179.861 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . -77.03 65.46 2.97 Favored Glycine 0 CA--C 1.527 0.839 0 CA-C-N 116.217 -0.447 . . . . 23.22 113.097 179.759 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -166.02 -172.31 2.27 Favored 'General case' 0 N--CA 1.468 0.429 0 C-N-CA 122.785 0.434 . . . . 72.23 110.513 -178.747 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 22' ' ' LEU . . . . . 0.542 ' HG ' ' HG3' ' A' ' 60' ' ' GLN . 97.2 mt -60.47 135.74 91.82 Favored Pre-proline 0 CA--C 1.539 0.527 0 N-CA-C 111.83 0.308 . . . . 73.33 111.83 178.25 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 23' ' ' PRO . . . . . 0.449 ' O ' ' HG ' ' A' ' 26' ' ' LEU . 39.8 Cg_endo -67.82 120.7 7.71 Favored 'Trans proline' 0 CA--C 1.539 0.735 0 C-N-CA 122.186 1.924 . . . . 71.42 111.715 174.409 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -57.06 -11.95 1.84 Allowed 'General case' 0 N--CA 1.475 0.798 0 N-CA-C 112.861 0.689 . . . . 52.3 112.861 -177.201 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 25' ' ' ASN . . . . . 0.544 ' HB3' ' HB2' ' A' ' 28' ' ' ASP . 18.8 m120 -92.38 33.76 1.08 Allowed 'General case' 0 CA--C 1.542 0.651 0 N-CA-C 112.265 0.468 . . . . 72.43 112.265 179.408 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 26' ' ' LEU . . . . . 0.449 ' HG ' ' O ' ' A' ' 23' ' ' PRO . 95.6 mt -54.23 -33.16 57.73 Favored 'General case' 0 N--CA 1.474 0.762 0 CA-C-O 120.785 0.326 . . . . 72.34 111.859 -179.671 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 11.3 m-20 -69.15 -38.94 79.04 Favored 'General case' 0 N--CA 1.47 0.548 0 CA-C-O 120.826 0.346 . . . . 73.53 111.554 175.159 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 28' ' ' ASP . . . . . 0.544 ' HB2' ' HB3' ' A' ' 25' ' ' ASN . 6.3 m-20 -69.64 -32.61 71.38 Favored 'General case' 0 CA--C 1.539 0.549 0 CA-C-N 116.285 -0.416 . . . . 55.01 111.319 179.057 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 29' ' ' MET . . . . . . . . . . . . . 84.2 mtp -66.32 140.33 58.1 Favored 'General case' 0 N--CA 1.468 0.426 0 CA-C-O 121.001 0.429 . . . . 74.53 111.307 178.82 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 55.1 mtmt -79.1 158.94 27.7 Favored 'General case' 0 CA--C 1.541 0.605 0 CA-C-O 120.945 0.403 . . . . 72.33 111.899 -177.892 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 94.9 t -49.58 -49.26 19.45 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.7 0 N-CA-C 112.842 0.682 . . . . 51.34 112.842 -176.097 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -57.92 -37.69 74.53 Favored 'General case' 0 N--CA 1.469 0.524 0 CA-C-O 120.855 0.359 . . . . 70.24 111.591 179.657 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 40.6 mt-10 -65.84 -48.55 71.26 Favored 'General case' 0 N--CA 1.466 0.338 0 CA-C-N 116.214 -0.448 . . . . 73.54 111.172 178.347 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 91.5 mt -58.55 -45.37 89.07 Favored 'General case' 0 N--CA 1.469 0.477 0 CA-C-O 120.965 0.412 . . . . 74.24 111.293 178.25 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 35' ' ' LYS . . . . . 0.499 ' HA ' HD12 ' A' ' 38' ' ' LEU . 98.0 mttt -62.83 -31.28 72.25 Favored 'General case' 0 CA--C 1.54 0.592 0 CA-C-O 121.003 0.43 . . . . 74.34 111.565 177.159 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 36' ' ' GLN . . . . . 0.407 ' O ' ' HG ' ' A' ' 40' ' ' LEU . 23.7 tm0? -70.05 -43.91 70.24 Favored 'General case' 0 CA--C 1.542 0.656 0 CA-C-O 121.06 0.457 . . . . 54.45 109.85 175.192 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 37' ' ' GLU . . . . . 0.474 ' HB3' ' NH2' ' A' ' 41' ' ' ARG . 52.8 mm-40 -58.15 -32.66 68.39 Favored 'General case' 0 N--CA 1.473 0.682 0 CA-C-N 115.945 -0.571 . . . . 63.42 111.86 174.436 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 38' ' ' LEU . . . . . 0.499 HD12 ' HA ' ' A' ' 35' ' ' LYS . 99.1 mt -69.45 -58.23 4.25 Favored 'General case' 0 CA--C 1.539 0.547 0 CA-C-N 116.289 -0.414 . . . . 53.1 111.913 178.116 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 39' ' ' LYS . . . . . 0.4 ' HB3' ' NZ ' ' A' ' 39' ' ' LYS . 0.3 OUTLIER -57.83 -31.62 66.82 Favored 'General case' 0 N--CA 1.474 0.741 0 N-CA-C 112.373 0.508 . . . . 75.41 112.373 -174.059 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 40' ' ' LEU . . . . . 0.407 ' HG ' ' O ' ' A' ' 36' ' ' GLN . 95.9 mt -58.96 -35.2 72.76 Favored 'General case' 0 N--CA 1.474 0.74 0 CA-C-O 121.18 0.514 . . . . 74.04 111.764 176.908 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 41' ' ' ARG . . . . . 0.508 ' HB3' ' CE2' ' A' ' 59' ' ' TYR . 16.5 mtm180 -114.21 34.25 4.79 Favored 'General case' 0 CA--C 1.54 0.573 0 CA-C-N 116.034 -0.53 . . . . 74.32 112.366 -173.505 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 32.4 t 69.05 10.17 7.77 Favored 'General case' 0 N--CA 1.479 0.99 0 N-CA-C 113.048 0.759 . . . . 72.24 113.048 172.482 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 43' ' ' LEU . . . . . 0.428 HD22 ' HG2' ' A' ' 55' ' ' ARG . 83.4 mt -88.8 142.0 30.28 Favored Pre-proline 0 CA--C 1.543 0.676 0 N-CA-C 112.126 0.417 . . . . 32.54 112.126 -177.562 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 44' ' ' PRO . . . . . 0.49 ' HG2' HH11 ' A' ' 55' ' ' ARG . 75.6 Cg_endo -76.05 143.38 25.81 Favored 'Trans proline' 0 CA--C 1.544 0.988 0 C-N-CA 123.036 2.491 . . . . 53.2 113.362 178.754 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 25.8 m -97.57 -0.05 10.47 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.711 0 N-CA-C 112.716 0.636 . . . . 53.53 112.716 -176.006 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 19.7 p -79.83 45.89 0.74 Allowed 'General case' 0 N--CA 1.475 0.806 0 N-CA-C 112.866 0.691 . . . . 64.41 112.866 -176.258 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . -131.54 173.77 20.35 Favored Glycine 0 CA--C 1.531 1.032 0 C-N-CA 121.079 -0.582 . . . . 63.42 113.6 179.607 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 48' ' ' THR . . . . . 0.59 ' O ' ' HG ' ' A' ' 52' ' ' LEU . 68.7 p -81.43 173.45 12.42 Favored 'General case' 0 N--CA 1.473 0.7 0 C-N-CA 122.487 0.315 . . . . 74.03 111.287 177.548 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 24.3 tptm -50.17 -50.38 49.35 Favored 'General case' 0 N--CA 1.473 0.709 0 CA-C-O 120.829 0.347 . . . . 75.5 111.599 -179.871 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 50' ' ' THR . . . . . . . . . . . . . 86.5 m -62.84 -39.93 95.88 Favored 'General case' 0 N--CA 1.47 0.542 0 CA-C-N 116.351 -0.386 . . . . 34.35 111.368 177.365 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 61.4 mm-40 -61.06 -42.2 98.05 Favored 'General case' 0 N--CA 1.469 0.501 0 N-CA-C 111.892 0.33 . . . . 71.34 111.892 178.423 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 52' ' ' LEU . . . . . 0.59 ' HG ' ' O ' ' A' ' 48' ' ' THR . 31.4 mt -58.16 -49.84 75.62 Favored 'General case' 0 CA--C 1.538 0.519 0 CA-C-O 121.323 0.582 . . . . 51.15 110.294 177.999 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 53' ' ' ILE . . . . . 0.466 ' O ' ' HG3' ' A' ' 57' ' ' ARG . 72.5 mt -63.4 -55.71 21.42 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.666 0 CA-C-N 115.623 -0.717 . . . . 64.34 111.944 179.704 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 15.3 mm-40 -59.39 -42.36 91.55 Favored 'General case' 0 N--CA 1.472 0.663 0 N-CA-C 112.233 0.457 . . . . 72.22 112.233 -177.96 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 55' ' ' ARG . . . . . 0.49 HH11 ' HG2' ' A' ' 44' ' ' PRO . 10.5 ttm180 -66.11 -35.23 79.95 Favored 'General case' 0 CA--C 1.539 0.553 0 CA-C-O 120.892 0.377 . . . . 65.12 110.792 -178.743 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 45.8 mt -63.04 -51.48 66.57 Favored 'General case' 0 N--CA 1.469 0.507 0 CA-C-N 116.355 -0.384 . . . . 75.42 111.254 172.696 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 57' ' ' ARG . . . . . 0.466 ' HG3' ' O ' ' A' ' 53' ' ' ILE . 29.3 mtp-105 -58.53 -51.66 68.96 Favored 'General case' 0 N--CA 1.47 0.549 0 CA-C-N 116.424 -0.353 . . . . 74.24 111.647 -177.041 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -57.8 -53.21 60.78 Favored 'General case' 0 CA--C 1.539 0.553 0 CA-C-N 116.297 -0.411 . . . . 71.34 111.893 -179.702 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 59' ' ' TYR . . . . . 0.508 ' CE2' ' HB3' ' A' ' 41' ' ' ARG . 72.1 t80 -57.59 -58.68 7.26 Favored 'General case' 0 N--CA 1.471 0.58 0 CA-C-O 121.041 0.448 . . . . 73.22 111.778 179.772 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 60' ' ' GLN . . . . . 0.542 ' HG3' ' HG ' ' A' ' 22' ' ' LEU . 0.6 OUTLIER -56.69 -31.38 64.41 Favored 'General case' 0 CA--C 1.546 0.819 0 CA-C-N 116.147 -0.478 . . . . 74.34 111.349 -175.278 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 61' ' ' ASP . . . . . . . . . . . . . 17.8 t70 -79.35 -45.77 18.95 Favored 'General case' 0 CA--C 1.542 0.657 0 CA-C-O 120.862 0.363 . . . . 45.22 111.884 -179.865 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 62' ' ' GLN . . . . . . . . . . . . . 14.1 pt20 -70.53 -32.03 69.32 Favored 'General case' 0 CA--C 1.542 0.655 0 N-CA-C 112.455 0.539 . . . . 70.41 112.455 -174.654 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 63' ' ' ILE . . . . . 0.461 ' O ' ' HB1' ' A' ' 74' ' ' ALA . 34.8 pt -65.37 -17.98 23.02 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.725 0 N-CA-C 111.942 0.349 . . . . 75.14 111.942 -179.691 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 34.4 t 73.3 85.43 0.11 Allowed Pre-proline 0 N--CA 1.474 0.749 0 C-N-CA 123.119 0.568 . . . . 74.5 111.374 -178.26 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 65' ' ' PRO . . . . . . . . . . . . . 93.7 Cg_endo -80.35 -175.83 2.89 Favored 'Trans proline' 0 CA--C 1.539 0.758 0 C-N-CA 122.948 2.432 . . . . 72.13 113.824 -177.042 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 66' ' ' VAL . . . . . 0.401 HG12 ' H ' ' A' ' 71' ' ' LYS . 19.5 m -90.68 122.04 67.49 Favored Pre-proline 0 CA--C 1.542 0.656 0 CA-C-N 115.988 -0.551 . . . . 64.21 111.639 177.815 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 67' ' ' PRO . . . . . . . . . . . . . 8.6 Cg_exo -72.49 65.0 3.74 Favored 'Trans proline' 0 CA--C 1.541 0.837 0 C-N-CA 122.547 2.165 . . . . 64.12 111.864 177.174 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 80.25 -57.19 4.66 Favored Glycine 0 CA--C 1.527 0.799 0 C-N-CA 121.368 -0.444 . . . . 50.4 112.604 -176.215 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . -87.43 149.3 46.43 Favored Pre-proline 0 CA--C 1.541 0.608 0 C-N-CA 122.264 0.226 . . . . 62.11 111.344 177.742 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 70' ' ' PRO . . . . . . . . . . . . . 35.4 Cg_endo -63.85 87.42 0.14 Allowed 'Trans proline' 0 CA--C 1.543 0.932 0 C-N-CA 122.382 2.054 . . . . 65.14 112.843 -179.5 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 71' ' ' LYS . . . . . 0.401 ' H ' HG12 ' A' ' 66' ' ' VAL . 39.5 ttpt -63.55 -59.57 4.46 Favored 'General case' 0 CA--C 1.539 0.553 0 CA-C-N 116.139 -0.482 . . . . 54.43 111.921 -179.443 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -179.66 146.16 0.44 Allowed Pre-proline 0 N--CA 1.471 0.602 0 CA-C-N 116.267 -0.424 . . . . 71.24 110.891 -178.352 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 73' ' ' PRO . . . . . . . . . . . . . 26.2 Cg_endo -61.8 106.81 0.47 Allowed 'Trans proline' 0 CA--C 1.54 0.81 0 C-N-CA 122.376 2.051 . . . . 72.12 111.964 176.335 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 74' ' ' ALA . . . . . 0.461 ' HB1' ' O ' ' A' ' 63' ' ' ILE . . . -94.38 -179.68 5.0 Favored 'General case' 0 N--CA 1.469 0.514 0 N-CA-C 112.796 0.665 . . . . 52.01 112.796 -173.939 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.254 1.303 0 CA-C-O 118.004 -0.998 . . . . 64.11 111.816 -177.416 . . . . . . . . 0 0 . 1 . 008 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 65.3 mtm . . . . . 0 N--CA 1.49 1.575 0 CA-C-O 120.531 0.205 . . . . 64.3 111.264 . . . . . . . . . 0 0 . 1 . 008 nuclear build full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . -50.18 112.69 1.6 Allowed Glycine 0 CA--C 1.534 1.229 0 N-CA-C 115.286 0.875 . . . . 21.0 115.286 -176.268 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 3' ' ' HIS . . . . . . . . . . . . . 41.3 p-80 -137.42 37.06 2.48 Favored 'General case' 0 N--CA 1.471 0.575 0 CA-C-O 121.732 0.777 . . . . 63.11 109.278 172.252 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 4' ' ' HIS . . . . . . . . . . . . . 49.0 t-80 -84.31 29.53 0.58 Allowed 'General case' 0 CA--C 1.55 0.965 0 CA-C-N 114.817 -1.083 . . . . 62.24 112.538 -167.982 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 5' ' ' HIS . . . . . . . . . . . . . 41.4 p-80 -65.96 140.63 58.33 Favored 'General case' 0 CA--C 1.545 0.767 0 CA-C-O 120.917 0.389 . . . . 75.2 112.047 -176.615 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 89.2 m-70 -132.92 167.65 19.86 Favored 'General case' 0 N--CA 1.471 0.603 0 CA-C-O 121.293 0.568 . . . . 74.23 112.067 177.95 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 55.7 t-80 -165.35 131.15 2.64 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 115.468 -0.787 . . . . 74.44 109.973 174.388 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 8' ' ' HIS . . . . . . . . . . . . . 22.1 p80 -154.57 179.17 9.3 Favored 'General case' 0 CA--C 1.537 0.452 0 CA-C-O 120.582 0.229 . . . . 74.41 111.313 -178.853 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 86.8 p -71.5 -175.97 1.43 Allowed 'General case' 0 N--CA 1.472 0.663 0 CA-C-O 120.884 0.373 . . . . 75.03 111.203 179.038 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 51.1 m80 -114.46 -67.17 1.02 Allowed 'General case' 0 N--CA 1.469 0.503 0 N-CA-C 112.497 0.555 . . . . 71.11 112.497 -178.29 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 11' ' ' MET . . . . . . . . . . . . . 48.4 ttm -151.09 132.9 15.01 Favored 'General case' 0 CA--C 1.535 0.386 0 CA-C-O 121.05 0.452 . . . . 54.43 112.123 -172.75 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 48.7 m -87.39 97.1 10.62 Favored 'General case' 0 CA--C 1.535 0.369 0 N-CA-C 109.982 -0.377 . . . . 72.01 109.982 174.386 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 13' ' ' THR . . . . . . . . . . . . . 81.5 p -60.36 125.62 82.32 Favored Pre-proline 0 N--CA 1.472 0.659 0 N-CA-C 112.859 0.688 . . . . 71.21 112.859 -173.447 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 14' ' ' PRO . . . . . . . . . . . . . 22.6 Cg_exo -64.64 85.53 0.17 Allowed 'Trans proline' 0 CA--C 1.541 0.826 0 C-N-CA 122.548 2.165 . . . . 75.35 111.461 172.615 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 15' ' ' LEU . . . . . 0.463 ' O ' HD12 ' A' ' 15' ' ' LEU . 3.7 pp -61.29 147.65 43.86 Favored 'General case' 0 N--CA 1.47 0.556 0 N-CA-C 113.069 0.766 . . . . 74.3 113.069 -174.22 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 16' ' ' THR . . . . . . . . . . . . . 8.8 t -134.39 164.38 27.56 Favored 'General case' 0 N--CA 1.47 0.568 0 CA-C-N 115.91 -0.587 . . . . 75.23 111.2 175.728 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . 138.69 -164.32 25.74 Favored Glycine 0 CA--C 1.529 0.917 0 C-N-CA 121.199 -0.524 . . . . 75.14 113.072 -178.143 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 13.7 ptmm? -145.2 146.41 30.37 Favored Pre-proline 0 CA--C 1.541 0.607 0 O-C-N 122.507 -0.408 . . . . 64.31 111.687 -179.808 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 90.5 Cg_endo -82.7 -157.54 0.08 OUTLIER 'Trans proline' 0 CA--C 1.541 0.827 0 C-N-CA 122.463 2.109 . . . . 43.51 112.525 172.944 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . 157.4 -104.45 0.25 Allowed Glycine 0 CA--C 1.523 0.539 0 C-N-CA 121.119 -0.563 . . . . 71.44 112.562 177.745 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . 179.85 -170.67 0.15 Allowed 'General case' 0 N--CA 1.472 0.669 0 CA-C-O 121.031 0.443 . . . . 71.55 111.636 -176.324 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 92.9 mt -105.4 160.21 26.83 Favored Pre-proline 0 CA--C 1.544 0.75 0 C-N-CA 122.793 0.437 . . . . 72.33 110.441 175.833 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 23' ' ' PRO . . . . . . . . . . . . . 35.9 Cg_endo -65.99 131.87 28.42 Favored 'Trans proline' 0 CA--C 1.544 0.978 0 C-N-CA 122.042 1.828 . . . . 71.1 112.283 174.859 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -68.08 -27.94 66.93 Favored 'General case' 0 N--CA 1.472 0.643 0 N-CA-C 112.266 0.469 . . . . 73.3 112.266 -177.02 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 19.6 m120 -87.18 52.41 2.5 Favored 'General case' 0 CA--C 1.539 0.543 0 CA-C-O 121.058 0.456 . . . . 63.42 112.056 -179.799 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 26' ' ' LEU . . . . . 0.456 ' HB2' HG23 ' A' ' 53' ' ' ILE . 87.5 mt -60.75 -27.71 68.15 Favored 'General case' 0 N--CA 1.469 0.518 0 CA-C-O 121.251 0.548 . . . . 62.24 110.662 173.835 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 7.6 p-10 -67.82 -28.91 67.98 Favored 'General case' 0 CA--C 1.54 0.579 0 CA-C-N 115.836 -0.62 . . . . 74.21 111.63 176.69 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 26.0 t70 -76.7 -39.71 51.12 Favored 'General case' 0 CA--C 1.54 0.578 0 CA-C-N 116.463 -0.335 . . . . 74.43 111.776 -178.963 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 29' ' ' MET . . . . . . . . . . . . . 58.6 mtm -68.56 157.62 35.65 Favored 'General case' 0 N--CA 1.471 0.614 0 CA-C-O 121.549 0.69 . . . . 65.55 112.366 -177.398 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 30' ' ' LYS . . . . . 0.44 ' HB2' ' HG2' ' A' ' 33' ' ' GLU . 50.5 mtmt -69.92 156.58 38.88 Favored 'General case' 0 CA--C 1.539 0.524 0 CA-C-N 115.535 -0.757 . . . . 75.51 112.138 -179.289 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 42.2 t -54.51 -42.71 60.79 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.561 0 CA-C-N 116.12 -0.491 . . . . 70.04 111.273 178.039 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -60.87 -33.74 73.54 Favored 'General case' 0 CA--C 1.54 0.57 0 CA-C-N 116.061 -0.518 . . . . 62.45 111.778 177.913 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 33' ' ' GLU . . . . . 0.44 ' HG2' ' HB2' ' A' ' 30' ' ' LYS . 36.9 mm-40 -67.37 -45.01 77.54 Favored 'General case' 0 N--CA 1.468 0.441 0 CA-C-O 121.122 0.487 . . . . 73.34 110.662 177.185 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 63.4 mt -58.75 -48.3 81.66 Favored 'General case' 0 CA--C 1.537 0.459 0 CA-C-N 115.954 -0.566 . . . . 75.33 110.973 177.481 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 35' ' ' LYS . . . . . 0.418 ' HA ' HD12 ' A' ' 38' ' ' LEU . 98.7 mttt -63.1 -29.6 70.94 Favored 'General case' 0 CA--C 1.54 0.564 0 CA-C-N 116.182 -0.463 . . . . 65.21 111.603 176.964 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 36' ' ' GLN . . . . . 0.553 ' HA ' ' HE3' ' A' ' 39' ' ' LYS . 56.8 tp60 -65.5 -49.72 67.95 Favored 'General case' 0 CA--C 1.537 0.474 0 CA-C-O 121.011 0.434 . . . . 73.34 110.654 174.701 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 7.8 mm-40 -63.45 -21.84 66.53 Favored 'General case' 0 CA--C 1.545 0.759 0 CA-C-O 121.128 0.49 . . . . 75.43 111.621 178.794 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 38' ' ' LEU . . . . . 0.46 ' CD1' HD22 ' A' ' 52' ' ' LEU . 94.8 mt -75.65 -56.24 4.88 Favored 'General case' 0 CA--C 1.539 0.531 0 CA-C-N 116.445 -0.343 . . . . 75.34 111.583 174.736 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 39' ' ' LYS . . . . . 0.553 ' HE3' ' HA ' ' A' ' 36' ' ' GLN . 17.0 ptpt -57.64 -35.96 71.21 Favored 'General case' 0 CA--C 1.543 0.682 0 CA-C-O 120.7 0.286 . . . . 74.32 111.682 -176.727 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 40' ' ' LEU . . . . . 0.469 ' HG ' ' O ' ' A' ' 36' ' ' GLN . 88.3 mt -66.32 -23.56 66.39 Favored 'General case' 0 N--CA 1.472 0.673 0 N-CA-C 111.855 0.317 . . . . 75.4 111.855 -179.793 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 41' ' ' ARG . . . . . 0.784 HH22 ' HA ' ' A' ' 56' ' ' LEU . 52.5 mtm180 -114.07 15.41 18.35 Favored 'General case' 0 CA--C 1.541 0.629 0 N-CA-C 111.987 0.366 . . . . 72.33 111.987 -176.612 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 33.3 t 63.23 73.68 0.45 Allowed 'General case' 0 N--CA 1.477 0.892 0 CA-C-O 121.146 0.498 . . . . 74.12 111.896 -179.056 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 43' ' ' LEU . . . . . 0.425 HD21 ' CD2' ' A' ' 59' ' ' TYR . 68.3 mt -144.3 143.74 23.21 Favored Pre-proline 0 N--CA 1.47 0.557 0 CA-C-N 116.183 -0.462 . . . . 63.14 111.616 -177.773 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 44' ' ' PRO . . . . . . . . . . . . . 56.7 Cg_endo -69.54 127.62 15.03 Favored 'Trans proline' 0 CA--C 1.543 0.933 0 C-N-CA 122.704 2.269 . . . . 74.03 113.09 178.868 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 33.6 m -96.91 23.05 0.94 Allowed 'Isoleucine or valine' 0 CA--C 1.544 0.736 0 CA-C-O 120.978 0.418 . . . . 64.11 112.068 -177.226 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 54.0 m -84.73 -8.33 58.88 Favored 'General case' 0 N--CA 1.477 0.917 0 N-CA-C 113.206 0.817 . . . . 53.21 113.206 -175.023 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . -87.3 170.74 41.3 Favored Glycine 0 CA--C 1.531 1.046 0 C-N-CA 120.928 -0.653 . . . . 73.34 113.824 -176.485 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 48' ' ' THR . . . . . 0.606 ' O ' ' HG ' ' A' ' 52' ' ' LEU . 63.1 p -77.31 167.69 21.29 Favored 'General case' 0 N--CA 1.477 0.91 0 O-C-N 122.637 -0.331 . . . . 64.12 111.359 177.511 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 65.0 tttm -48.37 -48.34 36.75 Favored 'General case' 0 N--CA 1.476 0.825 0 N-CA-C 112.357 0.503 . . . . 72.53 112.357 -176.364 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 50' ' ' THR . . . . . . . . . . . . . 87.3 m -64.55 -39.75 94.32 Favored 'General case' 0 N--CA 1.474 0.743 0 CA-C-O 120.949 0.404 . . . . 64.24 111.904 178.748 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 43.5 mt-10 -64.88 -40.71 95.54 Favored 'General case' 0 N--CA 1.472 0.634 0 CA-C-O 120.86 0.362 . . . . 71.12 111.331 177.933 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 52' ' ' LEU . . . . . 0.606 ' HG ' ' O ' ' A' ' 48' ' ' THR . 47.7 mt -58.34 -50.99 71.67 Favored 'General case' 0 CA--C 1.535 0.398 0 CA-C-O 121.082 0.468 . . . . 73.04 110.024 176.754 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 53' ' ' ILE . . . . . 0.456 HG23 ' HB2' ' A' ' 26' ' ' LEU . 85.2 mt -53.26 -54.73 16.19 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.577 0 CA-C-N 115.742 -0.663 . . . . 63.42 111.732 177.036 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -58.57 -38.43 77.87 Favored 'General case' 0 CA--C 1.537 0.443 0 CA-C-N 116.386 -0.37 . . . . 64.44 111.859 -178.974 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 55' ' ' ARG . . . . . 0.425 HH11 ' HD2' ' A' ' 55' ' ' ARG . 15.9 ttt180 -76.89 -25.1 52.64 Favored 'General case' 0 CA--C 1.541 0.613 0 O-C-N 122.112 -0.367 . . . . 52.44 111.257 -179.792 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 56' ' ' LEU . . . . . 0.784 ' HA ' HH22 ' A' ' 41' ' ' ARG . 85.2 mt -62.82 -49.34 75.31 Favored 'General case' 0 C--O 1.236 0.362 0 CA-C-O 121.126 0.489 . . . . 72.32 109.843 170.48 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 58.6 mtp180 -62.91 -47.83 81.59 Favored 'General case' 0 CA--C 1.538 0.518 0 CA-C-N 115.316 -0.856 . . . . 75.21 110.828 177.078 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 58' ' ' ALA . . . . . 0.513 ' O ' ' HG3' ' A' ' 62' ' ' GLN . . . -55.67 -57.43 12.0 Favored 'General case' 0 N--CA 1.469 0.495 0 CA-C-N 116.032 -0.531 . . . . 74.4 112.17 179.821 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 59' ' ' TYR . . . . . 0.425 ' CD2' HD21 ' A' ' 43' ' ' LEU . 54.1 t80 -54.46 -38.87 66.86 Favored 'General case' 0 N--CA 1.473 0.692 0 CA-C-O 120.993 0.425 . . . . 74.01 111.363 179.635 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 60' ' ' GLN . . . . . . . . . . . . . 23.9 tm0? -69.68 -34.75 74.38 Favored 'General case' 0 CA--C 1.538 0.492 0 CA-C-O 121.094 0.473 . . . . 73.3 110.461 177.614 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 61' ' ' ASP . . . . . . . . . . . . . 34.3 t70 -70.5 -33.63 71.44 Favored 'General case' 0 CA--C 1.543 0.692 0 CA-C-N 116.175 -0.466 . . . . 74.02 111.408 178.338 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 62' ' ' GLN . . . . . 0.513 ' HG3' ' O ' ' A' ' 58' ' ' ALA . 84.7 mt-30 -59.79 -41.89 92.15 Favored 'General case' 0 N--CA 1.473 0.724 0 CA-C-O 121.147 0.498 . . . . 72.24 111.345 178.43 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 63' ' ' ILE . . . . . . . . . . . . . 27.0 pt -82.65 -27.08 8.44 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.634 0 CA-C-N 116.306 -0.407 . . . . 31.21 110.665 175.089 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 10.2 t 73.87 142.62 0.09 OUTLIER Pre-proline 0 N--CA 1.477 0.894 0 C-N-CA 123.688 0.795 . . . . 63.43 111.908 178.382 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 65' ' ' PRO . . . . . . . . . . . . . 54.6 Cg_endo -68.7 81.79 0.57 Allowed 'Trans proline' 0 C--N 1.353 0.782 0 C-N-CA 122.348 2.032 . . . . 72.4 112.97 179.518 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 66' ' ' VAL . . . . . . . . . . . . . 29.7 m -132.22 143.62 49.69 Favored Pre-proline 0 CA--C 1.543 0.708 0 CA-C-N 116.063 -0.517 . . . . 71.34 111.597 178.602 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 67' ' ' PRO . . . . . . . . . . . . . 51.7 Cg_exo -55.93 -45.31 39.61 Favored 'Trans proline' 0 CA--C 1.541 0.847 0 C-N-CA 122.589 2.192 . . . . 64.42 112.453 175.413 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . -83.78 58.09 5.03 Favored Glycine 0 CA--C 1.526 0.767 0 C-N-CA 121.196 -0.526 . . . . 62.44 112.398 175.313 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . -59.82 121.84 61.06 Favored Pre-proline 0 CA--C 1.541 0.611 0 CA-C-O 120.687 0.279 . . . . 63.24 111.582 -179.633 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 70' ' ' PRO . . . . . . . . . . . . . 61.0 Cg_endo -71.43 -14.46 30.92 Favored 'Trans proline' 0 CA--C 1.54 0.801 0 C-N-CA 122.7 2.267 . . . . 42.14 113.847 -175.879 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 71' ' ' LYS . . . . . 0.591 ' HD2' ' O ' ' A' ' 72' ' ' ALA . 0.1 OUTLIER -67.64 158.54 31.94 Favored 'General case' 0 CA--C 1.544 0.741 0 CA-C-O 121.012 0.434 . . . . 51.13 111.793 -176.655 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 72' ' ' ALA . . . . . 0.591 ' O ' ' HD2' ' A' ' 71' ' ' LYS . . . -59.65 153.76 49.81 Favored Pre-proline 0 CA--C 1.547 0.851 0 N-CA-C 112.945 0.72 . . . . 65.31 112.945 -176.684 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 73' ' ' PRO . . . . . . . . . . . . . 81.8 Cg_exo -50.17 -15.33 1.29 Allowed 'Trans proline' 0 CA--C 1.543 0.967 0 C-N-CA 123.208 2.605 . . . . 61.31 114.176 179.037 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -51.79 120.5 5.32 Favored 'General case' 0 CA--C 1.539 0.551 0 CA-C-O 121.171 0.51 . . . . 41.21 112.368 178.279 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.252 1.195 0 CA-C-O 118.532 -0.747 . . . . 72.13 110.829 177.785 . . . . . . . . 0 0 . 1 . 009 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 64.9 mtt . . . . . 0 N--CA 1.49 1.566 0 CA-C-O 121.016 0.436 . . . . 54.02 111.316 . . . . . . . . . 0 0 . 1 . 009 nuclear build full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . 173.65 106.44 0.19 Allowed Glycine 0 CA--C 1.527 0.811 0 C-N-CA 120.974 -0.632 . . . . 70.21 113.06 179.376 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 3' ' ' HIS . . . . . . . . . . . . . 38.1 m80 -87.99 99.35 12.08 Favored 'General case' 0 CA--C 1.538 0.493 0 CA-C-O 120.766 0.317 . . . . 74.13 110.54 178.071 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 4' ' ' HIS . . . . . . . . . . . . . 13.2 t-80 -147.22 124.81 11.74 Favored 'General case' 0 CA--C 1.543 0.694 0 CA-C-O 120.738 0.304 . . . . 74.24 111.598 -173.574 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 5' ' ' HIS . . . . . . . . . . . . . 23.1 t60 -148.08 150.75 34.45 Favored 'General case' 0 CA--C 1.544 0.724 0 C-N-CA 122.744 0.418 . . . . 60.21 110.147 -179.3 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 8.3 p-80 -128.0 157.32 40.95 Favored 'General case' 0 N--CA 1.474 0.752 0 CA-C-O 120.863 0.364 . . . . 72.33 111.81 179.406 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 7.9 p80 -160.52 110.39 1.76 Allowed 'General case' 0 CA--C 1.541 0.631 0 CA-C-O 121.124 0.488 . . . . 75.44 111.701 176.219 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 8' ' ' HIS . . . . . . . . . . . . . 65.4 t60 -126.74 118.29 24.41 Favored 'General case' 0 CA--C 1.538 0.508 0 CA-C-N 116.197 -0.456 . . . . 72.41 111.172 178.814 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 47.5 t -145.72 145.23 30.78 Favored 'General case' 0 N--CA 1.471 0.581 0 CA-C-O 120.78 0.324 . . . . 73.54 111.339 179.181 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 32.8 t-80 -163.36 87.29 0.54 Allowed 'General case' 0 CA--C 1.541 0.602 0 CA-C-O 121.157 0.503 . . . . 55.12 110.757 178.335 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 11' ' ' MET . . . . . . . . . . . . . 26.3 ttt -91.4 139.45 30.71 Favored 'General case' 0 CA--C 1.543 0.675 0 CA-C-N 116.1 -0.5 . . . . 71.41 111.664 -176.702 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 67.0 m -115.72 137.58 51.95 Favored 'General case' 0 N--CA 1.475 0.823 0 CA-C-O 121.026 0.441 . . . . 75.21 111.818 179.736 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 13' ' ' THR . . . . . . . . . . . . . 74.6 p -89.77 157.53 46.25 Favored Pre-proline 0 N--CA 1.473 0.71 0 CA-C-N 116.185 -0.461 . . . . 72.4 111.401 -179.3 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 14' ' ' PRO . . . . . . . . . . . . . 63.3 Cg_exo -53.78 143.98 56.58 Favored 'Trans proline' 0 CA--C 1.543 0.937 0 C-N-CA 122.701 2.267 . . . . 65.21 113.389 177.007 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 86.5 mt -97.0 112.01 23.97 Favored 'General case' 0 CA--C 1.537 0.467 0 CA-C-O 120.912 0.386 . . . . 74.3 111.675 -178.327 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 16' ' ' THR . . . . . . . . . . . . . 9.8 t -90.15 170.83 9.98 Favored 'General case' 0 N--CA 1.472 0.654 0 CA-C-N 116.21 -0.45 . . . . 73.32 111.754 -179.316 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . -89.43 152.8 22.88 Favored Glycine 0 CA--C 1.53 0.976 0 CA-C-N 116.301 -0.409 . . . . 63.53 113.693 -177.256 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -155.31 155.26 29.73 Favored Pre-proline 0 N--CA 1.472 0.627 0 O-C-N 122.559 -0.377 . . . . 71.24 110.969 179.143 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 19' ' ' PRO . . . . . 0.403 ' HD3' ' HB2' ' A' ' 75' ' ' ALA . 26.0 Cg_exo -63.78 179.68 0.96 Allowed 'Trans proline' 0 CA--C 1.54 0.818 0 C-N-CA 122.38 2.053 . . . . 65.13 112.785 175.648 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . -87.31 -79.43 1.24 Allowed Glycine 0 CA--C 1.526 0.741 0 C-N-CA 121.003 -0.618 . . . . 42.13 112.455 178.087 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -174.72 147.53 1.04 Allowed 'General case' 0 N--CA 1.468 0.464 0 C-N-CA 122.649 0.38 . . . . 43.41 111.054 178.261 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 22' ' ' LEU . . . . . 0.452 HD12 ' HB2' ' A' ' 60' ' ' GLN . 79.4 mt -60.02 146.26 82.95 Favored Pre-proline 0 CA--C 1.54 0.576 0 CA-C-O 120.437 0.161 . . . . 62.04 111.086 176.052 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 23' ' ' PRO . . . . . 0.523 ' O ' ' HG ' ' A' ' 26' ' ' LEU . 74.5 Cg_exo -50.92 136.84 44.04 Favored 'Trans proline' 0 CA--C 1.539 0.764 0 C-N-CA 122.925 2.416 . . . . 71.14 113.644 -177.243 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -80.15 -15.12 57.76 Favored 'General case' 0 N--CA 1.467 0.421 0 CA-C-O 120.965 0.412 . . . . 72.14 111.309 177.167 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 25' ' ' ASN . . . . . 0.432 ' HB3' ' HB3' ' A' ' 28' ' ' ASP . 14.9 m120 -92.77 27.07 2.47 Favored 'General case' 0 CA--C 1.542 0.67 0 N-CA-C 112.161 0.43 . . . . 64.02 112.161 -177.807 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 26' ' ' LEU . . . . . 0.523 ' HG ' ' O ' ' A' ' 23' ' ' PRO . 82.8 mt -51.07 -38.26 50.59 Favored 'General case' 0 N--CA 1.476 0.839 0 N-CA-C 112.949 0.722 . . . . 75.45 112.949 -176.873 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 35.2 t70 -75.53 -31.25 60.04 Favored 'General case' 0 CA--C 1.541 0.62 0 O-C-N 122.091 -0.38 . . . . 72.45 111.332 179.077 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 28' ' ' ASP . . . . . 0.432 ' HB3' ' HB3' ' A' ' 25' ' ' ASN . 22.1 t70 -73.14 -23.3 60.45 Favored 'General case' 0 CA--C 1.541 0.627 0 CA-C-O 121.124 0.488 . . . . 61.42 110.254 175.791 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 29' ' ' MET . . . . . 0.401 ' SD ' HD23 ' A' ' 26' ' ' LEU . 76.3 mtp -70.83 160.67 32.33 Favored 'General case' 0 CA--C 1.537 0.479 0 CA-C-O 121.295 0.569 . . . . 73.44 111.559 176.038 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 46.3 mtpt -92.9 157.68 16.23 Favored 'General case' 0 CA--C 1.539 0.531 0 CA-C-N 115.898 -0.592 . . . . 72.22 112.003 -177.926 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 57.3 t -52.13 -47.86 43.17 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.693 0 CA-C-N 115.909 -0.587 . . . . 51.21 112.27 -176.418 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -61.73 -35.96 79.6 Favored 'General case' 0 N--CA 1.471 0.575 0 CA-C-O 120.919 0.39 . . . . 73.41 111.874 179.853 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 41.7 mt-10 -72.01 -35.47 69.43 Favored 'General case' 0 N--CA 1.47 0.546 0 CA-C-N 116.297 -0.41 . . . . 65.14 111.126 -178.895 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 90.6 mt -65.79 -50.45 64.66 Favored 'General case' 0 CA--C 1.537 0.473 0 CA-C-N 116.145 -0.48 . . . . 65.14 110.887 174.501 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 35' ' ' LYS . . . . . 0.401 ' HG2' ' HB ' ' A' ' 45' ' ' VAL . 60.3 mttm -54.99 -41.82 71.7 Favored 'General case' 0 N--CA 1.47 0.544 0 CA-C-O 121.043 0.449 . . . . 74.43 111.299 175.667 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 36' ' ' GLN . . . . . 0.485 ' O ' ' HG ' ' A' ' 40' ' ' LEU . 26.0 tm0? -56.15 -47.81 77.5 Favored 'General case' 0 CA--C 1.539 0.539 0 CA-C-N 115.8 -0.636 . . . . 70.22 111.32 -179.489 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 37' ' ' GLU . . . . . 0.726 ' HB3' ' NH2' ' A' ' 41' ' ' ARG . 42.5 mt-10 -70.79 -39.18 73.29 Favored 'General case' 0 CA--C 1.538 0.518 0 N-CA-C 112.095 0.405 . . . . 63.04 112.095 178.151 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 38' ' ' LEU . . . . . 0.416 ' CD1' HD22 ' A' ' 52' ' ' LEU . 77.5 mt -55.84 -54.3 46.21 Favored 'General case' 0 N--CA 1.467 0.424 0 CA-C-O 120.822 0.344 . . . . 73.03 111.573 176.913 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 18.7 ptmt -63.48 -25.68 68.37 Favored 'General case' 0 CA--C 1.541 0.628 0 N-CA-C 112.225 0.454 . . . . 72.04 112.225 -175.006 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 40' ' ' LEU . . . . . 0.485 ' HG ' ' O ' ' A' ' 36' ' ' GLN . 66.1 mt -72.08 -30.03 64.7 Favored 'General case' 0 N--CA 1.471 0.576 0 CA-C-O 120.805 0.336 . . . . 74.3 111.174 175.388 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 41' ' ' ARG . . . . . 0.726 ' NH2' ' HB3' ' A' ' 37' ' ' GLU . 0.0 OUTLIER -97.52 17.07 18.49 Favored 'General case' 0 N--CA 1.472 0.64 0 CA-C-N 116.412 -0.358 . . . . 62.23 111.258 173.951 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 30.0 t 63.32 16.48 9.52 Favored 'General case' 0 N--CA 1.48 1.057 0 N-CA-C 112.706 0.632 . . . . 73.2 112.706 176.989 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 43' ' ' LEU . . . . . 0.426 ' HA ' ' HD3' ' A' ' 44' ' ' PRO . 58.4 mt -79.65 136.2 55.69 Favored Pre-proline 0 CA--C 1.543 0.674 0 N-CA-C 111.914 0.339 . . . . 74.43 111.914 -178.652 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 44' ' ' PRO . . . . . 0.426 ' HD3' ' HA ' ' A' ' 43' ' ' LEU . 51.6 Cg_exo -56.24 120.81 8.9 Favored 'Trans proline' 0 CA--C 1.542 0.905 0 C-N-CA 122.93 2.42 . . . . 61.53 113.227 178.588 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 45' ' ' VAL . . . . . 0.401 ' HB ' ' HG2' ' A' ' 35' ' ' LYS . 34.0 m -94.87 10.17 4.89 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.733 0 N-CA-C 112.719 0.637 . . . . 55.33 112.719 -176.419 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 37.1 t -73.99 -22.17 59.71 Favored 'General case' 0 N--CA 1.478 0.931 0 N-CA-C 113.063 0.764 . . . . 74.33 113.063 -176.226 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . -68.31 169.04 40.91 Favored Glycine 0 CA--C 1.534 1.25 0 C-N-CA 120.968 -0.634 . . . . 53.15 114.055 -176.944 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 48' ' ' THR . . . . . 0.589 ' O ' ' HG ' ' A' ' 52' ' ' LEU . 64.1 p -74.26 170.32 15.81 Favored 'General case' 0 N--CA 1.475 0.799 0 O-C-N 122.558 -0.378 . . . . 74.12 111.115 177.097 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 49' ' ' LYS . . . . . 0.406 ' O ' HG13 ' A' ' 53' ' ' ILE . 64.0 tttm -48.1 -44.98 32.32 Favored 'General case' 0 N--CA 1.471 0.611 0 N-CA-C 112.056 0.391 . . . . 72.33 112.056 -178.875 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 50' ' ' THR . . . . . . . . . . . . . 94.4 m -64.51 -43.86 92.75 Favored 'General case' 0 N--CA 1.472 0.634 0 CA-C-O 120.877 0.37 . . . . 64.23 111.313 177.565 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 44.8 mt-10 -64.6 -34.72 78.92 Favored 'General case' 0 N--CA 1.469 0.518 0 CA-C-N 116.45 -0.341 . . . . 74.43 111.533 -179.878 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 52' ' ' LEU . . . . . 0.589 ' HG ' ' O ' ' A' ' 48' ' ' THR . 44.5 mt -62.03 -44.51 96.55 Favored 'General case' 0 N--CA 1.471 0.6 0 CA-C-O 121.409 0.624 . . . . 72.25 110.318 176.381 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 53' ' ' ILE . . . . . 0.536 HG22 ' HD3' ' A' ' 57' ' ' ARG . 79.7 mt -60.91 -52.38 62.36 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.576 0 CA-C-N 115.525 -0.762 . . . . 73.2 111.301 176.172 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 11.8 mm-40 -61.45 -30.15 70.41 Favored 'General case' 0 N--CA 1.47 0.54 0 CA-C-N 116.204 -0.453 . . . . 54.41 111.757 178.68 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 55' ' ' ARG . . . . . 0.507 ' HA ' ' HE ' ' A' ' 55' ' ' ARG . 0.8 OUTLIER -67.33 -50.03 61.68 Favored 'General case' 0 CA--C 1.54 0.562 0 CA-C-O 120.865 0.364 . . . . 71.14 110.93 179.5 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 56' ' ' LEU . . . . . 0.62 HD22 HH21 ' A' ' 41' ' ' ARG . 60.7 mt -59.77 -51.34 70.16 Favored 'General case' 0 N--CA 1.472 0.667 0 CA-C-O 121.193 0.52 . . . . 64.34 111.126 175.376 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 57' ' ' ARG . . . . . 0.536 ' HD3' HG22 ' A' ' 53' ' ' ILE . 16.7 mtp85 -56.97 -39.11 74.0 Favored 'General case' 0 CA--C 1.539 0.538 0 CA-C-N 116.022 -0.536 . . . . 74.03 112.132 179.806 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -66.75 -40.03 88.14 Favored 'General case' 0 CA--C 1.54 0.575 0 CA-C-O 120.984 0.421 . . . . 74.33 111.5 176.797 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 59' ' ' TYR . . . . . . . . . . . . . 73.5 t80 -63.43 -38.09 89.8 Favored 'General case' 0 CA--C 1.542 0.657 0 CA-C-N 116.237 -0.438 . . . . 53.12 111.348 178.907 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 60' ' ' GLN . . . . . 0.452 ' HB2' HD12 ' A' ' 22' ' ' LEU . 0.0 OUTLIER -76.61 -45.7 29.12 Favored 'General case' 0 CA--C 1.542 0.669 0 CA-C-O 121.282 0.563 . . . . 54.32 110.536 178.618 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 61' ' ' ASP . . . . . . . . . . . . . 27.3 t70 -53.08 -28.77 26.68 Favored 'General case' 0 CA--C 1.545 0.787 0 N-CA-C 112.833 0.679 . . . . 74.12 112.833 -176.988 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 62' ' ' GLN . . . . . . . . . . . . . 10.1 pt20 -85.89 -23.92 26.84 Favored 'General case' 0 N--CA 1.473 0.699 0 N-CA-C 112.735 0.642 . . . . 50.02 112.735 -178.956 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 63' ' ' ILE . . . . . . . . . . . . . 32.0 pt -100.42 -16.09 7.29 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.777 0 N-CA-C 112.13 0.418 . . . . 75.41 112.13 -178.878 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 64' ' ' SER . . . . . 0.427 ' HA ' ' HD3' ' A' ' 65' ' ' PRO . 32.8 t -66.9 134.63 94.04 Favored Pre-proline 0 CA--C 1.541 0.612 0 N-CA-C 112.229 0.455 . . . . 72.1 112.229 -177.544 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 65' ' ' PRO . . . . . 0.427 ' HD3' ' HA ' ' A' ' 64' ' ' SER . 6.6 Cg_exo -74.13 91.1 0.95 Allowed 'Trans proline' 0 CA--C 1.539 0.748 0 C-N-CA 122.694 2.263 . . . . 72.01 112.529 177.216 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 66' ' ' VAL . . . . . 0.478 ' HB ' ' HD2' ' A' ' 67' ' ' PRO . 33.4 m -73.99 157.19 87.35 Favored Pre-proline 0 CA--C 1.545 0.78 0 CA-C-N 116.636 -0.257 . . . . 65.53 111.346 176.709 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 67' ' ' PRO . . . . . 0.478 ' HD2' ' HB ' ' A' ' 66' ' ' VAL . 37.3 Cg_exo -36.04 -57.91 0.51 Allowed 'Trans proline' 0 C--N 1.359 1.081 0 C-N-CA 123.814 3.009 . . . . 71.35 115.176 -175.695 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . -119.76 63.57 0.46 Allowed Glycine 0 CA--C 1.527 0.814 0 C-N-CA 120.758 -0.734 . . . . 64.23 114.042 -175.422 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . -162.27 147.22 9.85 Favored Pre-proline 0 N--CA 1.47 0.574 0 O-C-N 122.352 -0.499 . . . . 41.35 111.951 176.065 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 70' ' ' PRO . . . . . . . . . . . . . 70.2 Cg_endo -73.3 163.65 37.32 Favored 'Trans proline' 0 CA--C 1.541 0.839 0 C-N-CA 122.498 2.132 . . . . 70.44 112.606 176.793 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 71' ' ' LYS . . . . . 0.507 ' N ' ' HD3' ' A' ' 71' ' ' LYS . 0.0 OUTLIER -152.3 168.66 24.67 Favored 'General case' 0 N--CA 1.47 0.572 0 CA-C-O 121.348 0.595 . . . . 53.13 112.511 -174.928 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -135.33 107.64 10.22 Favored Pre-proline 0 CA--C 1.539 0.54 0 CA-C-N 115.752 -0.658 . . . . 54.15 110.541 175.378 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 73' ' ' PRO . . . . . . . . . . . . . 74.5 Cg_endo -74.44 130.55 14.01 Favored 'Trans proline' 0 CA--C 1.542 0.909 0 C-N-CA 122.522 2.148 . . . . 71.43 113.536 -176.999 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -96.52 97.7 9.62 Favored 'General case' 0 CA--C 1.536 0.438 0 CA-C-N 116.385 -0.371 . . . . 73.52 111.176 177.113 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 75' ' ' ALA . . . . . 0.403 ' HB2' ' HD3' ' A' ' 19' ' ' PRO . . . . . . . . 0 C--O 1.253 1.242 0 CA-C-O 118.727 -0.654 . . . . 74.25 111.613 -178.838 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 49.9 ttp . . . . . 0 N--CA 1.49 1.54 0 CA-C-O 120.607 0.242 . . . . 62.32 111.063 . . . . . . . . . 0 0 . 1 . 010 nuclear build full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . 150.22 66.47 0.01 OUTLIER Glycine 0 CA--C 1.524 0.646 0 C-N-CA 120.962 -0.637 . . . . 73.03 113.245 177.607 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 3' ' ' HIS . . . . . . . . . . . . . 53.8 m80 -65.91 108.22 2.1 Favored 'General case' 0 N--CA 1.468 0.468 0 CA-C-O 120.95 0.405 . . . . 72.33 111.326 178.508 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 4' ' ' HIS . . . . . . . . . . . . . 40.3 m80 -67.55 118.73 11.25 Favored 'General case' 0 CA--C 1.539 0.542 0 CA-C-O 120.968 0.414 . . . . 71.02 111.144 -179.7 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 5' ' ' HIS . . . . . . . . . . . . . 33.1 p80 -75.15 157.01 35.31 Favored 'General case' 0 N--CA 1.473 0.695 0 N-CA-C 113.318 0.859 . . . . 74.44 113.318 -172.771 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 5.0 p-80 -127.04 161.02 29.39 Favored 'General case' 0 N--CA 1.469 0.483 0 CA-C-N 115.133 -0.939 . . . . 75.22 110.046 175.381 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 7.1 p80 -157.14 127.96 6.65 Favored 'General case' 0 CA--C 1.542 0.657 0 CA-C-O 121.258 0.552 . . . . 74.11 112.156 177.632 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 8' ' ' HIS . . . . . . . . . . . . . 15.8 p-80 -78.48 135.58 37.4 Favored 'General case' 0 N--CA 1.47 0.55 0 CA-C-N 115.859 -0.61 . . . . 73.43 111.411 179.045 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 78.5 p -135.88 125.36 25.08 Favored 'General case' 0 N--CA 1.471 0.605 0 CA-C-O 121.017 0.437 . . . . 75.12 111.697 179.595 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 59.1 t-80 -154.21 145.61 23.05 Favored 'General case' 0 CA--C 1.538 0.513 0 CA-C-N 116.285 -0.416 . . . . 63.3 110.785 176.841 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 11' ' ' MET . . . . . . . . . . . . . 58.5 ttp -113.97 146.94 39.41 Favored 'General case' 0 CA--C 1.545 0.753 0 CA-C-O 120.92 0.391 . . . . 74.42 111.982 -176.882 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 47.1 t -135.81 94.79 3.12 Favored 'General case' 0 N--CA 1.475 0.778 0 CA-C-O 121.085 0.469 . . . . 75.21 111.014 175.729 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 13' ' ' THR . . . . . . . . . . . . . 46.8 p -119.34 112.59 35.76 Favored Pre-proline 0 N--CA 1.472 0.633 0 CA-C-N 116.401 -0.363 . . . . 73.3 111.854 -178.834 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 14' ' ' PRO . . . . . . . . . . . . . 63.5 Cg_endo -72.98 123.27 8.77 Favored 'Trans proline' 0 CA--C 1.542 0.904 0 C-N-CA 122.393 2.062 . . . . 64.22 112.419 177.22 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 2.4 pp -85.04 170.5 12.91 Favored 'General case' 0 CA--C 1.539 0.547 0 CA-C-O 121.204 0.526 . . . . 54.11 112.041 -177.553 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 16' ' ' THR . . . . . . . . . . . . . 64.9 p -110.57 162.77 14.39 Favored 'General case' 0 N--CA 1.471 0.594 0 CA-C-O 121.084 0.469 . . . . 53.21 111.86 -179.55 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . 145.62 139.42 3.38 Favored Glycine 0 CA--C 1.526 0.749 0 CA-C-N 116.104 -0.498 . . . . 74.24 112.554 179.74 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 16.8 ptpt -141.83 90.07 8.74 Favored Pre-proline 0 CA--C 1.542 0.648 0 CA-C-O 121.189 0.518 . . . . 74.14 111.887 -178.628 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 87.9 Cg_endo -85.2 123.59 2.69 Favored 'Trans proline' 0 CA--C 1.543 0.929 0 C-N-CA 122.745 2.297 . . . . 75.3 112.686 176.318 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . -75.82 71.53 1.89 Allowed Glycine 0 CA--C 1.525 0.7 0 C-N-CA 120.947 -0.644 . . . . 73.14 112.639 179.335 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -141.17 173.9 11.05 Favored 'General case' 0 CA--C 1.539 0.544 0 CA-C-O 120.995 0.426 . . . . 73.45 112.022 -178.509 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 22' ' ' LEU . . . . . 0.457 ' HG ' ' HG3' ' A' ' 60' ' ' GLN . 91.3 mt -130.24 144.01 51.5 Favored Pre-proline 0 N--CA 1.475 0.786 0 CA-C-N 116.03 -0.532 . . . . 74.34 111.269 177.941 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 23' ' ' PRO . . . . . 0.434 ' HG2' HD23 ' A' ' 26' ' ' LEU . 46.9 Cg_endo -70.32 150.34 64.65 Favored 'Trans proline' 0 CA--C 1.541 0.838 0 C-N-CA 122.191 1.927 . . . . 74.23 111.751 170.714 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -67.17 -39.63 86.5 Favored 'General case' 0 N--CA 1.47 0.556 0 CA-C-O 121.023 0.44 . . . . 74.02 112.02 -177.855 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 25' ' ' ASN . . . . . 0.429 ' HB3' ' HB2' ' A' ' 28' ' ' ASP . 1.9 m-20 -92.57 72.44 5.08 Favored 'General case' 0 CA--C 1.537 0.456 0 CA-C-O 121.107 0.479 . . . . 75.34 111.812 -178.613 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 26' ' ' LEU . . . . . 0.434 HD23 ' HG2' ' A' ' 23' ' ' PRO . 92.9 mt -72.28 -33.49 67.48 Favored 'General case' 0 CA--C 1.536 0.412 0 CA-C-N 116.332 -0.395 . . . . 71.41 111.685 179.029 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 36.3 t70 -72.83 -25.17 61.03 Favored 'General case' 0 CA--C 1.538 0.516 0 O-C-N 122.17 -0.331 . . . . 64.43 111.42 178.611 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 28' ' ' ASP . . . . . 0.429 ' HB2' ' HB3' ' A' ' 25' ' ' ASN . 16.3 m-20 -74.91 -15.36 60.7 Favored 'General case' 0 N--CA 1.469 0.508 0 CA-C-O 120.89 0.376 . . . . 74.02 111.296 175.155 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 29' ' ' MET . . . . . . . . . . . . . 86.1 mtp -81.65 137.8 35.4 Favored 'General case' 0 CA--C 1.536 0.419 0 CA-C-O 121.01 0.433 . . . . 65.21 110.947 175.76 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 30' ' ' LYS . . . . . 0.46 ' HB2' ' HG2' ' A' ' 33' ' ' GLU . 51.3 mtmt -66.85 155.41 38.4 Favored 'General case' 0 CA--C 1.541 0.624 0 CA-C-N 116.302 -0.408 . . . . 74.41 111.357 -179.989 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 90.2 t -54.06 -42.4 54.82 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.713 0 N-CA-C 111.963 0.357 . . . . 73.24 111.963 -177.673 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -63.27 -33.08 74.72 Favored 'General case' 0 CA--C 1.539 0.528 0 CA-C-O 120.791 0.329 . . . . 74.51 111.643 177.68 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 33' ' ' GLU . . . . . 0.46 ' HG2' ' HB2' ' A' ' 30' ' ' LYS . 57.9 mm-40 -70.22 -47.61 60.68 Favored 'General case' 0 N--CA 1.468 0.426 0 CA-C-O 120.919 0.39 . . . . 65.4 110.636 177.462 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 97.7 mt -57.35 -46.08 83.68 Favored 'General case' 0 CA--C 1.539 0.535 0 CA-C-N 116.234 -0.439 . . . . 61.24 111.144 176.228 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 55.2 mtmt -63.98 -32.47 74.01 Favored 'General case' 0 CA--C 1.539 0.538 0 CA-C-N 116.426 -0.352 . . . . 74.23 111.568 177.5 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 51.5 tp60 -65.81 -49.6 67.69 Favored 'General case' 0 CA--C 1.539 0.533 0 CA-C-O 121.008 0.433 . . . . 71.51 110.067 175.495 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 37' ' ' GLU . . . . . 0.639 ' HB3' HH21 ' A' ' 41' ' ' ARG . 42.2 mm-40 -54.75 -31.77 59.0 Favored 'General case' 0 N--CA 1.472 0.637 0 CA-C-N 115.921 -0.581 . . . . 70.12 111.591 175.562 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 38' ' ' LEU . . . . . 0.45 ' CD1' HD22 ' A' ' 52' ' ' LEU . 91.5 mt -72.02 -62.2 1.51 Allowed 'General case' 0 CA--C 1.538 0.488 0 CA-C-N 116.284 -0.416 . . . . 73.41 111.92 176.694 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 20.6 ptmt -58.92 -34.28 71.53 Favored 'General case' 0 CA--C 1.541 0.599 0 N-CA-C 112.622 0.601 . . . . 72.21 112.622 -172.929 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 93.0 mt -64.87 -22.46 67.0 Favored 'General case' 0 N--CA 1.475 0.793 0 CA-C-O 121.193 0.521 . . . . 43.22 111.568 177.743 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 41' ' ' ARG . . . . . 0.639 HH21 ' HB3' ' A' ' 37' ' ' GLU . 15.5 mtm180 -109.72 27.12 9.89 Favored 'General case' 0 CA--C 1.541 0.603 0 CA-C-N 116.136 -0.484 . . . . 75.22 111.604 177.77 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 28.0 t 70.23 5.34 5.27 Favored 'General case' 0 N--CA 1.478 0.97 0 N-CA-C 112.809 0.67 . . . . 74.05 112.809 174.818 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 61.4 mt -82.8 142.38 45.26 Favored Pre-proline 0 CA--C 1.542 0.639 0 CA-C-O 120.723 0.297 . . . . 71.52 111.468 -179.569 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 44' ' ' PRO . . . . . 0.434 ' HG2' ' NH1' ' A' ' 55' ' ' ARG . 59.2 Cg_endo -70.13 143.79 50.14 Favored 'Trans proline' 0 C--N 1.352 0.723 0 C-N-CA 122.476 2.117 . . . . 72.32 112.567 178.411 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 30.2 m -95.09 16.45 1.99 Allowed 'Isoleucine or valine' 0 CA--C 1.54 0.59 0 CA-C-O 121.22 0.533 . . . . 71.31 111.93 -177.063 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 33.0 t -90.53 89.42 7.55 Favored 'General case' 0 N--CA 1.47 0.528 0 CA-C-N 116.247 -0.433 . . . . 72.12 111.455 179.713 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . -172.82 174.88 45.88 Favored Glycine 0 CA--C 1.528 0.867 0 C-N-CA 120.711 -0.757 . . . . 62.12 113.851 178.68 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 48' ' ' THR . . . . . 0.601 ' O ' ' HG ' ' A' ' 52' ' ' LEU . 68.3 p -93.12 170.03 9.95 Favored 'General case' 0 N--CA 1.469 0.516 0 C-N-CA 122.58 0.352 . . . . 72.4 111.019 178.748 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 22.8 tptm -44.47 -54.57 5.84 Favored 'General case' 0 N--CA 1.472 0.656 0 N-CA-C 112.135 0.42 . . . . 72.32 112.135 -179.02 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 50' ' ' THR . . . . . . . . . . . . . 51.4 m -69.96 -40.9 75.14 Favored 'General case' 0 CA--C 1.538 0.482 0 CA-C-N 116.405 -0.361 . . . . 72.43 111.781 -179.59 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 2.9 tm-20 -55.17 -48.82 73.24 Favored 'General case' 0 CA--C 1.542 0.647 0 CA-C-N 116.354 -0.384 . . . . 72.23 111.246 179.298 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 52' ' ' LEU . . . . . 0.601 ' HG ' ' O ' ' A' ' 48' ' ' THR . 54.2 mt -56.47 -46.38 80.44 Favored 'General case' 0 N--CA 1.47 0.556 0 CA-C-O 121.137 0.494 . . . . 73.24 111.059 179.169 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 53' ' ' ILE . . . . . . . . . . . . . 78.9 mt -56.23 -53.12 43.28 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.534 0 CA-C-N 115.948 -0.569 . . . . 75.15 111.634 178.162 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 38.9 mt-10 -68.31 -28.14 66.91 Favored 'General case' 0 CA--C 1.536 0.438 0 CA-C-N 116.243 -0.435 . . . . 72.45 111.816 -178.897 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 55' ' ' ARG . . . . . 0.434 ' NH1' ' HG2' ' A' ' 44' ' ' PRO . 41.9 ttm-85 -68.69 -38.71 80.54 Favored 'General case' 0 CA--C 1.537 0.481 0 CA-C-O 121.122 0.486 . . . . 74.23 110.596 176.752 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 62.4 mt -56.73 -48.39 77.88 Favored 'General case' 0 CA--C 1.538 0.494 0 CA-C-N 116.088 -0.506 . . . . 72.31 111.137 173.482 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 54.1 mtm180 -61.48 -41.96 98.05 Favored 'General case' 0 N--CA 1.469 0.497 0 CA-C-N 116.577 -0.283 . . . . 75.45 111.186 177.78 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -55.25 -41.21 71.85 Favored 'General case' 0 N--CA 1.471 0.584 0 CA-C-O 120.943 0.402 . . . . 61.12 111.682 179.703 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 59' ' ' TYR . . . . . . . . . . . . . 87.0 t80 -69.73 -51.57 33.07 Favored 'General case' 0 CA--C 1.536 0.44 0 CA-C-O 121.092 0.472 . . . . 74.32 110.833 176.207 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 60' ' ' GLN . . . . . 0.457 ' HG3' ' HG ' ' A' ' 22' ' ' LEU . 17.6 mm100 -58.42 -29.29 65.99 Favored 'General case' 0 CA--C 1.539 0.547 0 CA-C-N 116.101 -0.499 . . . . 71.11 112.264 179.484 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 61' ' ' ASP . . . . . . . . . . . . . 19.5 t70 -71.91 -45.27 61.8 Favored 'General case' 0 C--N 1.321 -0.65 0 CA-C-N 116.178 -0.465 . . . . 74.25 111.633 179.094 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 62' ' ' GLN . . . . . . . . . . . . . 11.0 pt20 -80.33 -18.62 48.64 Favored 'General case' 0 CA--C 1.54 0.589 0 N-CA-C 112.706 0.632 . . . . 75.43 112.706 -175.348 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 63' ' ' ILE . . . . . . . . . . . . . 39.5 pt -90.15 -22.34 6.41 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.721 0 O-C-N 121.841 -0.537 . . . . 74.22 112.076 177.012 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 64' ' ' SER . . . . . 0.408 ' HA ' ' HD3' ' A' ' 65' ' ' PRO . 33.0 t -102.19 133.43 20.62 Favored Pre-proline 0 N--CA 1.473 0.688 0 O-C-N 122.298 -0.251 . . . . 75.25 111.388 -178.073 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 65' ' ' PRO . . . . . 0.408 ' HD3' ' HA ' ' A' ' 64' ' ' SER . 51.1 Cg_exo -56.74 122.11 11.23 Favored 'Trans proline' 0 CA--C 1.539 0.737 0 C-N-CA 122.659 2.24 . . . . 74.52 112.819 178.275 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 66' ' ' VAL . . . . . . . . . . . . . 27.6 m -67.79 114.14 18.48 Favored Pre-proline 0 CA--C 1.546 0.789 0 CA-C-O 120.864 0.364 . . . . 75.12 111.501 -179.79 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 67' ' ' PRO . . . . . . . . . . . . . 17.9 Cg_exo -66.84 93.92 0.33 Allowed 'Trans proline' 0 CA--C 1.537 0.639 0 C-N-CA 122.76 2.307 . . . . 72.42 112.767 -177.445 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 76.96 -55.7 3.51 Favored Glycine 0 CA--C 1.531 1.07 0 C-N-CA 121.235 -0.507 . . . . 61.32 113.489 -179.468 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . 70.29 145.33 0.11 Allowed Pre-proline 0 N--CA 1.472 0.653 0 C-N-CA 123.07 0.548 . . . . 71.23 112.09 -179.471 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 70' ' ' PRO . . . . . . . . . . . . . 52.2 Cg_exo -56.78 143.96 88.81 Favored 'Trans proline' 0 CA--C 1.542 0.901 0 C-N-CA 122.708 2.272 . . . . 73.15 113.123 177.653 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 71' ' ' LYS . . . . . 0.503 ' O ' ' HD3' ' A' ' 71' ' ' LYS . 0.1 OUTLIER -78.79 142.71 36.74 Favored 'General case' 0 CA--C 1.539 0.545 0 CA-C-O 121.114 0.483 . . . . 63.53 111.465 179.011 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -93.65 141.96 24.51 Favored Pre-proline 0 CA--C 1.542 0.65 0 CA-C-N 116.151 -0.477 . . . . 61.33 111.65 179.351 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 73' ' ' PRO . . . . . . . . . . . . . 33.9 Cg_exo -58.22 104.13 0.17 Allowed 'Trans proline' 0 CA--C 1.542 0.897 0 C-N-CA 122.609 2.206 . . . . 75.52 112.82 178.201 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -73.91 138.04 44.04 Favored 'General case' 0 CA--C 1.537 0.451 0 CA-C-O 120.941 0.4 . . . . 74.42 111.585 -178.973 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.253 1.275 0 CA-C-O 118.676 -0.678 . . . . 65.14 111.512 177.652 . . . . . . . . 0 0 . 1 . 011 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 21.2 mmt . . . . . 0 N--CA 1.49 1.539 0 N-CA-C 110.533 -0.173 . . . . 55.42 110.533 . . . . . . . . . 0 0 . 1 . 011 nuclear build full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . 145.86 164.99 11.15 Favored Glycine 0 CA--C 1.526 0.748 0 C-N-CA 120.834 -0.698 . . . . 53.34 113.46 179.414 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 3' ' ' HIS . . . . . . . . . . . . . 47.7 m80 -146.85 -178.85 6.41 Favored 'General case' 0 N--CA 1.473 0.71 0 CA-C-O 121.448 0.642 . . . . 72.1 112.461 -178.186 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 4' ' ' HIS . . . . . . . . . . . . . 16.2 p-80 -151.22 121.17 7.11 Favored 'General case' 0 CA--C 1.54 0.587 0 CA-C-N 115.632 -0.713 . . . . 72.03 110.849 -178.85 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 5' ' ' HIS . . . . . . . . . . . . . 53.3 t-80 -144.19 138.62 28.21 Favored 'General case' 0 CA--C 1.54 0.594 0 CA-C-O 121.175 0.512 . . . . 75.44 112.355 -173.855 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 66.9 m80 -115.08 178.55 4.24 Favored 'General case' 0 N--CA 1.47 0.546 0 CA-C-N 115.933 -0.576 . . . . 72.33 110.479 172.612 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 29.1 p80 -126.11 161.67 27.11 Favored 'General case' 0 N--CA 1.472 0.636 0 CA-C-O 120.809 0.338 . . . . 75.11 111.256 178.533 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 8' ' ' HIS . . . . . . . . . . . . . 96.6 m-70 -77.67 167.08 22.16 Favored 'General case' 0 N--CA 1.469 0.487 0 CA-C-O 121.482 0.658 . . . . 64.32 112.602 -177.781 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 57.7 p -91.73 169.74 10.47 Favored 'General case' 0 N--CA 1.469 0.487 0 CA-C-N 115.062 -0.972 . . . . 73.51 110.674 174.355 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 49.0 m80 -106.06 87.79 2.65 Favored 'General case' 0 N--CA 1.469 0.483 0 CA-C-O 121.291 0.567 . . . . 51.11 112.153 -178.436 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 11' ' ' MET . . . . . . . . . . . . . 24.0 mmt -103.0 121.34 42.35 Favored 'General case' 0 CA--C 1.536 0.442 0 CA-C-N 116.033 -0.531 . . . . 74.5 110.956 179.65 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 35.2 t -114.81 176.64 4.96 Favored 'General case' 0 N--CA 1.474 0.764 0 CA-C-O 121.115 0.483 . . . . 74.34 112.083 -176.672 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 13' ' ' THR . . . . . . . . . . . . . 72.1 p -109.86 143.52 28.09 Favored Pre-proline 0 N--CA 1.473 0.689 0 CA-C-N 116.025 -0.534 . . . . 72.24 111.237 178.714 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 14' ' ' PRO . . . . . . . . . . . . . 15.5 Cg_exo -69.91 172.13 13.36 Favored 'Trans proline' 0 CA--C 1.54 0.793 0 C-N-CA 122.657 2.238 . . . . 63.14 112.743 177.33 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 76.4 mt -79.62 147.96 31.86 Favored 'General case' 0 CA--C 1.537 0.474 0 O-C-N 122.251 -0.28 . . . . 75.11 111.292 179.41 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 16' ' ' THR . . . . . . . . . . . . . 7.3 m -52.21 -48.03 65.31 Favored 'General case' 0 N--CA 1.475 0.776 0 N-CA-C 112.045 0.387 . . . . 60.25 112.045 -179.188 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . 173.46 61.65 0.05 OUTLIER Glycine 0 CA--C 1.527 0.837 0 C-N-CA 120.985 -0.626 . . . . 72.01 113.375 177.966 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 14.2 mptt -96.13 133.09 25.6 Favored Pre-proline 0 CA--C 1.544 0.74 0 O-C-N 122.39 -0.477 . . . . 65.32 111.223 178.272 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 71.8 Cg_endo -75.23 117.71 4.96 Favored 'Trans proline' 0 CA--C 1.541 0.831 0 C-N-CA 122.986 2.458 . . . . 73.05 113.264 -178.491 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . -100.47 124.6 8.3 Favored Glycine 0 CA--C 1.528 0.892 0 C-N-CA 121.089 -0.577 . . . . 55.5 113.216 179.52 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -160.67 -178.11 6.64 Favored 'General case' 0 N--CA 1.47 0.549 0 CA-C-O 121.011 0.434 . . . . 61.42 112.056 -179.576 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 98.8 mt -72.87 155.58 90.5 Favored Pre-proline 0 CA--C 1.541 0.632 0 CA-C-N 116.232 -0.44 . . . . 72.23 111.051 177.716 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 23' ' ' PRO . . . . . . . . . . . . . 74.5 Cg_exo -50.81 130.39 30.63 Favored 'Trans proline' 0 CA--C 1.541 0.87 0 C-N-CA 122.538 2.159 . . . . 71.42 112.898 177.266 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 24' ' ' ALA . . . . . 0.405 ' HB1' ' HB2' ' A' ' 75' ' ' ALA . . . -55.33 -43.83 75.32 Favored 'General case' 0 CA--C 1.539 0.523 0 CA-C-O 121.106 0.479 . . . . 44.24 112.132 -178.022 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 85.1 m-20 -97.77 67.97 2.03 Favored 'General case' 0 CA--C 1.537 0.455 0 N-CA-C 112.122 0.416 . . . . 62.12 112.122 179.219 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 26' ' ' LEU . . . . . 0.414 ' HB2' HG23 ' A' ' 53' ' ' ILE . 96.5 mt -63.63 -28.58 70.01 Favored 'General case' 0 N--CA 1.47 0.539 0 CA-C-O 121.614 0.721 . . . . 73.34 110.086 170.444 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 8.8 p-10 -64.74 -25.17 67.81 Favored 'General case' 0 CA--C 1.539 0.54 0 CA-C-N 115.346 -0.843 . . . . 72.04 111.835 177.788 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 34.7 t70 -84.23 -6.77 59.44 Favored 'General case' 0 CA--C 1.543 0.698 0 CA-C-O 120.945 0.402 . . . . 73.32 111.65 -179.857 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 29' ' ' MET . . . . . 0.457 ' O ' ' HE3' ' A' ' 49' ' ' LYS . 83.6 mtp -87.66 166.78 14.43 Favored 'General case' 0 CA--C 1.541 0.613 0 CA-C-O 121.062 0.458 . . . . 64.11 111.752 179.875 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 30' ' ' LYS . . . . . 0.573 ' HB2' ' HG2' ' A' ' 33' ' ' GLU . 29.0 mtpp -84.17 153.1 23.87 Favored 'General case' 0 CA--C 1.54 0.585 0 CA-C-N 116.487 -0.324 . . . . 74.1 111.458 179.731 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 65.6 t -53.47 -57.1 5.77 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.772 0 N-CA-C 112.164 0.431 . . . . 71.24 112.164 -178.261 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 32' ' ' ALA . . . . . 0.53 ' HA ' ' HD3' ' A' ' 35' ' ' LYS . . . -58.38 -29.3 65.92 Favored 'General case' 0 N--CA 1.472 0.641 0 N-CA-C 112.214 0.449 . . . . 70.15 112.214 -178.85 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 33' ' ' GLU . . . . . 0.573 ' HG2' ' HB2' ' A' ' 30' ' ' LYS . 13.9 mm-40 -74.41 -38.95 62.94 Favored 'General case' 0 CA--C 1.538 0.519 0 CA-C-O 120.75 0.309 . . . . 74.32 110.938 179.413 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 92.9 mt -63.61 -44.14 94.82 Favored 'General case' 0 N--CA 1.47 0.531 0 CA-C-O 121.271 0.558 . . . . 72.23 110.308 172.925 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 35' ' ' LYS . . . . . 0.53 ' HD3' ' HA ' ' A' ' 32' ' ' ALA . 58.2 mtpt -55.84 -41.26 74.02 Favored 'General case' 0 N--CA 1.468 0.469 0 CA-C-N 115.775 -0.648 . . . . 63.42 111.447 176.658 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 36' ' ' GLN . . . . . 0.414 ' O ' ' HG ' ' A' ' 40' ' ' LEU . 8.0 tp-100 -56.69 -52.85 63.34 Favored 'General case' 0 CA--C 1.539 0.531 0 CA-C-O 120.876 0.37 . . . . 55.23 110.775 175.855 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 37' ' ' GLU . . . . . 0.629 ' HB3' ' NH2' ' A' ' 41' ' ' ARG . 25.9 mm-40 -57.91 -36.43 72.43 Favored 'General case' 0 CA--C 1.54 0.594 0 N-CA-C 112.253 0.464 . . . . 71.44 112.253 177.784 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 38' ' ' LEU . . . . . 0.446 ' CD1' HD22 ' A' ' 52' ' ' LEU . 88.0 mt -66.26 -58.33 5.59 Favored 'General case' 0 CA--C 1.539 0.54 0 CA-C-O 120.887 0.375 . . . . 71.41 111.549 177.14 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 20.7 ptmt -61.25 -30.24 70.33 Favored 'General case' 0 CA--C 1.54 0.585 0 N-CA-C 111.99 0.367 . . . . 73.23 111.99 -175.433 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 40' ' ' LEU . . . . . 0.414 ' HG ' ' O ' ' A' ' 36' ' ' GLN . 87.1 mt -68.21 -25.9 65.45 Favored 'General case' 0 CA--C 1.541 0.611 0 O-C-N 122.249 -0.282 . . . . 74.55 111.722 176.851 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 41' ' ' ARG . . . . . 0.678 HH21 HD22 ' A' ' 56' ' ' LEU . 80.8 mtm-85 -110.77 25.5 11.71 Favored 'General case' 0 N--CA 1.472 0.656 0 N-CA-C 112.051 0.389 . . . . 71.24 112.051 179.953 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 31.9 t 63.1 34.15 13.94 Favored 'General case' 0 N--CA 1.479 1.008 0 N-CA-C 112.415 0.524 . . . . 72.24 112.415 174.832 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 64.3 mt -105.16 138.55 19.56 Favored Pre-proline 0 CA--C 1.541 0.625 0 CA-C-N 116.554 -0.293 . . . . 74.15 111.499 179.367 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 44' ' ' PRO . . . . . 0.412 ' HG2' ' NH1' ' A' ' 55' ' ' ARG . 37.2 Cg_endo -66.84 131.64 26.24 Favored 'Trans proline' 0 CA--C 1.544 1.007 0 C-N-CA 122.524 2.149 . . . . 53.22 112.801 178.066 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 34.2 m -102.47 17.22 4.51 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.748 0 N-CA-C 112.356 0.502 . . . . 75.15 112.356 -174.948 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 69.3 m -81.36 13.33 3.0 Favored 'General case' 0 N--CA 1.478 0.942 0 N-CA-C 113.329 0.863 . . . . 61.03 113.329 -175.552 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . -104.45 172.28 20.18 Favored Glycine 0 CA--C 1.529 0.912 0 C-N-CA 120.908 -0.663 . . . . 22.22 113.973 -175.983 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 48' ' ' THR . . . . . 0.575 ' O ' ' HG ' ' A' ' 52' ' ' LEU . 43.4 p -77.0 169.23 18.71 Favored 'General case' 0 N--CA 1.473 0.707 0 O-C-N 122.504 -0.41 . . . . 71.23 110.87 176.785 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 49' ' ' LYS . . . . . 0.512 ' HE2' HD11 ' A' ' 53' ' ' ILE . 23.7 tptm -42.22 -51.15 4.81 Favored 'General case' 0 N--CA 1.475 0.776 0 CA-C-O 120.942 0.401 . . . . 73.43 111.598 176.818 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 50' ' ' THR . . . . . . . . . . . . . 31.1 m -60.88 -47.07 88.08 Favored 'General case' 0 CA--C 1.539 0.548 0 CA-C-N 116.01 -0.541 . . . . 71.35 111.769 -179.919 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 42.4 mt-10 -64.44 -38.13 89.96 Favored 'General case' 0 N--CA 1.472 0.637 0 CA-C-O 120.798 0.332 . . . . 73.41 111.789 -177.018 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 52' ' ' LEU . . . . . 0.575 ' HG ' ' O ' ' A' ' 48' ' ' THR . 43.8 mt -61.24 -44.23 97.59 Favored 'General case' 0 N--CA 1.47 0.542 0 CA-C-O 121.309 0.576 . . . . 72.44 110.458 177.175 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 53' ' ' ILE . . . . . 0.512 HD11 ' HE2' ' A' ' 49' ' ' LYS . 70.0 mt -60.77 -55.82 22.01 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.51 0 CA-C-N 115.643 -0.708 . . . . 75.35 111.149 176.645 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 53.9 mm-40 -54.99 -41.11 70.82 Favored 'General case' 0 CA--C 1.538 0.493 0 CA-C-N 116.161 -0.472 . . . . 73.34 111.74 -179.493 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 55' ' ' ARG . . . . . 0.412 ' NH1' ' HG2' ' A' ' 44' ' ' PRO . 30.9 ttm180 -63.36 -38.12 89.9 Favored 'General case' 0 CA--C 1.541 0.625 0 CA-C-N 116.237 -0.438 . . . . 54.43 111.361 179.643 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 56' ' ' LEU . . . . . 0.678 HD22 HH21 ' A' ' 41' ' ' ARG . 68.6 mt -68.72 -46.81 67.98 Favored 'General case' 0 N--CA 1.472 0.631 0 CA-C-O 120.757 0.313 . . . . 73.41 111.452 174.563 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 57' ' ' ARG . . . . . 0.44 ' HG3' ' O ' ' A' ' 53' ' ' ILE . 69.0 mtp180 -55.79 -46.17 78.03 Favored 'General case' 0 N--CA 1.471 0.593 0 CA-C-O 121.246 0.546 . . . . 54.3 111.073 178.713 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -69.13 -40.97 77.94 Favored 'General case' 0 CA--C 1.536 0.434 0 CA-C-N 116.021 -0.536 . . . . 74.5 112.132 -179.954 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 59' ' ' TYR . . . . . . . . . . . . . 49.6 t80 -63.84 -28.47 69.88 Favored 'General case' 0 N--CA 1.469 0.508 0 CA-C-O 121.051 0.453 . . . . 75.2 110.894 177.695 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 60' ' ' GLN . . . . . . . . . . . . . 17.4 tm0? -78.36 -44.8 24.1 Favored 'General case' 0 CA--C 1.542 0.663 0 CA-C-N 116.196 -0.456 . . . . 75.31 110.355 176.381 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 61' ' ' ASP . . . . . . . . . . . . . 17.1 t70 -55.17 -45.97 75.78 Favored 'General case' 0 CA--C 1.542 0.642 0 N-CA-C 112.36 0.504 . . . . 62.12 112.36 179.359 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 62' ' ' GLN . . . . . . . . . . . . . 17.7 pt20 -65.29 -22.35 66.84 Favored 'General case' 0 CA--C 1.542 0.671 0 N-CA-C 112.588 0.588 . . . . 71.1 112.588 -177.36 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 63' ' ' ILE . . . . . . . . . . . . . 34.9 pt -102.37 -17.1 7.12 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.71 0 N-CA-C 112.0 0.37 . . . . 64.53 112.0 177.535 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 35.4 t 71.19 147.33 0.12 Allowed Pre-proline 0 N--CA 1.483 1.182 0 C-N-CA 123.348 0.659 . . . . 63.52 112.554 177.985 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 65' ' ' PRO . . . . . . . . . . . . . 36.1 Cg_exo -60.3 103.54 0.22 Allowed 'Trans proline' 0 C--N 1.357 0.983 0 C-N-CA 122.353 2.035 . . . . 72.02 112.422 174.186 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 66' ' ' VAL . . . . . . . . . . . . . 26.8 m -96.82 143.67 26.51 Favored Pre-proline 0 CA--C 1.542 0.644 0 N-CA-C 112.25 0.463 . . . . 63.03 112.25 -175.94 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 67' ' ' PRO . . . . . . . . . . . . . 38.2 Cg_endo -66.1 122.04 9.49 Favored 'Trans proline' 0 C--N 1.352 0.745 0 C-N-CA 122.597 2.198 . . . . 71.24 112.329 177.943 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 124.15 -32.64 4.1 Favored Glycine 0 CA--C 1.525 0.718 0 C-N-CA 121.244 -0.503 . . . . 70.42 112.55 -178.538 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 69' ' ' ALA . . . . . 0.456 ' HB1' ' HD2' ' A' ' 70' ' ' PRO . . . -70.58 167.01 30.37 Favored Pre-proline 0 CA--C 1.543 0.683 0 O-C-N 122.665 -0.315 . . . . 65.25 111.108 176.232 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 70' ' ' PRO . . . . . 0.456 ' HD2' ' HB1' ' A' ' 69' ' ' ALA . 86.0 Cg_exo -44.11 118.49 1.67 Allowed 'Trans proline' 0 CA--C 1.544 0.996 0 C-N-CA 122.663 2.242 . . . . 73.41 113.677 177.544 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 58.5 pttt -59.12 107.46 0.55 Allowed 'General case' 0 CA--C 1.545 0.781 0 CA-C-O 121.184 0.516 . . . . 71.31 112.161 -179.002 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -159.26 106.95 1.53 Allowed Pre-proline 0 CA--C 1.537 0.455 0 N-CA-C 112.32 0.489 . . . . 72.1 112.32 -179.565 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 73' ' ' PRO . . . . . . . . . . . . . 73.7 Cg_endo -75.33 167.6 26.37 Favored 'Trans proline' 0 CA--C 1.54 0.8 0 C-N-CA 122.017 1.812 . . . . 74.42 112.201 173.365 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -63.56 157.31 24.04 Favored 'General case' 0 CA--C 1.54 0.574 0 N-CA-C 112.24 0.459 . . . . 53.55 112.24 -178.159 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 75' ' ' ALA . . . . . 0.405 ' HB2' ' HB1' ' A' ' 24' ' ' ALA . . . . . . . . 0 C--O 1.253 1.277 0 CA-C-O 118.887 -0.577 . . . . 72.51 112.339 -178.606 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 25.9 ptt? . . . . . 0 N--CA 1.49 1.55 0 CA-C-O 120.773 0.32 . . . . 62.32 111.291 . . . . . . . . . 0 0 . 1 . 012 nuclear build full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . 72.55 29.22 66.11 Favored Glycine 0 CA--C 1.529 0.948 0 C-N-CA 120.855 -0.688 . . . . 72.03 113.124 -178.806 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 3' ' ' HIS . . . . . . . . . . . . . 32.1 t-80 -86.33 11.55 11.99 Favored 'General case' 0 CA--C 1.545 0.776 0 O-C-N 122.545 -0.385 . . . . 60.22 111.609 -178.125 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 4' ' ' HIS . . . . . . . . . . . . . 28.0 p80 -46.71 140.32 4.62 Favored 'General case' 0 N--CA 1.474 0.75 0 CA-C-O 120.957 0.408 . . . . 72.32 112.099 177.568 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 5' ' ' HIS . . . . . . . . . . . . . 12.1 p80 -149.39 98.09 2.74 Favored 'General case' 0 CA--C 1.539 0.538 0 CA-C-O 121.203 0.525 . . . . 73.3 111.551 179.898 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 10.3 p-80 -160.49 128.93 4.69 Favored 'General case' 0 N--CA 1.469 0.481 0 CA-C-N 116.214 -0.448 . . . . 74.22 110.932 177.869 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 8.1 p80 -173.4 139.39 0.76 Allowed 'General case' 0 N--CA 1.468 0.469 0 CA-C-N 116.541 -0.299 . . . . 61.34 111.219 -179.644 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 8' ' ' HIS . . . . . . . . . . . . . 28.5 t-80 -164.28 112.96 1.15 Allowed 'General case' 0 CA--C 1.538 0.494 0 CA-C-O 120.805 0.336 . . . . 75.33 111.474 178.966 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 66.7 m -94.62 147.11 23.62 Favored 'General case' 0 N--CA 1.471 0.62 0 CA-C-N 116.388 -0.369 . . . . 53.24 111.209 177.736 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 87.5 m-70 -100.12 155.91 17.47 Favored 'General case' 0 N--CA 1.471 0.621 0 CA-C-O 121.078 0.466 . . . . 64.54 111.665 178.809 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 11' ' ' MET . . . . . . . . . . . . . 65.5 mtt -109.85 133.01 53.63 Favored 'General case' 0 N--CA 1.468 0.46 0 CA-C-N 116.235 -0.439 . . . . 54.43 110.741 176.93 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 50.7 m -127.27 132.39 50.36 Favored 'General case' 0 N--CA 1.471 0.611 0 CA-C-O 120.946 0.403 . . . . 74.42 111.169 -178.298 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 13' ' ' THR . . . . . . . . . . . . . 67.8 p -90.38 152.18 45.24 Favored Pre-proline 0 N--CA 1.47 0.53 0 CA-C-O 120.67 0.271 . . . . 62.03 111.455 -179.351 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 14' ' ' PRO . . . . . . . . . . . . . 73.0 Cg_endo -74.01 -166.37 0.31 Allowed 'Trans proline' 0 CA--C 1.542 0.888 0 C-N-CA 122.673 2.249 . . . . 75.33 113.698 -178.956 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 15' ' ' LEU . . . . . 0.444 ' N ' HD23 ' A' ' 15' ' ' LEU . 2.3 pt? -143.27 -173.7 4.0 Favored 'General case' 0 CA--C 1.54 0.558 0 CA-C-N 116.124 -0.489 . . . . 73.41 110.938 -178.924 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 16' ' ' THR . . . . . . . . . . . . . 71.6 p -74.65 -57.97 3.58 Favored 'General case' 0 N--CA 1.474 0.738 0 CA-C-O 120.971 0.415 . . . . 52.22 111.681 179.422 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . 68.84 22.06 75.4 Favored Glycine 0 CA--C 1.525 0.683 0 CA-C-N 116.115 -0.493 . . . . 52.35 112.374 -177.02 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 18' ' ' LYS . . . . . 0.42 ' HA ' ' HD3' ' A' ' 19' ' ' PRO . 9.3 mtpm? -144.52 149.93 45.72 Favored Pre-proline 0 CA--C 1.541 0.628 0 O-C-N 122.619 -0.342 . . . . 71.04 111.917 -175.461 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 19' ' ' PRO . . . . . 0.42 ' HD3' ' HA ' ' A' ' 18' ' ' LYS . 11.3 Cg_exo -72.02 161.2 45.49 Favored 'Trans proline' 0 CA--C 1.54 0.786 0 C-N-CA 123.031 2.488 . . . . 62.42 112.461 173.97 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . -58.32 -46.92 92.3 Favored Glycine 0 CA--C 1.529 0.948 0 C-N-CA 120.887 -0.673 . . . . 53.2 113.212 178.24 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -88.67 -164.61 1.16 Allowed 'General case' 0 CA--C 1.541 0.622 0 CA-C-O 121.02 0.438 . . . . 72.25 111.708 178.85 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 22' ' ' LEU . . . . . 0.519 HD12 ' HB2' ' A' ' 60' ' ' GLN . 88.8 mt -65.73 127.35 93.0 Favored Pre-proline 0 CA--C 1.542 0.655 0 CA-C-N 116.483 -0.326 . . . . 74.3 110.984 177.637 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 23' ' ' PRO . . . . . 0.482 ' HD3' ' HA ' ' A' ' 22' ' ' LEU . 23.3 Cg_exo -62.86 163.1 23.06 Favored 'Trans proline' 0 CA--C 1.539 0.762 0 C-N-CA 123.013 2.475 . . . . 54.34 113.942 -174.554 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -87.27 14.07 8.52 Favored 'General case' 0 N--CA 1.47 0.567 0 CA-C-O 121.269 0.557 . . . . 22.53 111.289 176.293 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 12.0 m120 -104.13 9.27 36.36 Favored 'General case' 0 CA--C 1.536 0.432 0 CA-C-N 116.0 -0.545 . . . . 74.44 111.739 -177.639 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 26' ' ' LEU . . . . . 0.457 HD23 ' SD ' ' A' ' 29' ' ' MET . 63.3 mt -56.39 -27.04 55.1 Favored 'General case' 0 N--CA 1.475 0.812 0 CA-C-O 121.052 0.453 . . . . 53.53 111.849 -174.811 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 5.1 m-20 -61.73 -53.21 59.06 Favored 'General case' 0 CA--C 1.543 0.681 0 CA-C-N 116.07 -0.514 . . . . 60.53 111.158 174.825 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 12.2 m-20 -73.48 -32.55 64.38 Favored 'General case' 0 N--CA 1.471 0.586 0 CA-C-N 116.188 -0.46 . . . . 65.05 111.696 179.484 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 29' ' ' MET . . . . . 0.457 ' SD ' HD23 ' A' ' 26' ' ' LEU . 87.7 mtp -57.13 123.01 13.77 Favored 'General case' 0 N--CA 1.468 0.426 0 CA-C-O 121.049 0.452 . . . . 61.11 110.67 178.461 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 30' ' ' LYS . . . . . 0.451 ' HB2' ' OE1' ' A' ' 33' ' ' GLU . 59.8 mtpt -70.22 167.1 18.62 Favored 'General case' 0 CA--C 1.541 0.624 0 N-CA-C 113.098 0.777 . . . . 75.03 113.098 -170.722 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 46.5 t -50.66 -55.47 6.55 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.681 0 N-CA-C 112.726 0.639 . . . . 64.4 112.726 -174.46 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -60.47 -40.15 90.21 Favored 'General case' 0 N--CA 1.471 0.587 0 CA-C-O 120.979 0.419 . . . . 62.32 111.717 -179.378 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 33' ' ' GLU . . . . . 0.451 ' OE1' ' HB2' ' A' ' 30' ' ' LYS . 0.9 OUTLIER -58.49 -46.19 87.17 Favored 'General case' 0 CA--C 1.541 0.62 0 CA-C-N 115.838 -0.619 . . . . 71.34 111.412 177.113 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 91.6 mt -64.77 -46.43 82.17 Favored 'General case' 0 N--CA 1.471 0.594 0 CA-C-O 121.305 0.574 . . . . 74.43 111.019 176.756 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 35' ' ' LYS . . . . . 0.401 ' HA ' HD12 ' A' ' 38' ' ' LEU . 9.0 mtpm? -60.94 -29.36 69.57 Favored 'General case' 0 CA--C 1.538 0.519 0 CA-C-N 115.882 -0.599 . . . . 71.45 111.929 179.112 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 54.2 tp60 -62.48 -47.63 83.17 Favored 'General case' 0 CA--C 1.538 0.496 0 CA-C-O 120.838 0.352 . . . . 74.1 110.849 176.95 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 29.9 mm-40 -61.92 -45.22 94.67 Favored 'General case' 0 N--CA 1.47 0.555 0 CA-C-O 121.104 0.478 . . . . 75.0 111.129 175.446 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 38' ' ' LEU . . . . . 0.479 ' CD1' HD22 ' A' ' 52' ' ' LEU . 97.3 mt -57.63 -53.95 52.33 Favored 'General case' 0 CA--C 1.541 0.626 0 CA-C-N 116.092 -0.503 . . . . 73.23 112.342 -178.781 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 19.3 ptpt -57.25 -38.25 73.57 Favored 'General case' 0 N--CA 1.474 0.743 0 CA-C-O 120.823 0.344 . . . . 72.35 111.745 -176.975 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 95.8 mt -65.78 -24.34 66.91 Favored 'General case' 0 CA--C 1.538 0.514 0 CA-C-O 121.187 0.518 . . . . 65.34 111.493 178.279 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 41' ' ' ARG . . . . . . . . . . . . . 80.4 mtt-85 -107.13 13.84 26.93 Favored 'General case' 0 CA--C 1.539 0.549 0 CA-C-N 116.143 -0.48 . . . . 73.35 111.754 -177.454 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 69.0 m 62.78 21.75 12.97 Favored 'General case' 0 N--CA 1.478 0.926 0 CA-C-O 121.022 0.439 . . . . 71.14 112.176 178.937 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 57.1 mt -88.57 147.81 40.5 Favored Pre-proline 0 CA--C 1.54 0.575 0 CA-C-N 116.224 -0.443 . . . . 74.03 111.516 -179.563 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 44' ' ' PRO . . . . . 0.527 ' HD2' ' HD3' ' A' ' 55' ' ' ARG . 51.8 Cg_exo -55.47 117.48 4.09 Favored 'Trans proline' 0 C--N 1.353 0.799 0 C-N-CA 122.888 2.392 . . . . 71.01 113.607 177.176 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 33.4 m -92.21 -18.38 7.25 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.579 0 CA-C-N 116.251 -0.431 . . . . 71.02 112.007 -179.944 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 57.2 m -84.51 50.44 1.89 Allowed 'General case' 0 N--CA 1.473 0.705 0 CA-C-O 120.993 0.425 . . . . 71.5 112.025 -177.634 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . -125.16 165.71 18.19 Favored Glycine 0 CA--C 1.526 0.722 0 C-N-CA 121.406 -0.426 . . . . 51.43 112.58 175.486 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 48' ' ' THR . . . . . 0.516 ' O ' ' HG ' ' A' ' 52' ' ' LEU . 68.7 p -76.09 165.05 25.5 Favored 'General case' 0 N--CA 1.472 0.64 0 O-C-N 122.517 -0.402 . . . . 54.15 111.801 178.808 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 49' ' ' LYS . . . . . 0.434 ' O ' HG13 ' A' ' 53' ' ' ILE . 26.7 tptp -44.97 -53.77 7.31 Favored 'General case' 0 N--CA 1.474 0.728 0 C-N-CA 123.234 0.614 . . . . 65.34 112.549 -174.994 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 50' ' ' THR . . . . . . . . . . . . . 60.1 m -62.0 -42.97 99.73 Favored 'General case' 0 N--CA 1.47 0.575 0 CA-C-N 116.617 -0.265 . . . . 72.02 111.703 -179.841 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 44.2 mt-10 -57.4 -41.87 81.13 Favored 'General case' 0 N--CA 1.471 0.622 0 CA-C-O 120.927 0.394 . . . . 72.0 110.933 177.88 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 52' ' ' LEU . . . . . 0.516 ' HG ' ' O ' ' A' ' 48' ' ' THR . 39.1 mt -63.7 -43.21 97.27 Favored 'General case' 0 CA--C 1.539 0.549 0 CA-C-N 116.194 -0.457 . . . . 71.44 111.152 179.376 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 53' ' ' ILE . . . . . 0.434 HG13 ' O ' ' A' ' 49' ' ' LYS . 68.2 mt -65.2 -51.72 61.87 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.524 0 CA-C-N 116.281 -0.418 . . . . 72.15 111.529 -179.917 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 43.7 mt-10 -57.69 -44.47 85.85 Favored 'General case' 0 N--CA 1.47 0.553 0 CA-C-O 120.968 0.413 . . . . 65.32 110.997 177.663 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 55' ' ' ARG . . . . . 0.527 ' HD3' ' HD2' ' A' ' 44' ' ' PRO . 37.2 ttm180 -57.42 -46.49 83.48 Favored 'General case' 0 CA--C 1.539 0.53 0 CA-C-N 115.847 -0.615 . . . . 71.23 111.955 179.496 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 56' ' ' LEU . . . . . 0.449 ' HB3' HD13 ' A' ' 22' ' ' LEU . 77.8 mt -63.78 -49.1 74.28 Favored 'General case' 0 CA--C 1.538 0.485 0 CA-C-O 120.773 0.32 . . . . 52.12 111.725 177.647 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 57' ' ' ARG . . . . . 0.42 ' O ' ' HB2' ' A' ' 61' ' ' ASP . 32.8 mtm180 -64.54 -37.58 88.05 Favored 'General case' 0 CA--C 1.539 0.529 0 N-CA-C 111.83 0.307 . . . . 75.54 111.83 -178.698 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -73.71 -34.57 64.87 Favored 'General case' 0 N--CA 1.47 0.542 0 CA-C-O 121.165 0.507 . . . . 71.14 111.393 178.933 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 59' ' ' TYR . . . . . . . . . . . . . 85.3 t80 -64.43 -55.83 18.31 Favored 'General case' 0 CA--C 1.537 0.453 0 CA-C-O 121.034 0.445 . . . . 74.32 110.701 175.983 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 60' ' ' GLN . . . . . 0.519 ' HB2' HD12 ' A' ' 22' ' ' LEU . 57.0 tp60 -59.99 -38.53 82.84 Favored 'General case' 0 CA--C 1.539 0.544 0 CA-C-N 116.087 -0.506 . . . . 63.34 111.426 178.049 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 61' ' ' ASP . . . . . 0.42 ' HB2' ' O ' ' A' ' 57' ' ' ARG . 15.8 t70 -54.54 -56.71 16.07 Favored 'General case' 0 CA--C 1.541 0.626 0 CA-C-N 116.107 -0.497 . . . . 64.33 112.086 179.107 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 62' ' ' GLN . . . . . . . . . . . . . 11.3 pt20 -72.94 -30.38 63.83 Favored 'General case' 0 CA--C 1.541 0.619 0 N-CA-C 112.941 0.719 . . . . 65.13 112.941 -173.473 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 63' ' ' ILE . . . . . . . . . . . . . 32.5 pt -80.96 -18.96 11.72 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.737 0 O-C-N 122.06 -0.4 . . . . 63.12 111.425 179.82 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 27.7 t -88.53 136.76 30.96 Favored Pre-proline 0 N--CA 1.47 0.539 0 CA-C-N 116.329 -0.396 . . . . 62.32 111.172 177.222 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 65' ' ' PRO . . . . . . . . . . . . . 59.3 Cg_endo -71.2 119.54 6.36 Favored 'Trans proline' 0 CA--C 1.543 0.94 0 C-N-CA 122.535 2.156 . . . . 74.1 112.504 179.194 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 66' ' ' VAL . . . . . 0.55 ' HB ' ' HB3' ' A' ' 69' ' ' ALA . 27.9 m -60.45 124.41 78.27 Favored Pre-proline 0 CA--C 1.547 0.833 0 CA-C-O 121.128 0.489 . . . . 74.05 112.093 -179.127 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 67' ' ' PRO . . . . . . . . . . . . . 98.7 Cg_endo -78.58 91.71 1.18 Allowed 'Trans proline' 0 CA--C 1.541 0.837 0 C-N-CA 122.605 2.203 . . . . 52.32 113.252 -175.949 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 64.43 15.42 59.18 Favored Glycine 0 CA--C 1.531 1.033 0 CA-C-N 116.331 -0.395 . . . . 63.01 113.876 178.791 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 69' ' ' ALA . . . . . 0.55 ' HB3' ' HB ' ' A' ' 66' ' ' VAL . . . -77.55 139.37 63.23 Favored Pre-proline 0 CA--C 1.539 0.557 0 O-C-N 122.624 -0.339 . . . . 32.22 111.477 -179.145 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 70' ' ' PRO . . . . . . . . . . . . . 51.0 Cg_endo -68.26 89.92 0.39 Allowed 'Trans proline' 0 CA--C 1.538 0.7 0 C-N-CA 122.491 2.127 . . . . 63.01 112.992 -179.03 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 36.3 ttpt -82.47 -22.53 35.14 Favored 'General case' 0 CA--C 1.538 0.481 0 CA-C-N 115.941 -0.572 . . . . 73.3 111.088 178.03 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -108.18 95.24 14.93 Favored Pre-proline 0 CA--C 1.541 0.629 0 N-CA-C 112.219 0.451 . . . . 75.45 112.219 -176.647 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 73' ' ' PRO . . . . . . . . . . . . . 97.4 Cg_endo -83.84 -166.83 0.39 Allowed 'Trans proline' 0 CA--C 1.541 0.869 0 C-N-CA 122.446 2.097 . . . . 72.35 112.333 174.465 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -173.59 179.66 2.03 Favored 'General case' 0 N--CA 1.471 0.6 0 C-N-CA 122.49 0.316 . . . . 75.32 110.818 178.761 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.251 1.18 0 CA-C-O 118.989 -0.529 . . . . 71.11 111.297 175.43 . . . . . . . . 0 0 . 1 . 013 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 87.6 mtp . . . . . 0 N--CA 1.489 1.498 0 CA-C-O 120.775 0.322 . . . . 72.3 111.176 . . . . . . . . . 0 0 . 1 . 013 nuclear build full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . 166.5 169.19 29.78 Favored Glycine 0 CA--C 1.521 0.441 0 C-N-CA 120.392 -0.909 . . . . 32.15 113.527 179.304 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 3' ' ' HIS . . . . . . . . . . . . . 87.9 m-70 -99.82 89.8 4.22 Favored 'General case' 0 CA--C 1.535 0.397 0 CA-C-O 121.541 0.686 . . . . 63.13 111.119 -179.058 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 4' ' ' HIS . . . . . . . . . . . . . 15.4 p80 -94.54 89.68 5.9 Favored 'General case' 0 CA--C 1.54 0.568 0 CA-C-N 115.721 -0.672 . . . . 74.33 111.563 -178.338 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 5' ' ' HIS . . . . . . . . . . . . . 14.9 p-80 -93.08 1.19 57.33 Favored 'General case' 0 CA--C 1.543 0.674 0 CA-C-N 115.935 -0.575 . . . . 63.34 111.894 -178.969 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 61.1 t60 69.03 161.59 0.21 Allowed 'General case' 0 CA--C 1.55 0.965 0 CA-C-O 121.082 0.468 . . . . 62.11 111.537 175.707 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 93.4 m-70 -95.2 166.43 11.91 Favored 'General case' 0 N--CA 1.475 0.799 0 O-C-N 121.888 -0.508 . . . . 70.2 112.023 -179.823 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 8' ' ' HIS . . . . . . . . . . . . . 80.2 m-70 -125.47 78.3 1.72 Allowed 'General case' 0 N--CA 1.47 0.572 0 CA-C-O 121.238 0.542 . . . . 75.04 111.012 173.323 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 71.5 p -81.86 115.55 21.11 Favored 'General case' 0 N--CA 1.468 0.452 0 CA-C-N 116.29 -0.413 . . . . 74.11 110.685 178.498 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 63.9 m-70 -76.88 124.81 28.29 Favored 'General case' 0 N--CA 1.469 0.48 0 CA-C-N 116.418 -0.356 . . . . 70.01 111.146 -175.915 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 11' ' ' MET . . . . . . . . . . . . . 22.9 ptt? -140.23 149.52 42.99 Favored 'General case' 0 N--CA 1.469 0.51 0 CA-C-N 116.481 -0.327 . . . . 44.1 111.008 -179.741 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 93.8 p -146.78 179.11 7.8 Favored 'General case' 0 N--CA 1.471 0.618 0 CA-C-O 121.24 0.543 . . . . 75.01 112.331 -177.703 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 13' ' ' THR . . . . . . . . . . . . . 35.1 p -94.62 148.78 35.47 Favored Pre-proline 0 N--CA 1.47 0.575 0 CA-C-N 115.957 -0.565 . . . . 73.45 111.504 177.264 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 14' ' ' PRO . . . . . . . . . . . . . 59.8 Cg_endo -71.7 133.22 21.65 Favored 'Trans proline' 0 CA--C 1.541 0.838 0 C-N-CA 122.593 2.195 . . . . 73.54 112.947 178.379 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 75.9 mt -98.38 170.41 8.87 Favored 'General case' 0 CA--C 1.54 0.589 0 CA-C-O 121.254 0.55 . . . . 45.24 111.837 -177.786 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 16' ' ' THR . . . . . . . . . . . . . 8.9 t -156.5 155.12 31.45 Favored 'General case' 0 N--CA 1.472 0.651 0 CA-C-N 116.267 -0.424 . . . . 71.24 111.363 177.731 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . -138.31 28.33 2.69 Favored Glycine 0 CA--C 1.525 0.659 0 C-N-CA 121.332 -0.461 . . . . 63.25 112.841 179.096 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 10.3 mtmp? -113.69 138.75 22.78 Favored Pre-proline 0 N--CA 1.472 0.632 0 O-C-N 122.606 -0.349 . . . . 52.23 111.651 179.545 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 73.4 Cg_endo -84.16 165.81 12.88 Favored 'Trans proline' 0 CA--C 1.543 0.951 0 C-N-CA 122.84 2.36 . . . . 54.12 112.852 175.674 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . -153.0 78.38 0.2 Allowed Glycine 0 CA--C 1.528 0.864 0 C-N-CA 120.92 -0.657 . . . . 55.35 113.461 179.774 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -139.87 134.63 31.94 Favored 'General case' 0 N--CA 1.47 0.551 0 CA-C-O 120.866 0.365 . . . . 71.31 111.766 178.305 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 88.5 mt -80.44 153.09 73.69 Favored Pre-proline 0 CA--C 1.542 0.648 0 CA-C-N 116.573 -0.285 . . . . 72.31 111.675 178.706 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 23' ' ' PRO . . . . . 0.473 ' O ' ' HG ' ' A' ' 26' ' ' LEU . 15.6 Cg_exo -68.74 114.21 3.46 Favored 'Trans proline' 0 CA--C 1.541 0.84 0 C-N-CA 122.418 2.079 . . . . 72.33 111.767 172.612 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -47.02 -30.68 2.77 Favored 'General case' 0 N--CA 1.474 0.771 0 N-CA-C 113.122 0.786 . . . . 71.13 113.122 -176.781 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 25' ' ' ASN . . . . . 0.484 ' HB3' ' HB3' ' A' ' 28' ' ' ASP . 14.4 m120 -82.34 33.84 0.41 Allowed 'General case' 0 CA--C 1.545 0.786 0 N-CA-C 112.465 0.542 . . . . 74.44 112.465 -178.719 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 26' ' ' LEU . . . . . 0.473 ' HG ' ' O ' ' A' ' 23' ' ' PRO . 85.6 mt -50.75 -56.84 10.17 Favored 'General case' 0 N--CA 1.476 0.829 0 N-CA-C 112.221 0.452 . . . . 52.21 112.221 179.128 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 15.5 t70 -64.59 -22.54 67.0 Favored 'General case' 0 CA--C 1.544 0.741 0 CA-C-O 120.893 0.378 . . . . 75.23 111.753 -177.768 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 28' ' ' ASP . . . . . 0.484 ' HB3' ' HB3' ' A' ' 25' ' ' ASN . 26.0 t70 -74.56 -34.18 62.86 Favored 'General case' 0 CA--C 1.54 0.591 0 CA-C-N 116.385 -0.371 . . . . 73.42 111.431 178.885 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 29' ' ' MET . . . . . . . . . . . . . 49.4 mtm -73.92 150.97 40.53 Favored 'General case' 0 CA--C 1.537 0.448 0 CA-C-O 121.048 0.451 . . . . 74.31 111.486 -179.694 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 52.0 mtmt -69.12 153.77 43.17 Favored 'General case' 0 CA--C 1.537 0.479 0 CA-C-N 116.162 -0.472 . . . . 73.24 111.822 -178.049 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 31' ' ' VAL . . . . . 0.423 HG13 HD11 ' A' ' 52' ' ' LEU . 91.7 t -49.09 -43.37 15.53 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.679 0 N-CA-C 112.316 0.488 . . . . 72.13 112.316 -177.75 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -58.96 -44.03 91.39 Favored 'General case' 0 N--CA 1.47 0.574 0 CA-C-O 120.814 0.34 . . . . 75.52 111.756 176.687 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 47.3 mt-10 -63.61 -36.36 83.57 Favored 'General case' 0 N--CA 1.47 0.56 0 CA-C-O 120.928 0.394 . . . . 71.25 111.079 178.73 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 34' ' ' LEU . . . . . 0.457 HD21 ' O ' ' A' ' 26' ' ' LEU . 89.4 mt -69.06 -40.83 78.28 Favored 'General case' 0 CA--C 1.539 0.537 0 CA-C-O 120.923 0.392 . . . . 73.51 111.339 176.372 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 94.6 mttt -67.56 -28.15 67.55 Favored 'General case' 0 CA--C 1.536 0.433 0 CA-C-O 120.873 0.368 . . . . 50.31 110.82 174.844 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 53.2 tp60 -64.68 -44.12 91.36 Favored 'General case' 0 N--CA 1.469 0.512 0 N-CA-C 109.89 -0.411 . . . . 70.12 109.89 172.912 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 37' ' ' GLU . . . . . 0.455 ' HB3' ' NH2' ' A' ' 41' ' ' ARG . 55.9 mm-40 -53.23 -40.9 64.89 Favored 'General case' 0 N--CA 1.471 0.607 0 CA-C-N 115.971 -0.559 . . . . 75.12 111.473 174.636 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 38' ' ' LEU . . . . . 0.525 HD13 ' O ' ' A' ' 44' ' ' PRO . 96.6 mt -70.53 -57.48 4.72 Favored 'General case' 0 CA--C 1.538 0.499 0 CA-C-N 115.958 -0.564 . . . . 71.43 112.129 -179.874 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 17.8 ptpt -59.54 -39.13 82.96 Favored 'General case' 0 N--CA 1.472 0.648 0 N-CA-C 112.265 0.469 . . . . 74.13 112.265 -173.99 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 86.0 mt -64.62 -13.6 54.32 Favored 'General case' 0 N--CA 1.473 0.691 0 N-CA-C 112.1 0.408 . . . . 73.52 112.1 179.826 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 41' ' ' ARG . . . . . 0.455 ' NH2' ' HB3' ' A' ' 37' ' ' GLU . 39.0 mtm-85 -124.83 25.59 7.35 Favored 'General case' 0 CA--C 1.543 0.679 0 CA-C-O 120.838 0.351 . . . . 61.45 111.526 179.506 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 73.3 m 63.58 32.44 14.05 Favored 'General case' 0 N--CA 1.48 1.035 0 N-CA-C 113.118 0.785 . . . . 54.44 113.118 174.175 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 43' ' ' LEU . . . . . 0.42 ' HA ' ' HD3' ' A' ' 44' ' ' PRO . 71.6 mt -104.02 145.41 30.6 Favored Pre-proline 0 CA--C 1.544 0.741 0 CA-C-O 120.712 0.292 . . . . 53.13 111.731 178.226 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 44' ' ' PRO . . . . . 0.525 ' O ' HD13 ' A' ' 38' ' ' LEU . 32.1 Cg_exo -62.44 135.59 54.36 Favored 'Trans proline' 0 C--N 1.354 0.849 0 C-N-CA 122.724 2.283 . . . . 54.4 112.898 178.662 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 45' ' ' VAL . . . . . 0.465 HG12 ' HB2' ' A' ' 38' ' ' LEU . 33.1 m -109.39 12.1 8.8 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.853 0 N-CA-C 112.55 0.574 . . . . 71.3 112.55 -176.524 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 46.8 m -79.7 9.17 5.4 Favored 'General case' 0 N--CA 1.476 0.841 0 N-CA-C 113.22 0.822 . . . . 54.31 113.22 -173.869 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . -106.21 170.82 17.0 Favored Glycine 0 CA--C 1.529 0.909 0 C-N-CA 120.797 -0.716 . . . . 43.41 113.911 -178.966 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 48' ' ' THR . . . . . 0.614 ' O ' ' HG ' ' A' ' 52' ' ' LEU . 74.9 p -83.21 178.04 8.27 Favored 'General case' 0 N--CA 1.472 0.645 0 C-N-CA 122.494 0.318 . . . . 73.23 111.446 176.627 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 88.5 tttt -46.42 -47.02 19.05 Favored 'General case' 0 CA--C 1.545 0.782 0 N-CA-C 112.755 0.65 . . . . 71.03 112.755 -175.903 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 50' ' ' THR . . . . . . . . . . . . . 56.7 m -64.43 -44.53 90.87 Favored 'General case' 0 N--CA 1.474 0.775 0 CA-C-O 120.714 0.292 . . . . 75.21 111.243 178.752 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 23.4 mm-40 -55.75 -44.64 77.78 Favored 'General case' 0 N--CA 1.473 0.717 0 CA-C-O 121.167 0.508 . . . . 74.11 111.28 177.101 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 52' ' ' LEU . . . . . 0.614 ' HG ' ' O ' ' A' ' 48' ' ' THR . 28.9 mt -57.63 -51.83 67.89 Favored 'General case' 0 N--CA 1.469 0.491 0 CA-C-N 115.773 -0.649 . . . . 70.33 111.607 -177.771 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 53' ' ' ILE . . . . . 0.401 ' O ' ' HG3' ' A' ' 57' ' ' ARG . 68.2 mt -60.47 -52.54 60.29 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.457 0 CA-C-N 116.352 -0.385 . . . . 65.44 111.772 179.887 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 33.7 mt-10 -60.73 -34.01 73.77 Favored 'General case' 0 N--CA 1.471 0.586 0 CA-C-O 120.931 0.396 . . . . 63.14 111.595 -178.949 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -64.82 -42.87 94.62 Favored 'General case' 0 CA--C 1.54 0.573 0 CA-C-O 121.221 0.534 . . . . 75.14 110.408 177.87 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 56' ' ' LEU . . . . . 0.413 HD22 HH21 ' A' ' 41' ' ' ARG . 97.3 mt -61.45 -46.13 91.37 Favored 'General case' 0 N--CA 1.47 0.53 0 CA-C-N 115.988 -0.551 . . . . 74.31 111.001 174.214 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 57' ' ' ARG . . . . . 0.401 ' HG3' ' O ' ' A' ' 53' ' ' ILE . 66.8 mtp180 -60.67 -36.04 77.73 Favored 'General case' 0 CA--C 1.544 0.73 0 CA-C-N 116.382 -0.372 . . . . 74.23 111.707 179.563 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -67.76 -39.02 84.19 Favored 'General case' 0 N--CA 1.472 0.654 0 CA-C-O 121.1 0.476 . . . . 65.3 111.12 175.797 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 59' ' ' TYR . . . . . . . . . . . . . 75.2 t80 -62.74 -44.82 95.22 Favored 'General case' 0 CA--C 1.542 0.661 0 CA-C-N 116.215 -0.448 . . . . 71.23 111.154 175.772 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 60' ' ' GLN . . . . . . . . . . . . . 15.5 mm100 -65.18 -45.78 83.45 Favored 'General case' 0 N--CA 1.471 0.584 0 CA-C-O 121.12 0.486 . . . . 74.25 111.501 177.494 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 61' ' ' ASP . . . . . . . . . . . . . 27.1 t70 -47.13 -38.83 12.26 Favored 'General case' 0 CA--C 1.543 0.704 0 CA-C-N 115.565 -0.743 . . . . 70.24 112.892 -178.231 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 62' ' ' GLN . . . . . . . . . . . . . 9.6 pt20 -87.05 -26.99 23.43 Favored 'General case' 0 CA--C 1.544 0.725 0 N-CA-C 112.954 0.724 . . . . 74.13 112.954 -175.612 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 63' ' ' ILE . . . . . . . . . . . . . 36.4 pt -97.09 -20.28 5.74 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.828 0 N-CA-C 112.576 0.584 . . . . 72.34 112.576 -176.212 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 26.0 t -70.48 141.7 88.37 Favored Pre-proline 0 N--CA 1.473 0.676 0 N-CA-C 111.689 0.255 . . . . 73.11 111.689 -177.113 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 65' ' ' PRO . . . . . . . . . . . . . 56.4 Cg_endo -69.19 78.51 0.81 Allowed 'Trans proline' 0 CA--C 1.542 0.896 0 C-N-CA 122.531 2.154 . . . . 64.5 113.254 -179.702 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 66' ' ' VAL . . . . . 0.403 ' HA ' ' HD3' ' A' ' 67' ' ' PRO . 23.9 m -94.91 146.98 32.32 Favored Pre-proline 0 CA--C 1.545 0.788 0 CA-C-N 116.039 -0.528 . . . . 73.4 111.786 178.554 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 67' ' ' PRO . . . . . 0.403 ' HD3' ' HA ' ' A' ' 66' ' ' VAL . 45.5 Cg_exo -57.91 -52.12 6.6 Favored 'Trans proline' 0 CA--C 1.544 0.983 0 C-N-CA 123.0 2.467 . . . . 71.42 114.322 -176.89 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . -69.91 -43.9 64.02 Favored Glycine 0 CA--C 1.529 0.937 0 C-N-CA 121.067 -0.587 . . . . 53.2 113.533 -178.943 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . 68.32 115.77 0.03 OUTLIER Pre-proline 0 N--CA 1.472 0.669 0 C-N-CA 123.185 0.594 . . . . 63.2 112.261 178.963 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 70' ' ' PRO . . . . . . . . . . . . . 72.0 Cg_exo -50.93 134.96 43.18 Favored 'Trans proline' 0 CA--C 1.542 0.901 0 C-N-CA 122.767 2.312 . . . . 72.24 113.039 178.326 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 18.7 ptpt -61.18 -19.05 61.14 Favored 'General case' 0 N--CA 1.471 0.611 0 N-CA-C 112.931 0.715 . . . . 70.2 112.931 -175.868 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -120.06 81.31 27.84 Favored Pre-proline 0 N--CA 1.472 0.636 0 CA-C-O 120.867 0.365 . . . . 72.42 111.482 177.941 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 73' ' ' PRO . . . . . . . . . . . . . 42.4 Cg_endo -96.37 -170.5 0.16 Allowed 'Trans proline' 0 CA--C 1.54 0.821 0 C-N-CA 123.344 2.696 . . . . 75.21 113.416 179.478 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -101.1 138.11 38.57 Favored 'General case' 0 CA--C 1.54 0.579 0 CA-C-N 116.237 -0.438 . . . . 63.22 111.271 176.249 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.252 1.229 0 CA-C-O 118.622 -0.704 . . . . 73.34 111.85 -179.875 . . . . . . . . 0 0 . 1 . 014 nuclear build full ' A' A ' 1' ' ' MET . . . . . 0.482 ' SD ' ' N ' ' A' ' 1' ' ' MET . 0.0 OUTLIER . . . . . 0 N--CA 1.487 1.41 0 CA-C-O 120.762 0.315 . . . . 64.14 111.251 . . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . -154.4 157.76 27.75 Favored Glycine 0 CA--C 1.526 0.727 0 C-N-CA 120.974 -0.632 . . . . 32.2 113.404 -178.889 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 3' ' ' HIS . . . . . . . . . . . . . 59.4 t-80 -84.79 121.48 27.76 Favored 'General case' 0 CA--C 1.54 0.57 0 CA-C-O 120.672 0.273 . . . . 64.23 111.343 -179.377 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 4' ' ' HIS . . . . . . . . . . . . . 50.1 t60 -102.67 104.12 14.44 Favored 'General case' 0 N--CA 1.473 0.685 0 CA-C-O 120.847 0.356 . . . . 72.21 111.143 178.84 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 5' ' ' HIS . . . . . . . . . . . . . 51.7 t-80 -93.76 104.79 16.86 Favored 'General case' 0 CA--C 1.541 0.598 0 CA-C-O 120.939 0.399 . . . . 70.12 111.436 -179.562 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 6.6 p-80 -75.92 146.29 39.8 Favored 'General case' 0 N--CA 1.474 0.742 0 N-CA-C 112.26 0.467 . . . . 73.22 112.26 -178.003 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 25.7 p80 -164.52 163.48 21.99 Favored 'General case' 0 N--CA 1.472 0.644 0 CA-C-N 116.219 -0.446 . . . . 75.22 112.039 -179.464 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 8' ' ' HIS . . . . . . . . . . . . . 54.4 p-80 -144.5 160.96 40.23 Favored 'General case' 0 CA--C 1.543 0.679 0 CA-C-N 116.42 -0.355 . . . . 75.32 110.975 174.939 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 92.3 p -141.14 -176.51 4.72 Favored 'General case' 0 N--CA 1.477 0.911 0 CA-C-O 120.96 0.41 . . . . 64.41 111.664 -177.828 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 45.2 m80 -113.47 160.84 18.04 Favored 'General case' 0 N--CA 1.471 0.616 0 CA-C-O 120.923 0.392 . . . . 64.31 111.477 179.205 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 11' ' ' MET . . . . . . . . . . . . . 52.0 ttm -141.41 104.45 4.59 Favored 'General case' 0 CA--C 1.54 0.566 0 CA-C-O 120.92 0.391 . . . . 74.03 110.977 176.14 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 66.1 p -86.22 138.12 32.11 Favored 'General case' 0 N--CA 1.472 0.64 0 CA-C-O 121.057 0.456 . . . . 75.02 111.838 -178.762 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 13' ' ' THR . . . . . . . . . . . . . 81.1 p -100.62 154.77 36.99 Favored Pre-proline 0 N--CA 1.473 0.689 0 CA-C-N 116.168 -0.469 . . . . 74.11 111.239 179.396 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 14' ' ' PRO . . . . . . . . . . . . . 98.4 Cg_endo -80.07 158.85 23.79 Favored 'Trans proline' 0 CA--C 1.544 1.011 0 C-N-CA 122.513 2.142 . . . . 64.15 113.99 -176.831 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 2.3 pt? -73.49 166.32 23.44 Favored 'General case' 0 CA--C 1.541 0.6 0 CA-C-N 116.04 -0.527 . . . . 74.4 111.098 173.915 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 16' ' ' THR . . . . . . . . . . . . . 90.9 m -147.08 138.93 24.33 Favored 'General case' 0 N--CA 1.472 0.651 0 CA-C-O 120.908 0.385 . . . . 70.51 111.905 -179.347 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . -93.29 103.52 3.05 Favored Glycine 0 CA--C 1.528 0.859 0 CA-C-N 116.312 -0.404 . . . . 21.01 112.168 175.499 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 45.7 mtmt -55.76 116.75 12.92 Favored Pre-proline 0 CA--C 1.544 0.727 0 N-CA-C 112.31 0.485 . . . . 72.45 112.31 -175.767 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 87.9 Cg_endo -83.84 131.52 5.31 Favored 'Trans proline' 0 CA--C 1.541 0.826 0 C-N-CA 122.594 2.196 . . . . 73.31 113.161 178.488 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . -129.84 -54.61 0.1 Allowed Glycine 0 N--CA 1.465 0.589 0 CA-C-N 116.308 -0.405 . . . . 71.4 112.117 175.633 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -124.4 134.95 52.96 Favored 'General case' 0 CA--C 1.535 0.397 0 CA-C-O 120.825 0.345 . . . . 70.34 110.811 176.65 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 22' ' ' LEU . . . . . 0.548 ' HG ' ' HG3' ' A' ' 60' ' ' GLN . 94.3 mt -78.3 149.18 75.46 Favored Pre-proline 0 N--CA 1.47 0.568 0 N-CA-C 111.955 0.354 . . . . 72.42 111.955 -177.533 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 23' ' ' PRO . . . . . 0.62 ' O ' ' HG ' ' A' ' 26' ' ' LEU . 22.9 Cg_exo -64.85 125.51 14.9 Favored 'Trans proline' 0 CA--C 1.538 0.701 0 C-N-CA 122.626 2.217 . . . . 71.53 111.773 173.269 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -56.27 -23.96 39.82 Favored 'General case' 0 CA--C 1.542 0.656 0 N-CA-C 112.934 0.716 . . . . 72.31 112.934 -176.339 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 3.7 m-20 -82.23 19.21 1.23 Allowed 'General case' 0 CA--C 1.545 0.772 0 N-CA-C 113.314 0.857 . . . . 72.24 113.314 -177.063 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 26' ' ' LEU . . . . . 0.62 ' HG ' ' O ' ' A' ' 23' ' ' PRO . 77.8 mt -50.32 -47.77 55.61 Favored 'General case' 0 N--CA 1.479 0.996 0 O-C-N 121.946 -0.471 . . . . 74.24 111.771 176.86 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 27' ' ' ASP . . . . . 0.442 ' HB3' HD13 ' A' ' 53' ' ' ILE . 1.0 OUTLIER -71.59 -28.7 64.0 Favored 'General case' 0 CA--C 1.539 0.551 0 N-CA-C 112.246 0.461 . . . . 62.3 112.246 179.055 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 34.6 t70 -77.31 -24.15 50.94 Favored 'General case' 0 CA--C 1.544 0.745 0 N-CA-C 111.725 0.268 . . . . 63.11 111.725 -179.784 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 29' ' ' MET . . . . . . . . . . . . . 68.8 mtm -79.07 -178.26 6.04 Favored 'General case' 0 CA--C 1.539 0.55 0 CA-C-O 121.296 0.569 . . . . 70.43 111.95 178.484 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 28.2 mtpp -87.37 165.23 15.75 Favored 'General case' 0 CA--C 1.539 0.523 0 CA-C-O 121.225 0.536 . . . . 71.14 112.094 -177.206 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 42.3 t -62.16 -42.63 95.88 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.556 0 CA-C-N 116.215 -0.448 . . . . 71.23 111.218 179.574 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -54.98 -39.03 68.55 Favored 'General case' 0 CA--C 1.539 0.542 0 CA-C-N 116.163 -0.471 . . . . 73.0 112.193 179.004 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 22.5 mm-40 -60.34 -48.43 81.76 Favored 'General case' 0 N--CA 1.469 0.507 0 CA-C-O 120.933 0.397 . . . . 72.03 111.177 177.954 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 34' ' ' LEU . . . . . 0.434 ' O ' ' HG ' ' A' ' 38' ' ' LEU . 67.8 mt -58.89 -47.04 86.36 Favored 'General case' 0 N--CA 1.468 0.438 0 CA-C-O 121.174 0.511 . . . . 73.52 111.169 178.289 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 35' ' ' LYS . . . . . 0.531 ' HA ' HD12 ' A' ' 38' ' ' LEU . 7.4 mtpm? -58.02 -37.75 74.91 Favored 'General case' 0 CA--C 1.541 0.619 0 CA-C-N 115.969 -0.559 . . . . 65.13 111.258 177.745 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 19.6 tm0? -68.88 -42.73 76.58 Favored 'General case' 0 CA--C 1.544 0.731 0 CA-C-O 120.957 0.408 . . . . 73.24 110.209 177.053 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 37' ' ' GLU . . . . . 0.471 ' HB3' HH21 ' A' ' 41' ' ' ARG . 36.9 mm-40 -58.57 -29.88 66.73 Favored 'General case' 0 N--CA 1.474 0.738 0 CA-C-N 116.287 -0.415 . . . . 64.14 111.937 176.166 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 38' ' ' LEU . . . . . 0.547 HD11 HD22 ' A' ' 52' ' ' LEU . 78.7 mt -73.95 -54.85 7.02 Favored 'General case' 0 CA--C 1.541 0.62 0 CA-C-N 116.137 -0.483 . . . . 74.33 112.126 -179.051 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -57.04 -31.16 64.87 Favored 'General case' 0 N--CA 1.476 0.854 0 N-CA-C 112.423 0.527 . . . . 52.32 112.423 -176.57 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 98.6 mt -61.34 -36.16 79.4 Favored 'General case' 0 N--CA 1.471 0.608 0 CA-C-O 121.235 0.54 . . . . 73.55 111.427 177.366 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 41' ' ' ARG . . . . . 0.471 HH21 ' HB3' ' A' ' 37' ' ' GLU . 13.9 mtm180 -109.03 27.24 9.71 Favored 'General case' 0 CA--C 1.542 0.649 0 CA-C-N 116.002 -0.545 . . . . 73.02 112.307 -175.949 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 38.3 t 68.98 12.63 8.67 Favored 'General case' 0 N--CA 1.48 1.059 0 N-CA-C 112.578 0.585 . . . . 72.1 112.578 173.566 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 71.9 mt -87.47 148.11 43.53 Favored Pre-proline 0 CA--C 1.542 0.661 0 O-C-N 122.333 -0.23 . . . . 72.42 111.137 -179.971 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 44' ' ' PRO . . . . . 0.444 ' O ' HD13 ' A' ' 38' ' ' LEU . 67.9 Cg_endo -70.73 125.35 11.55 Favored 'Trans proline' 0 C--N 1.352 0.752 0 C-N-CA 122.284 1.989 . . . . 71.14 112.637 -177.895 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 45' ' ' VAL . . . . . 0.451 HG12 ' O ' ' A' ' 35' ' ' LYS . 30.5 m -76.72 27.42 0.04 OUTLIER 'Isoleucine or valine' 0 CA--C 1.546 0.808 0 N-CA-C 112.936 0.717 . . . . 74.41 112.936 -176.108 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 68.7 m -123.65 130.51 52.77 Favored 'General case' 0 N--CA 1.471 0.595 0 CA-C-O 121.231 0.539 . . . . 75.24 111.777 -178.428 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 152.29 164.12 12.1 Favored Glycine 0 CA--C 1.528 0.906 0 CA-C-N 115.363 -0.835 . . . . 73.54 112.045 -179.182 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 48' ' ' THR . . . . . 0.424 ' O ' ' HG ' ' A' ' 52' ' ' LEU . 44.1 p -77.09 162.16 27.7 Favored 'General case' 0 N--CA 1.475 0.806 0 CA-C-N 117.629 0.714 . . . . 73.0 111.786 -179.8 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 49' ' ' LYS . . . . . 0.499 ' O ' HG13 ' A' ' 53' ' ' ILE . 24.2 tptm -44.26 -61.57 1.46 Allowed 'General case' 0 N--CA 1.472 0.651 0 CA-C-N 116.032 -0.531 . . . . 72.12 112.154 -178.883 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 50' ' ' THR . . . . . 0.474 ' HA ' HD12 ' A' ' 53' ' ' ILE . 34.6 m -56.59 -45.48 81.37 Favored 'General case' 0 N--CA 1.472 0.643 0 N-CA-C 112.129 0.418 . . . . 73.21 112.129 -176.718 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 48.0 mt-10 -66.09 -41.0 91.24 Favored 'General case' 0 CA--C 1.536 0.433 0 N-CA-C 112.248 0.462 . . . . 75.31 112.248 -176.441 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 52' ' ' LEU . . . . . 0.547 HD22 HD11 ' A' ' 38' ' ' LEU . 62.6 mt -62.8 -42.02 99.54 Favored 'General case' 0 N--CA 1.469 0.517 0 CA-C-O 121.046 0.45 . . . . 70.24 111.24 179.024 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 53' ' ' ILE . . . . . 0.499 HG13 ' O ' ' A' ' 49' ' ' LYS . 35.1 mt -58.02 -54.64 29.38 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.435 0 CA-C-O 121.365 0.603 . . . . 62.24 110.914 176.68 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 54.1 mm-40 -67.23 -24.64 65.84 Favored 'General case' 0 CA--C 1.535 0.39 0 CA-C-N 115.935 -0.575 . . . . 70.42 111.876 179.363 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 37.1 ttm180 -67.06 -45.83 76.2 Favored 'General case' 0 N--CA 1.467 0.419 0 CA-C-O 120.991 0.424 . . . . 73.44 110.408 175.637 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 83.0 mt -60.72 -48.65 80.85 Favored 'General case' 0 CA--C 1.539 0.522 0 CA-C-O 121.125 0.488 . . . . 74.44 111.079 174.925 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 65.7 mtt180 -62.03 -38.25 87.99 Favored 'General case' 0 N--CA 1.469 0.5 0 CA-C-N 116.194 -0.457 . . . . 74.42 111.555 178.246 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -66.08 -40.56 90.94 Favored 'General case' 0 CA--C 1.534 0.328 0 CA-C-O 120.884 0.373 . . . . 73.51 111.068 177.352 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 59' ' ' TYR . . . . . 0.436 ' O ' ' HG2' ' A' ' 62' ' ' GLN . 71.1 t80 -58.91 -48.42 81.53 Favored 'General case' 0 CA--C 1.538 0.494 0 CA-C-N 116.144 -0.48 . . . . 73.24 110.987 177.457 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 60' ' ' GLN . . . . . 0.548 ' HG3' ' HG ' ' A' ' 22' ' ' LEU . 86.4 mm-40 -63.35 -42.54 98.93 Favored 'General case' 0 CA--C 1.539 0.537 0 CA-C-O 120.747 0.308 . . . . 71.25 111.275 175.861 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 61' ' ' ASP . . . . . . . . . . . . . 27.0 t70 -56.81 -47.69 79.68 Favored 'General case' 0 CA--C 1.541 0.6 0 N-CA-C 112.022 0.379 . . . . 74.53 112.022 179.498 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 62' ' ' GLN . . . . . 0.436 ' HG2' ' O ' ' A' ' 59' ' ' TYR . 14.2 pt20 -69.38 -31.21 69.45 Favored 'General case' 0 CA--C 1.539 0.544 0 N-CA-C 112.026 0.38 . . . . 75.22 112.026 -177.343 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 63' ' ' ILE . . . . . . . . . . . . . 26.0 pt -95.34 5.19 8.34 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.77 0 N-CA-C 111.833 0.308 . . . . 74.22 111.833 178.922 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 46.9 t 71.98 105.2 0.03 OUTLIER Pre-proline 0 N--CA 1.475 0.791 0 C-N-CA 123.327 0.651 . . . . 72.32 111.797 -178.588 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 65' ' ' PRO . . . . . . . . . . . . . 14.4 Cg_exo -68.34 112.4 2.78 Favored 'Trans proline' 0 CA--C 1.537 0.646 0 C-N-CA 122.664 2.242 . . . . 75.42 112.157 179.454 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 66' ' ' VAL . . . . . . . . . . . . . 27.0 m -103.6 132.33 21.17 Favored Pre-proline 0 CA--C 1.542 0.64 0 CA-C-O 120.99 0.424 . . . . 64.23 111.928 -178.506 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 67' ' ' PRO . . . . . . . . . . . . . 85.9 Cg_endo -77.55 0.22 10.0 Favored 'Trans proline' 0 CA--C 1.54 0.818 0 C-N-CA 122.565 2.177 . . . . 74.21 112.591 178.038 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 123.41 -25.64 6.23 Favored Glycine 0 CA--C 1.523 0.56 0 CA-C-N 116.281 -0.418 . . . . 61.2 112.394 -177.022 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 69' ' ' ALA . . . . . 0.405 ' HB1' ' HD2' ' A' ' 70' ' ' PRO . . . 68.48 159.1 0.15 Allowed Pre-proline 0 CA--C 1.545 0.75 0 C-N-CA 122.977 0.511 . . . . 61.34 112.056 178.906 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 70' ' ' PRO . . . . . 0.405 ' HD2' ' HB1' ' A' ' 69' ' ' ALA . 56.8 Cg_endo -70.43 30.25 0.2 Allowed 'Trans proline' 0 CA--C 1.548 1.215 0 C-N-CA 122.554 2.17 . . . . 71.33 113.563 177.818 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 7.0 mtpm? -80.14 82.13 6.26 Favored 'General case' 0 CA--C 1.537 0.477 0 CA-C-O 121.034 0.445 . . . . 75.45 110.764 177.839 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -105.06 108.16 60.61 Favored Pre-proline 0 CA--C 1.539 0.551 0 N-CA-C 112.511 0.56 . . . . 42.3 112.511 -175.982 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 73' ' ' PRO . . . . . . . . . . . . . 73.8 Cg_endo -86.27 12.32 3.05 Favored 'Trans proline' 0 CA--C 1.542 0.887 0 C-N-CA 122.842 2.361 . . . . 63.53 112.842 174.643 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -96.72 -166.45 1.41 Allowed 'General case' 0 CA--C 1.543 0.699 0 CA-C-N 116.358 -0.383 . . . . 73.02 111.798 -179.121 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.253 1.24 0 CA-C-O 118.996 -0.526 . . . . 75.15 111.826 178.379 . . . . . . . . 0 0 . 1 . 015 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 86.5 mtp . . . . . 0 N--CA 1.491 1.596 0 CA-C-O 120.814 0.34 . . . . 55.14 111.235 . . . . . . . . . 0 0 . 1 . 015 nuclear build full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . 118.68 167.9 14.03 Favored Glycine 0 CA--C 1.521 0.416 0 C-N-CA 121.19 -0.528 . . . . 73.15 111.982 -178.223 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 3' ' ' HIS . . . . . . . . . . . . . 97.1 m-70 -133.05 160.07 38.24 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-O 121.25 0.548 . . . . 74.42 111.776 -178.775 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 4' ' ' HIS . . . . . . . . . . . . . 12.2 p80 -120.28 129.75 54.17 Favored 'General case' 0 CA--C 1.534 0.349 0 CA-C-N 115.947 -0.57 . . . . 72.13 111.205 -177.969 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 5' ' ' HIS . . . . . . . . . . . . . 49.4 t-80 -131.13 130.89 43.66 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-O 120.744 0.307 . . . . 72.23 111.147 -178.509 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 72.5 m80 -108.96 159.21 17.0 Favored 'General case' 0 N--CA 1.468 0.431 0 CA-C-O 121.252 0.548 . . . . 73.41 111.816 179.199 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 20.6 t-80 -147.91 113.27 5.59 Favored 'General case' 0 CA--C 1.537 0.478 0 CA-C-N 115.78 -0.646 . . . . 64.44 110.437 176.931 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 8' ' ' HIS . . . . . . . . . . . . . 61.9 t60 -105.59 108.04 19.35 Favored 'General case' 0 CA--C 1.54 0.564 0 CA-C-N 116.116 -0.493 . . . . 71.1 111.559 -174.695 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 75.7 m -106.73 101.42 10.87 Favored 'General case' 0 N--CA 1.471 0.605 0 CA-C-O 120.832 0.349 . . . . 73.02 111.288 178.01 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 51.4 t-80 -75.22 94.83 3.03 Favored 'General case' 0 CA--C 1.538 0.492 0 CA-C-O 121.067 0.46 . . . . 73.35 110.656 178.493 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 11' ' ' MET . . . . . . . . . . . . . 11.0 ptt? -99.24 157.95 16.03 Favored 'General case' 0 N--CA 1.467 0.42 0 CA-C-N 116.119 -0.491 . . . . 74.25 111.371 -179.694 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 34.8 m -89.22 172.75 8.83 Favored 'General case' 0 N--CA 1.471 0.599 0 CA-C-O 121.575 0.702 . . . . 71.23 112.824 -172.026 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 13' ' ' THR . . . . . . . . . . . . . 67.4 p -118.23 118.04 34.47 Favored Pre-proline 0 N--CA 1.47 0.568 0 CA-C-N 115.539 -0.755 . . . . 75.44 110.987 179.865 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 14' ' ' PRO . . . . . . . . . . . . . 62.1 Cg_endo -72.98 122.59 8.24 Favored 'Trans proline' 0 CA--C 1.54 0.805 0 C-N-CA 122.219 1.946 . . . . 75.25 112.873 178.496 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 15' ' ' LEU . . . . . 0.454 ' O ' HD12 ' A' ' 15' ' ' LEU . 3.0 pp -66.88 150.24 49.46 Favored 'General case' 0 CA--C 1.541 0.599 0 CA-C-O 121.16 0.505 . . . . 71.04 111.403 178.741 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 16' ' ' THR . . . . . . . . . . . . . 59.1 m -116.14 110.21 18.53 Favored 'General case' 0 N--CA 1.468 0.428 0 CA-C-O 121.16 0.505 . . . . 71.51 112.066 -176.362 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . -81.91 171.47 52.36 Favored Glycine 0 CA--C 1.526 0.762 0 CA-C-N 115.9 -0.591 . . . . 53.52 112.421 175.452 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 57.4 pttt -86.3 120.95 72.59 Favored Pre-proline 0 CA--C 1.54 0.56 0 CA-C-O 121.011 0.434 . . . . 74.22 111.899 -179.372 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 52.3 Cg_endo -96.4 27.53 0.22 Allowed 'Trans proline' 0 CA--C 1.541 0.851 0 C-N-CA 123.314 2.676 . . . . 73.42 112.913 176.294 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . -78.4 56.87 4.11 Favored Glycine 0 CA--C 1.531 1.042 0 N-CA-C 114.01 0.364 . . . . 63.55 114.01 -175.475 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -178.27 126.35 0.12 Allowed 'General case' 0 N--CA 1.472 0.645 0 C-N-CA 122.823 0.449 . . . . 74.13 111.011 177.184 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 22' ' ' LEU . . . . . 0.426 ' HA ' ' HD3' ' A' ' 23' ' ' PRO . 99.4 mt -92.86 140.61 23.62 Favored Pre-proline 0 CA--C 1.536 0.436 0 N-CA-C 111.943 0.349 . . . . 65.23 111.943 -178.49 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 23' ' ' PRO . . . . . 0.54 ' O ' ' HG ' ' A' ' 26' ' ' LEU . 11.4 Cg_exo -73.69 152.34 47.69 Favored 'Trans proline' 0 CA--C 1.543 0.937 0 C-N-CA 122.985 2.456 . . . . 72.21 112.681 173.685 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -73.81 -19.44 60.75 Favored 'General case' 0 N--CA 1.471 0.619 0 CA-C-O 121.279 0.562 . . . . 72.54 111.088 175.567 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 83.9 m-20 -84.41 24.12 1.02 Allowed 'General case' 0 CA--C 1.541 0.625 0 N-CA-C 112.986 0.736 . . . . 72.15 112.986 -179.486 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 26' ' ' LEU . . . . . 0.54 ' HG ' ' O ' ' A' ' 23' ' ' PRO . 67.2 mt -52.88 -37.4 60.44 Favored 'General case' 0 N--CA 1.479 1.018 0 CA-C-N 118.327 0.512 . . . . 52.41 111.615 179.221 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 4.3 m-20 -68.55 -36.31 78.62 Favored 'General case' 0 CA--C 1.544 0.722 0 CA-C-O 121.278 0.561 . . . . 74.44 111.544 177.707 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 9.1 m-20 -76.32 -37.47 57.35 Favored 'General case' 0 CA--C 1.538 0.509 0 CA-C-N 116.165 -0.471 . . . . 75.23 111.681 179.202 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 29' ' ' MET . . . . . . . . . . . . . 81.4 mtp -59.68 141.78 54.38 Favored 'General case' 0 N--CA 1.466 0.373 0 CA-C-N 115.871 -0.604 . . . . 72.41 112.546 -175.07 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 30' ' ' LYS . . . . . 0.566 ' HB2' ' HG2' ' A' ' 33' ' ' GLU . 48.3 mtmt -68.94 149.38 48.91 Favored 'General case' 0 CA--C 1.539 0.52 0 CA-C-N 115.545 -0.752 . . . . 71.0 111.992 -179.725 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 90.0 t -48.24 -44.47 12.67 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.724 0 CA-C-N 115.868 -0.606 . . . . 62.25 112.194 -179.797 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -61.25 -39.67 91.21 Favored 'General case' 0 N--CA 1.469 0.523 0 N-CA-C 112.12 0.415 . . . . 41.42 112.12 179.252 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 33' ' ' GLU . . . . . 0.566 ' HG2' ' HB2' ' A' ' 30' ' ' LYS . 16.3 mm-40 -68.23 -37.32 80.7 Favored 'General case' 0 N--CA 1.467 0.424 0 CA-C-O 120.971 0.415 . . . . 74.43 111.23 -178.779 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 83.2 mt -61.49 -45.99 91.88 Favored 'General case' 0 CA--C 1.538 0.481 0 CA-C-O 121.23 0.538 . . . . 75.43 110.5 175.56 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 35' ' ' LYS . . . . . 0.469 ' HA ' HD12 ' A' ' 38' ' ' LEU . 96.6 mttt -64.82 -29.13 70.08 Favored 'General case' 0 CA--C 1.539 0.532 0 CA-C-N 116.293 -0.412 . . . . 71.3 111.398 176.684 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 36' ' ' GLN . . . . . 0.505 ' HA ' ' HE3' ' A' ' 39' ' ' LYS . 55.9 tp60 -61.95 -37.39 84.55 Favored 'General case' 0 CA--C 1.539 0.552 0 CA-C-N 116.334 -0.394 . . . . 62.22 111.297 178.256 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 36.6 mt-10 -81.49 -30.2 33.38 Favored 'General case' 0 CA--C 1.539 0.531 0 O-C-N 122.166 -0.334 . . . . 72.13 111.698 176.06 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 38' ' ' LEU . . . . . 0.469 HD12 ' HA ' ' A' ' 35' ' ' LYS . 89.2 mt -58.71 -54.35 48.05 Favored 'General case' 0 N--CA 1.472 0.655 0 CA-C-O 120.741 0.305 . . . . 53.21 111.377 174.94 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 39' ' ' LYS . . . . . 0.505 ' HE3' ' HA ' ' A' ' 36' ' ' GLN . 17.5 ptpt -55.36 -37.13 67.12 Favored 'General case' 0 CA--C 1.543 0.687 0 CA-C-N 116.463 -0.335 . . . . 54.22 111.553 -179.781 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 40' ' ' LEU . . . . . 0.43 ' HG ' ' O ' ' A' ' 36' ' ' GLN . 94.2 mt -69.03 -29.39 67.54 Favored 'General case' 0 CA--C 1.538 0.49 0 N-CA-C 112.002 0.371 . . . . 65.51 112.002 -179.086 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 41' ' ' ARG . . . . . 0.61 HH21 HD23 ' A' ' 56' ' ' LEU . 61.5 mtm180 -105.92 22.82 14.98 Favored 'General case' 0 CA--C 1.542 0.659 0 N-CA-C 112.118 0.414 . . . . 71.44 112.118 -177.78 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 31.1 t 62.69 28.96 16.79 Favored 'General case' 0 N--CA 1.482 1.156 0 CA-C-O 121.33 0.586 . . . . 60.02 112.046 176.133 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 65.3 mt -100.6 148.63 35.24 Favored Pre-proline 0 CA--C 1.543 0.692 0 CA-C-N 116.056 -0.52 . . . . 74.4 111.182 179.125 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 44' ' ' PRO . . . . . . . . . . . . . 56.8 Cg_endo -69.36 130.27 19.53 Favored 'Trans proline' 0 CA--C 1.541 0.852 0 C-N-CA 122.364 2.043 . . . . 55.33 113.094 179.644 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 34.8 m -76.06 -21.77 15.63 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.533 0 CA-C-N 116.153 -0.476 . . . . 52.51 111.618 179.339 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 31.5 t -62.22 101.57 0.23 Allowed 'General case' 0 N--CA 1.473 0.721 0 CA-C-N 116.36 -0.382 . . . . 72.1 111.902 178.501 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 176.89 154.03 11.47 Favored Glycine 0 CA--C 1.532 1.119 0 C-N-CA 120.854 -0.689 . . . . 55.43 114.063 177.516 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 48' ' ' THR . . . . . 0.575 ' O ' ' HG ' ' A' ' 52' ' ' LEU . 44.0 p -76.82 174.06 10.96 Favored 'General case' 0 N--CA 1.476 0.871 0 O-C-N 122.633 -0.333 . . . . 72.13 110.87 174.133 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 49' ' ' LYS . . . . . 0.407 ' HE2' HD11 ' A' ' 53' ' ' ILE . 24.5 tptm -49.85 -49.59 48.64 Favored 'General case' 0 N--CA 1.474 0.745 0 CA-C-O 120.84 0.353 . . . . 75.35 111.357 -179.566 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 50' ' ' THR . . . . . . . . . . . . . 82.7 m -58.27 -50.33 73.98 Favored 'General case' 0 N--CA 1.475 0.783 0 CA-C-O 120.954 0.407 . . . . 70.41 111.317 176.832 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 15.6 mm-40 -54.1 -46.76 72.19 Favored 'General case' 0 N--CA 1.469 0.484 0 CA-C-N 115.846 -0.615 . . . . 64.3 111.803 -179.71 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 52' ' ' LEU . . . . . 0.575 ' HG ' ' O ' ' A' ' 48' ' ' THR . 50.9 mt -63.03 -48.63 77.93 Favored 'General case' 0 CA--C 1.537 0.476 0 CA-C-N 116.304 -0.407 . . . . 73.32 111.309 -178.167 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 53' ' ' ILE . . . . . 0.407 HD11 ' HE2' ' A' ' 49' ' ' LYS . 74.3 mt -59.13 -48.07 88.03 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.568 0 N-CA-C 111.998 0.37 . . . . 61.0 111.998 -179.609 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 54' ' ' GLU . . . . . 0.754 ' HG2' HH21 ' A' ' 57' ' ' ARG . 27.2 mt-10 -68.87 -38.4 79.67 Favored 'General case' 0 CA--C 1.537 0.455 0 O-C-N 122.243 -0.286 . . . . 75.44 111.341 179.49 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 39.7 ttm180 -62.41 -43.83 97.89 Favored 'General case' 0 CA--C 1.539 0.554 0 CA-C-O 120.98 0.419 . . . . 73.33 111.14 177.591 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 56' ' ' LEU . . . . . 0.61 HD23 HH21 ' A' ' 41' ' ' ARG . 48.7 mt -58.76 -51.55 69.51 Favored 'General case' 0 C--O 1.237 0.415 0 CA-C-N 116.206 -0.452 . . . . 75.41 111.057 174.029 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 57' ' ' ARG . . . . . 0.754 HH21 ' HG2' ' A' ' 54' ' ' GLU . 79.0 mtm180 -60.62 -47.59 85.56 Favored 'General case' 0 CA--C 1.538 0.513 0 N-CA-C 112.205 0.446 . . . . 75.31 112.205 -178.761 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -55.12 -51.3 66.88 Favored 'General case' 0 N--CA 1.472 0.646 0 CA-C-O 120.863 0.363 . . . . 63.33 111.936 -178.348 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 59' ' ' TYR . . . . . . . . . . . . . 76.9 t80 -57.56 -41.34 80.84 Favored 'General case' 0 CA--C 1.54 0.596 0 CA-C-O 121.183 0.516 . . . . 61.34 111.59 179.222 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 60' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -74.61 -30.57 61.72 Favored 'General case' 0 N--CA 1.472 0.635 0 CA-C-O 121.381 0.61 . . . . 64.14 110.573 178.857 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 61' ' ' ASP . . . . . . . . . . . . . 8.0 t70 -64.62 -37.16 86.61 Favored 'General case' 0 CA--C 1.541 0.625 0 CA-C-N 115.891 -0.595 . . . . 53.54 111.491 -176.338 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 62' ' ' GLN . . . . . . . . . . . . . 51.5 mt-30 -63.52 -33.97 76.76 Favored 'General case' 0 CA--C 1.541 0.604 0 N-CA-C 112.129 0.418 . . . . 55.23 112.129 178.872 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 63' ' ' ILE . . . . . . . . . . . . . 28.9 pt -103.4 9.88 8.88 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.76 0 N-CA-C 112.524 0.565 . . . . 64.12 112.524 -176.424 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 30.0 t -128.41 130.11 23.55 Favored Pre-proline 0 N--CA 1.475 0.815 0 C-N-CA 122.511 0.324 . . . . 75.43 110.994 -179.886 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 65' ' ' PRO . . . . . . . . . . . . . 10.8 Cg_endo -53.25 114.34 1.7 Allowed 'Trans proline' 0 CA--C 1.541 0.869 0 C-N-CA 122.777 2.318 . . . . 41.51 113.24 -177.482 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 66' ' ' VAL . . . . . . . . . . . . . 35.3 m -88.98 138.62 29.12 Favored Pre-proline 0 CA--C 1.542 0.667 0 N-CA-C 112.584 0.587 . . . . 73.3 112.584 -174.528 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 67' ' ' PRO . . . . . . . . . . . . . 95.7 Cg_endo -87.68 104.1 0.54 Allowed 'Trans proline' 0 CA--C 1.545 1.036 0 C-N-CA 122.979 2.452 . . . . 65.22 112.859 177.026 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 79.87 -69.44 3.06 Favored Glycine 0 CA--C 1.53 1.009 0 C-N-CA 121.225 -0.512 . . . . 60.54 113.233 -179.762 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . 68.2 153.92 0.14 Allowed Pre-proline 0 N--CA 1.478 0.939 0 C-N-CA 123.369 0.668 . . . . 55.11 112.797 178.061 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 70' ' ' PRO . . . . . . . . . . . . . 67.7 Cg_endo -72.63 158.22 51.08 Favored 'Trans proline' 0 CA--C 1.54 0.795 0 C-N-CA 122.439 2.093 . . . . 64.44 112.894 177.327 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 85.0 tttt -98.63 107.52 19.99 Favored 'General case' 0 N--CA 1.467 0.418 0 CA-C-O 120.801 0.334 . . . . 72.11 111.212 -179.055 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -150.13 102.18 3.17 Favored Pre-proline 0 CA--C 1.537 0.46 0 CA-C-O 120.614 0.245 . . . . 71.44 111.58 -179.214 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 73' ' ' PRO . . . . . . . . . . . . . 59.0 Cg_endo -71.35 148.62 55.3 Favored 'Trans proline' 0 CA--C 1.539 0.751 0 C-N-CA 122.467 2.112 . . . . 71.4 112.548 177.859 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -92.53 165.32 13.07 Favored 'General case' 0 CA--C 1.538 0.483 0 CA-C-O 120.919 0.39 . . . . 64.23 111.558 178.698 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.253 1.277 0 CA-C-O 118.667 -0.682 . . . . 63.32 111.507 179.166 . . . . . . . . 0 0 . 1 . 016 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 65.0 mtt . . . . . 0 N--CA 1.494 1.729 0 CA-C-O 120.704 0.288 . . . . 75.13 111.335 . . . . . . . . . 0 0 . 1 . 016 nuclear build full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . 131.8 73.97 0.11 Allowed Glycine 0 CA--C 1.524 0.645 0 C-N-CA 121.097 -0.573 . . . . 62.55 113.053 -179.526 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 3' ' ' HIS . . . . . . . . . . . . . 99.5 m-70 -134.78 150.37 50.53 Favored 'General case' 0 N--CA 1.469 0.511 0 CA-C-O 121.017 0.437 . . . . 74.4 111.441 178.249 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 4' ' ' HIS . . . . . . . . . . . . . 58.3 m-70 -111.12 147.55 34.64 Favored 'General case' 0 N--CA 1.47 0.528 0 CA-C-N 116.287 -0.415 . . . . 72.35 110.962 177.211 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 5' ' ' HIS . . . . . . . . . . . . . 36.4 m80 -74.22 104.41 4.99 Favored 'General case' 0 N--CA 1.467 0.383 0 CA-C-O 121.415 0.626 . . . . 72.31 111.933 179.684 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 50.5 m80 -69.38 81.62 0.38 Allowed 'General case' 0 CA--C 1.538 0.484 0 CA-C-N 115.487 -0.779 . . . . 74.44 111.476 -179.665 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 13.0 p-80 -58.69 135.03 57.31 Favored 'General case' 0 CA--C 1.539 0.554 0 CA-C-N 116.148 -0.478 . . . . 65.34 111.526 176.799 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 8' ' ' HIS . . . . . . . . . . . . . 83.2 t60 -154.89 133.55 12.05 Favored 'General case' 0 CA--C 1.536 0.412 0 CA-C-N 116.408 -0.36 . . . . 75.32 111.418 -178.809 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 36.0 t -126.14 136.75 53.24 Favored 'General case' 0 N--CA 1.471 0.624 0 CA-C-N 116.406 -0.361 . . . . 53.44 110.802 178.262 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 8.1 p80 -68.57 94.85 0.6 Allowed 'General case' 0 CA--C 1.543 0.676 0 CA-C-O 121.583 0.706 . . . . 73.43 110.807 178.721 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 11' ' ' MET . . . . . . . . . . . . . 28.0 ttt -115.6 109.44 17.77 Favored 'General case' 0 CA--C 1.538 0.485 0 CA-C-N 116.121 -0.491 . . . . 65.41 111.905 -176.695 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 75.4 m -114.2 167.83 10.35 Favored 'General case' 0 N--CA 1.47 0.565 0 CA-C-N 116.094 -0.503 . . . . 72.5 110.669 174.1 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 13' ' ' THR . . . . . . . . . . . . . 68.8 p -100.01 135.94 20.28 Favored Pre-proline 0 N--CA 1.468 0.461 0 CA-C-N 116.641 -0.254 . . . . 64.1 110.722 176.977 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 14' ' ' PRO . . . . . . . . . . . . . 38.4 Cg_endo -66.06 124.09 12.15 Favored 'Trans proline' 0 CA--C 1.539 0.736 0 C-N-CA 122.436 2.09 . . . . 45.45 112.825 179.433 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 1.9 pp -70.69 158.31 36.48 Favored 'General case' 0 CA--C 1.541 0.623 0 CA-C-O 121.103 0.478 . . . . 71.24 111.953 178.064 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 16' ' ' THR . . . . . . . . . . . . . 48.8 m -84.85 -54.87 4.39 Favored 'General case' 0 N--CA 1.473 0.719 0 CA-C-O 120.99 0.424 . . . . 62.32 112.102 -176.975 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . 80.72 -149.94 30.59 Favored Glycine 0 CA--C 1.53 0.972 0 C-N-CA 121.129 -0.558 . . . . 64.12 112.357 -174.835 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 37.4 mtmm -112.23 100.32 49.13 Favored Pre-proline 0 CA--C 1.54 0.56 0 O-C-N 122.382 -0.481 . . . . 75.23 111.552 178.704 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 1.3 Cg_endo -85.66 -160.17 0.11 Allowed 'Trans proline' 0 CA--C 1.536 0.59 0 C-N-CA 122.902 2.401 . . . . 74.14 112.066 174.246 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . 168.71 -102.59 0.19 Allowed Glycine 0 CA--C 1.523 0.574 0 C-N-CA 120.5 -0.857 . . . . 53.01 113.045 176.658 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -97.59 179.75 4.74 Favored 'General case' 0 CA--C 1.538 0.507 0 CA-C-O 121.248 0.547 . . . . 71.42 111.903 -177.005 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 22' ' ' LEU . . . . . 0.449 HD13 ' HB3' ' A' ' 56' ' ' LEU . 94.3 mt -127.0 137.67 31.09 Favored Pre-proline 0 CA--C 1.538 0.501 0 CA-C-N 116.195 -0.457 . . . . 71.44 110.61 178.983 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 23' ' ' PRO . . . . . 0.468 ' O ' ' HG ' ' A' ' 26' ' ' LEU . 37.8 Cg_endo -64.92 139.22 60.96 Favored 'Trans proline' 0 CA--C 1.54 0.805 0 C-N-CA 122.605 2.204 . . . . 64.11 113.134 -178.386 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -72.15 -2.83 20.12 Favored 'General case' 0 CA--C 1.543 0.694 0 CA-C-O 121.04 0.448 . . . . 71.51 111.874 179.124 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 11.2 m120 -82.54 18.73 1.42 Allowed 'General case' 0 CA--C 1.542 0.658 0 N-CA-C 112.183 0.438 . . . . 73.13 112.183 -178.768 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 26' ' ' LEU . . . . . 0.468 ' HG ' ' O ' ' A' ' 23' ' ' PRO . 90.7 mt -58.18 -40.12 80.67 Favored 'General case' 0 N--CA 1.471 0.612 0 CA-C-O 120.842 0.353 . . . . 70.11 111.84 -178.632 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 7.3 m-20 -63.28 -34.81 78.49 Favored 'General case' 0 CA--C 1.539 0.534 0 CA-C-O 120.978 0.418 . . . . 71.15 111.206 175.283 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 36.6 t70 -72.45 -42.55 64.89 Favored 'General case' 0 CA--C 1.542 0.66 0 CA-C-N 116.255 -0.43 . . . . 74.52 111.533 -178.649 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 29' ' ' MET . . . . . . . . . . . . . 50.2 mtm -68.92 159.81 31.95 Favored 'General case' 0 N--CA 1.471 0.606 0 CA-C-O 121.092 0.472 . . . . 71.23 111.608 179.279 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 54.5 mtpt -88.9 171.43 9.91 Favored 'General case' 0 CA--C 1.54 0.583 0 N-CA-C 112.689 0.626 . . . . 73.25 112.689 -173.623 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 31' ' ' VAL . . . . . 0.474 HG22 ' HD3' ' A' ' 49' ' ' LYS . 86.5 t -56.66 -47.89 81.59 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.615 0 CA-C-N 115.798 -0.637 . . . . 41.11 112.372 -176.74 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -58.67 -38.52 78.37 Favored 'General case' 0 CA--C 1.536 0.426 0 CA-C-N 116.448 -0.342 . . . . 53.25 111.871 -179.353 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 37.4 mt-10 -69.73 -41.86 74.73 Favored 'General case' 0 CA--C 1.537 0.469 0 CA-C-O 121.114 0.483 . . . . 73.44 111.192 179.42 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 95.4 mt -63.34 -47.21 83.11 Favored 'General case' 0 CA--C 1.54 0.559 0 CA-C-N 116.346 -0.388 . . . . 52.43 111.305 178.171 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 35' ' ' LYS . . . . . 0.473 ' HE2' ' O ' ' A' ' 45' ' ' VAL . 98.5 mttt -61.31 -35.66 77.98 Favored 'General case' 0 CA--C 1.537 0.464 0 CA-C-N 116.577 -0.283 . . . . 72.01 111.513 177.598 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 36' ' ' GLN . . . . . 0.499 ' NE2' HD11 ' A' ' 40' ' ' LEU . 22.4 tm0? -60.59 -44.52 96.16 Favored 'General case' 0 CA--C 1.539 0.536 0 CA-C-O 120.868 0.366 . . . . 72.13 110.771 177.38 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 37' ' ' GLU . . . . . 0.594 ' HB3' ' NH2' ' A' ' 41' ' ' ARG . 24.8 mm-40 -64.31 -41.03 97.03 Favored 'General case' 0 CA--C 1.543 0.698 0 CA-C-N 116.329 -0.396 . . . . 74.23 111.884 175.04 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 38' ' ' LEU . . . . . 0.482 ' HB2' HG12 ' A' ' 45' ' ' VAL . 88.5 mt -62.24 -56.01 22.81 Favored 'General case' 0 N--CA 1.472 0.628 0 N-CA-C 112.164 0.431 . . . . 70.34 112.164 179.552 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 18.6 ptpt -57.03 -34.75 68.52 Favored 'General case' 0 N--CA 1.473 0.683 0 N-CA-C 112.582 0.586 . . . . 75.11 112.582 -174.475 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 40' ' ' LEU . . . . . 0.499 HD11 ' NE2' ' A' ' 36' ' ' GLN . 92.7 mt -63.55 -33.5 75.72 Favored 'General case' 0 N--CA 1.473 0.679 0 CA-C-O 120.904 0.383 . . . . 70.53 111.694 177.91 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 41' ' ' ARG . . . . . 0.764 HH21 HD22 ' A' ' 56' ' ' LEU . 70.0 mtm-85 -105.69 23.11 14.4 Favored 'General case' 0 CA--C 1.54 0.565 0 CA-C-N 116.44 -0.346 . . . . 71.42 111.923 -178.013 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 23.2 t 64.48 22.81 12.79 Favored 'General case' 0 N--CA 1.478 0.959 0 N-CA-C 112.317 0.488 . . . . 64.22 112.317 173.134 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 72.5 mt -92.12 134.39 28.65 Favored Pre-proline 0 CA--C 1.546 0.805 0 CA-C-N 116.626 -0.261 . . . . 62.21 111.611 -178.482 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 44' ' ' PRO . . . . . 0.513 ' HD2' ' HD3' ' A' ' 55' ' ' ARG . 77.8 Cg_exo -52.06 115.37 2.12 Favored 'Trans proline' 0 C--N 1.356 0.949 0 C-N-CA 122.994 2.463 . . . . 53.31 113.71 178.638 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 45' ' ' VAL . . . . . 0.482 HG12 ' HB2' ' A' ' 38' ' ' LEU . 33.0 m -85.5 -10.77 11.4 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.608 0 N-CA-C 112.523 0.564 . . . . 71.45 112.523 -178.955 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 33.2 t -80.9 32.3 0.32 Allowed 'General case' 0 N--CA 1.481 1.1 0 N-CA-C 113.064 0.764 . . . . 70.03 113.064 -173.424 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . -107.8 176.45 20.67 Favored Glycine 0 CA--C 1.527 0.833 0 C-N-CA 121.028 -0.606 . . . . 72.24 113.471 179.459 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 48' ' ' THR . . . . . 0.556 ' O ' ' HG ' ' A' ' 52' ' ' LEU . 72.3 p -76.31 163.14 27.3 Favored 'General case' 0 N--CA 1.475 0.812 0 O-C-N 122.668 -0.313 . . . . 72.44 111.372 176.829 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 49' ' ' LYS . . . . . 0.474 ' HD3' HG22 ' A' ' 31' ' ' VAL . 29.6 tptp -44.37 -44.24 8.14 Favored 'General case' 0 N--CA 1.473 0.721 0 CA-C-O 120.962 0.41 . . . . 63.24 111.795 178.169 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 50' ' ' THR . . . . . . . . . . . . . 30.5 m -68.2 -44.79 75.06 Favored 'General case' 0 CA--C 1.538 0.504 0 CA-C-N 116.213 -0.449 . . . . 65.32 111.675 179.037 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 44.0 mt-10 -60.7 -42.47 97.24 Favored 'General case' 0 N--CA 1.471 0.611 0 N-CA-C 111.952 0.352 . . . . 71.2 111.952 179.446 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 52' ' ' LEU . . . . . 0.556 ' HG ' ' O ' ' A' ' 48' ' ' THR . 46.7 mt -54.81 -39.2 68.26 Favored 'General case' 0 N--CA 1.469 0.523 0 CA-C-O 121.504 0.669 . . . . 75.12 110.325 178.457 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 53' ' ' ILE . . . . . . . . . . . . . 88.5 mt -70.25 -58.09 6.34 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.517 0 CA-C-N 115.184 -0.916 . . . . 70.44 111.911 179.287 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 40.6 mt-10 -61.29 -31.7 71.53 Favored 'General case' 0 N--CA 1.468 0.469 0 N-CA-C 111.897 0.332 . . . . 53.34 111.897 -178.019 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 55' ' ' ARG . . . . . 0.513 ' HD3' ' HD2' ' A' ' 44' ' ' PRO . 35.2 ttm180 -65.53 -41.22 93.3 Favored 'General case' 0 CA--C 1.538 0.486 0 CA-C-O 120.76 0.314 . . . . 65.41 111.258 177.187 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 56' ' ' LEU . . . . . 0.764 HD22 HH21 ' A' ' 41' ' ' ARG . 79.6 mt -63.72 -47.7 80.07 Favored 'General case' 0 CA--C 1.537 0.46 0 CA-C-O 121.023 0.44 . . . . 52.01 111.043 174.015 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 74.6 mtp180 -61.67 -43.12 99.45 Favored 'General case' 0 CA--C 1.54 0.583 0 CA-C-N 116.098 -0.501 . . . . 72.12 111.466 179.328 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -64.8 -39.51 93.71 Favored 'General case' 0 N--CA 1.469 0.507 0 CA-C-N 116.419 -0.355 . . . . 33.01 111.673 179.456 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 59' ' ' TYR . . . . . . . . . . . . . 84.8 t80 -64.56 -47.29 79.28 Favored 'General case' 0 CA--C 1.537 0.468 0 CA-C-O 120.977 0.418 . . . . 71.32 110.677 176.371 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 60' ' ' GLN . . . . . . . . . . . . . 8.4 tp-100 -60.15 -41.35 92.56 Favored 'General case' 0 CA--C 1.54 0.564 0 CA-C-O 121.092 0.472 . . . . 73.41 110.914 176.664 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 61' ' ' ASP . . . . . . . . . . . . . 26.9 t70 -59.86 -49.4 77.87 Favored 'General case' 0 CA--C 1.543 0.704 0 CA-C-N 115.895 -0.593 . . . . 65.44 111.959 179.863 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 62' ' ' GLN . . . . . . . . . . . . . 10.8 pt20 -70.82 -25.82 63.02 Favored 'General case' 0 CA--C 1.542 0.64 0 N-CA-C 112.681 0.623 . . . . 65.2 112.681 -176.573 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 63' ' ' ILE . . . . . . . . . . . . . 32.5 pt -90.26 -18.01 7.76 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.771 0 O-C-N 121.917 -0.489 . . . . 75.51 111.872 179.124 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 64' ' ' SER . . . . . 0.415 ' HA ' ' HD3' ' A' ' 65' ' ' PRO . 38.1 t -90.13 129.13 46.95 Favored Pre-proline 0 N--CA 1.471 0.614 0 CA-C-O 120.546 0.212 . . . . 73.52 111.229 178.842 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 65' ' ' PRO . . . . . 0.415 ' HD3' ' HA ' ' A' ' 64' ' ' SER . 24.6 Cg_exo -63.42 88.08 0.13 Allowed 'Trans proline' 0 CA--C 1.539 0.761 0 C-N-CA 122.4 2.066 . . . . 64.14 112.654 178.652 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 66' ' ' VAL . . . . . . . . . . . . . 27.0 m -116.92 146.64 38.34 Favored Pre-proline 0 CA--C 1.541 0.599 0 CA-C-N 116.513 -0.312 . . . . 72.15 111.585 -179.351 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 67' ' ' PRO . . . . . . . . . . . . . 52.8 Cg_exo -53.51 -48.24 22.99 Favored 'Trans proline' 0 C--N 1.354 0.822 0 C-N-CA 122.617 2.211 . . . . 74.52 112.554 178.512 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . -84.46 35.66 3.0 Favored Glycine 0 CA--C 1.527 0.815 0 C-N-CA 121.379 -0.439 . . . . 71.45 113.467 179.445 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . -58.43 153.24 39.77 Favored Pre-proline 0 CA--C 1.541 0.612 0 O-C-N 122.751 -0.264 . . . . 54.33 111.557 177.669 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 70' ' ' PRO . . . . . . . . . . . . . 19.6 Cg_endo -57.14 151.28 51.93 Favored 'Trans proline' 0 CA--C 1.54 0.79 0 C-N-CA 122.404 2.069 . . . . 71.02 112.74 179.454 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 26.4 ttpp -70.67 -19.82 62.75 Favored 'General case' 0 CA--C 1.541 0.597 0 CA-C-O 121.156 0.503 . . . . 72.35 111.029 178.895 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 72' ' ' ALA . . . . . 0.482 ' HA ' ' HD3' ' A' ' 73' ' ' PRO . . . -71.1 126.91 92.04 Favored Pre-proline 0 CA--C 1.543 0.691 0 CA-C-N 116.229 -0.441 . . . . 63.21 111.378 175.634 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 73' ' ' PRO . . . . . 0.482 ' HD3' ' HA ' ' A' ' 72' ' ' ALA . 15.8 Cg_exo -69.07 174.37 9.01 Favored 'Trans proline' 0 CA--C 1.542 0.904 0 C-N-CA 122.698 2.265 . . . . 55.42 113.395 -179.478 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -61.86 137.77 58.28 Favored 'General case' 0 CA--C 1.538 0.492 0 CA-C-O 120.915 0.388 . . . . 33.4 111.834 178.919 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.255 1.374 0 CA-C-O 118.999 -0.525 . . . . 73.42 111.782 -179.102 . . . . . . . . 0 0 . 1 . 017 nuclear build full ' A' A ' 1' ' ' MET . . . . . 0.461 ' SD ' ' C ' ' A' ' 1' ' ' MET . 0.0 OUTLIER . . . . . 0 N--CA 1.49 1.567 0 CA-C-O 120.983 0.421 . . . . 45.4 111.788 . . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . 103.78 -172.94 21.37 Favored Glycine 0 CA--C 1.527 0.793 0 C-N-CA 121.241 -0.504 . . . . 73.44 113.085 -177.712 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 3' ' ' HIS . . . . . . . . . . . . . 79.6 t60 -154.21 -50.87 0.09 Allowed 'General case' 0 N--CA 1.467 0.379 0 CA-C-O 121.13 0.49 . . . . 73.1 110.726 179.19 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 4' ' ' HIS . . . . . . . . . . . . . 78.2 t60 -146.38 114.9 6.76 Favored 'General case' 0 CA--C 1.538 0.486 0 CA-C-N 116.143 -0.48 . . . . 74.44 110.535 177.417 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 5' ' ' HIS . . . . . . . . . . . . . 42.8 m80 -73.83 100.31 3.43 Favored 'General case' 0 CA--C 1.538 0.481 0 CA-C-O 121.042 0.448 . . . . 73.01 111.684 -175.368 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 83.5 t60 -75.34 103.63 5.57 Favored 'General case' 0 CA--C 1.538 0.513 0 CA-C-O 121.001 0.429 . . . . 71.04 110.409 176.963 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 72.2 m80 -67.66 140.4 56.82 Favored 'General case' 0 CA--C 1.538 0.498 0 CA-C-N 116.237 -0.438 . . . . 73.13 111.901 -176.686 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 8' ' ' HIS . . . . . . . . . . . . . 57.0 m-70 -71.55 93.65 1.23 Allowed 'General case' 0 N--CA 1.471 0.595 0 CA-C-O 121.29 0.566 . . . . 64.43 111.859 -179.566 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 21.1 m -97.94 149.42 22.44 Favored 'General case' 0 N--CA 1.469 0.484 0 CA-C-N 115.869 -0.605 . . . . 73.05 110.919 178.228 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 32.2 p-80 -110.97 143.1 42.17 Favored 'General case' 0 N--CA 1.472 0.654 0 CA-C-O 120.481 0.181 . . . . 71.23 111.231 179.553 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 11' ' ' MET . . . . . . . . . . . . . 21.5 ptp -167.68 170.79 10.69 Favored 'General case' 0 N--CA 1.47 0.575 0 N-CA-C 112.449 0.537 . . . . 73.21 112.449 -177.238 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 94.1 p 54.63 26.58 7.56 Favored 'General case' 0 N--CA 1.478 0.939 0 N-CA-C 113.402 0.89 . . . . 71.3 113.402 176.233 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 13' ' ' THR . . . . . 0.475 ' HA ' ' HD3' ' A' ' 14' ' ' PRO . 80.8 p -73.93 130.01 83.86 Favored Pre-proline 0 N--CA 1.473 0.712 0 O-C-N 122.037 -0.414 . . . . 73.44 111.32 179.186 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 14' ' ' PRO . . . . . 0.475 ' HD3' ' HA ' ' A' ' 13' ' ' THR . 9.2 Cg_exo -73.29 24.4 0.31 Allowed 'Trans proline' 0 CA--C 1.549 1.241 0 C-N-CA 123.472 2.781 . . . . 54.31 114.958 -174.766 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 7.1 mp 59.33 -175.65 0.1 Allowed 'General case' 0 CA--C 1.546 0.825 0 CA-C-O 121.636 0.731 . . . . 74.3 112.928 177.362 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 16' ' ' THR . . . . . . . . . . . . . 44.4 p -127.03 106.93 9.61 Favored 'General case' 0 N--CA 1.472 0.675 0 CA-C-N 115.641 -0.709 . . . . 71.31 110.992 178.322 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . -105.19 -175.22 24.36 Favored Glycine 0 CA--C 1.528 0.874 0 C-N-CA 121.15 -0.548 . . . . 33.24 113.606 -177.214 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 6.2 ptpp? -130.71 153.64 81.61 Favored Pre-proline 0 CA--C 1.542 0.642 0 O-C-N 122.653 -0.322 . . . . 74.4 111.577 179.564 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 90.9 Cg_endo -91.32 127.66 1.13 Allowed 'Trans proline' 0 CA--C 1.543 0.961 0 C-N-CA 122.831 2.354 . . . . 74.1 112.315 170.556 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . -79.33 48.01 3.31 Favored Glycine 0 CA--C 1.53 0.998 0 C-N-CA 121.152 -0.547 . . . . 75.14 113.904 -178.832 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -177.06 173.33 1.84 Allowed 'General case' 0 N--CA 1.469 0.512 0 C-N-CA 122.738 0.415 . . . . 74.43 110.843 -179.376 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 22' ' ' LEU . . . . . 0.489 ' HB3' HD11 ' A' ' 26' ' ' LEU . 59.0 mt -92.16 137.9 24.72 Favored Pre-proline 0 N--CA 1.469 0.486 0 CA-C-O 120.685 0.279 . . . . 73.45 111.714 178.046 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 23' ' ' PRO . . . . . 0.477 ' O ' ' HG ' ' A' ' 26' ' ' LEU . 53.6 Cg_exo -54.74 143.3 70.71 Favored 'Trans proline' 0 CA--C 1.541 0.833 0 C-N-CA 122.68 2.253 . . . . 74.23 112.523 173.899 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -72.02 -23.47 61.4 Favored 'General case' 0 CA--C 1.538 0.51 0 N-CA-C 112.36 0.504 . . . . 63.11 112.36 -177.547 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 25' ' ' ASN . . . . . 0.561 ' HB3' ' HB3' ' A' ' 28' ' ' ASP . 47.8 m-80 -102.13 27.13 6.91 Favored 'General case' 0 CA--C 1.543 0.702 0 N-CA-C 113.063 0.764 . . . . 75.15 113.063 -175.964 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 26' ' ' LEU . . . . . 0.489 HD11 ' HB3' ' A' ' 22' ' ' LEU . 71.5 mt -49.83 -42.37 47.13 Favored 'General case' 0 N--CA 1.479 1.017 0 CA-C-O 120.976 0.417 . . . . 65.12 111.973 177.738 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 3.7 m-20 -66.81 -35.11 79.31 Favored 'General case' 0 CA--C 1.543 0.676 0 CA-C-O 121.13 0.49 . . . . 75.22 111.286 178.402 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 28' ' ' ASP . . . . . 0.561 ' HB3' ' HB3' ' A' ' 25' ' ' ASN . 21.5 t70 -73.07 -31.49 64.42 Favored 'General case' 0 CA--C 1.542 0.649 0 CA-C-N 116.18 -0.464 . . . . 63.43 111.239 -179.732 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 29' ' ' MET . . . . . 0.463 ' HG3' ' O ' ' A' ' 25' ' ' ASN . 86.9 mtp -63.84 156.31 27.85 Favored 'General case' 0 CA--C 1.541 0.604 0 CA-C-O 121.434 0.635 . . . . 52.55 112.288 -177.531 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 30' ' ' LYS . . . . . 0.454 ' HB2' ' HG3' ' A' ' 33' ' ' GLU . 55.3 mtpt -80.82 157.78 25.62 Favored 'General case' 0 CA--C 1.538 0.515 0 CA-C-N 116.012 -0.54 . . . . 74.14 111.836 -178.643 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 31' ' ' VAL . . . . . 0.584 HG22 ' HB2' ' A' ' 49' ' ' LYS . 16.0 t -52.14 -50.77 34.61 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.614 0 CA-C-N 115.961 -0.563 . . . . 74.14 112.188 -176.61 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -64.1 -27.69 69.26 Favored 'General case' 0 CA--C 1.539 0.546 0 N-CA-C 112.435 0.532 . . . . 75.42 112.435 -179.714 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 33' ' ' GLU . . . . . 0.454 ' HG3' ' HB2' ' A' ' 30' ' ' LYS . 40.6 mt-10 -72.92 -42.36 63.6 Favored 'General case' 0 N--CA 1.469 0.51 0 CA-C-O 120.899 0.381 . . . . 74.44 110.809 179.248 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 84.8 mt -59.94 -35.22 74.46 Favored 'General case' 0 N--CA 1.469 0.522 0 CA-C-O 121.308 0.575 . . . . 65.41 110.805 174.898 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 35' ' ' LYS . . . . . 0.499 ' HE3' HG12 ' A' ' 31' ' ' VAL . 99.3 mttt -64.89 -30.14 71.12 Favored 'General case' 0 CA--C 1.537 0.473 0 CA-C-N 115.998 -0.546 . . . . 62.32 111.668 176.262 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 57.2 tp60 -66.73 -44.15 82.32 Favored 'General case' 0 CA--C 1.539 0.545 0 CA-C-O 120.934 0.397 . . . . 72.4 110.402 173.954 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 14.1 mm-40 -54.8 -51.9 64.34 Favored 'General case' 0 N--CA 1.471 0.575 0 CA-C-O 121.425 0.631 . . . . 65.31 110.895 173.887 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 38' ' ' LEU . . . . . 0.452 ' CD1' HD22 ' A' ' 52' ' ' LEU . 90.6 mt -58.74 -53.46 58.08 Favored 'General case' 0 CA--C 1.541 0.628 0 N-CA-C 113.207 0.817 . . . . 61.11 113.207 -176.773 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 18.2 ptpt -59.09 -33.67 71.1 Favored 'General case' 0 N--CA 1.474 0.768 0 N-CA-C 112.511 0.559 . . . . 72.11 112.511 -174.462 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 97.4 mt -67.8 -10.83 56.16 Favored 'General case' 0 N--CA 1.471 0.603 0 CA-C-O 121.072 0.463 . . . . 75.22 111.532 178.264 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 41' ' ' ARG . . . . . . . . . . . . . 33.8 mtt180 -123.1 15.77 9.91 Favored 'General case' 0 CA--C 1.54 0.564 0 CA-C-N 116.182 -0.463 . . . . 75.54 111.121 -177.058 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 69.8 m 60.85 31.56 20.04 Favored 'General case' 0 N--CA 1.476 0.862 0 CA-C-N 116.192 -0.458 . . . . 45.43 111.868 -179.224 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 43' ' ' LEU . . . . . 0.404 ' HB3' HD22 ' A' ' 38' ' ' LEU . 83.7 mt -98.6 137.2 20.61 Favored Pre-proline 0 CA--C 1.543 0.676 0 CA-C-N 116.488 -0.324 . . . . 74.42 111.378 179.443 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 44' ' ' PRO . . . . . . . . . . . . . 32.0 Cg_endo -64.06 130.12 26.42 Favored 'Trans proline' 0 CA--C 1.543 0.971 0 C-N-CA 122.941 2.427 . . . . 72.41 113.122 -178.746 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 45' ' ' VAL . . . . . 0.415 HG12 ' HB2' ' A' ' 38' ' ' LEU . 23.0 m -102.34 15.04 5.69 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.725 0 CA-C-N 115.953 -0.567 . . . . 71.2 112.027 -176.154 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 29.6 t -68.47 -43.12 77.68 Favored 'General case' 0 N--CA 1.474 0.733 0 N-CA-C 113.479 0.918 . . . . 73.51 113.479 -174.053 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . -71.52 179.97 32.41 Favored Glycine 0 CA--C 1.528 0.903 0 N-CA-C 115.393 0.917 . . . . 43.14 115.393 -170.898 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 48' ' ' THR . . . . . 0.575 ' O ' ' HG ' ' A' ' 52' ' ' LEU . 69.4 p -77.05 170.6 16.24 Favored 'General case' 0 N--CA 1.471 0.582 0 C-N-CA 122.86 0.464 . . . . 74.43 111.647 178.365 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 49' ' ' LYS . . . . . 0.584 ' HB2' HG22 ' A' ' 31' ' ' VAL . 88.2 tttt -50.53 -51.82 44.25 Favored 'General case' 0 N--CA 1.47 0.563 0 N-CA-C 112.41 0.522 . . . . 75.43 112.41 -176.794 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 50' ' ' THR . . . . . . . . . . . . . 91.5 m -54.9 -44.77 74.43 Favored 'General case' 0 N--CA 1.471 0.6 0 CA-C-O 120.79 0.329 . . . . 71.13 111.141 178.157 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 49.3 mt-10 -59.38 -42.25 91.25 Favored 'General case' 0 N--CA 1.47 0.554 0 CA-C-O 120.973 0.416 . . . . 63.23 111.319 177.066 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 52' ' ' LEU . . . . . 0.575 ' HG ' ' O ' ' A' ' 48' ' ' THR . 32.9 mt -65.38 -47.04 77.73 Favored 'General case' 0 CA--C 1.539 0.545 0 CA-C-N 116.312 -0.404 . . . . 64.43 111.141 -179.655 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 53' ' ' ILE . . . . . . . . . . . . . 66.9 mt -58.14 -50.46 78.16 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.545 0 CA-C-O 120.84 0.352 . . . . 71.51 111.117 178.235 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 47.3 mt-10 -58.35 -41.81 85.52 Favored 'General case' 0 CA--C 1.536 0.413 0 CA-C-N 116.347 -0.388 . . . . 73.33 111.181 177.702 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 41.7 ttm180 -63.3 -40.19 96.67 Favored 'General case' 0 CA--C 1.543 0.703 0 CA-C-N 116.586 -0.279 . . . . 63.42 111.471 178.592 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 78.9 mt -62.13 -51.27 68.54 Favored 'General case' 0 N--CA 1.47 0.544 0 CA-C-O 121.098 0.475 . . . . 53.33 111.366 175.113 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 55.1 mtt180 -74.4 -18.42 60.66 Favored 'General case' 0 CA--C 1.542 0.639 0 CA-C-N 116.268 -0.424 . . . . 70.24 111.999 -178.267 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -76.03 -42.68 47.12 Favored 'General case' 0 N--CA 1.468 0.464 0 CA-C-O 121.162 0.505 . . . . 74.34 110.333 170.596 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 59' ' ' TYR . . . . . . . . . . . . . 48.6 t80 -62.91 -27.35 69.31 Favored 'General case' 0 CA--C 1.54 0.577 0 CA-C-N 115.932 -0.576 . . . . 70.41 110.452 175.32 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 60' ' ' GLN . . . . . 0.478 ' HB2' HD11 ' A' ' 22' ' ' LEU . 59.6 tp60 -76.45 -40.43 50.53 Favored 'General case' 0 CA--C 1.542 0.635 0 CA-C-N 115.919 -0.582 . . . . 65.52 111.664 177.009 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 61' ' ' ASP . . . . . . . . . . . . . 26.8 t70 -56.44 -26.66 54.38 Favored 'General case' 0 CA--C 1.547 0.837 0 N-CA-C 112.211 0.448 . . . . 63.32 112.211 -176.888 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 62' ' ' GLN . . . . . . . . . . . . . 14.1 pt20 -91.8 -0.3 57.52 Favored 'General case' 0 CA--C 1.546 0.797 0 N-CA-C 112.345 0.498 . . . . 74.22 112.345 -178.791 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 63' ' ' ILE . . . . . . . . . . . . . 32.3 pt -135.92 -0.14 0.97 Allowed 'Isoleucine or valine' 0 N--CA 1.476 0.856 0 N-CA-C 112.352 0.501 . . . . 75.44 112.352 178.631 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 64' ' ' SER . . . . . 0.467 ' HB2' ' HG3' ' A' ' 60' ' ' GLN . 47.8 t -85.49 137.81 36.36 Favored Pre-proline 0 N--CA 1.474 0.744 0 N-CA-C 112.175 0.435 . . . . 74.43 112.175 -175.877 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 65' ' ' PRO . . . . . . . . . . . . . 60.6 Cg_endo -73.73 90.83 0.92 Allowed 'Trans proline' 0 CA--C 1.54 0.79 0 C-N-CA 122.29 1.993 . . . . 61.14 112.071 173.165 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 66' ' ' VAL . . . . . . . . . . . . . 34.3 m -72.03 145.54 88.97 Favored Pre-proline 0 CA--C 1.545 0.753 0 N-CA-C 112.31 0.485 . . . . 73.31 112.31 -177.128 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 67' ' ' PRO . . . . . . . . . . . . . 33.3 Cg_exo -60.33 -57.93 0.63 Allowed 'Trans proline' 0 CA--C 1.541 0.873 0 C-N-CA 122.739 2.292 . . . . 74.35 112.921 174.817 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . -138.32 -41.14 0.1 OUTLIER Glycine 0 CA--C 1.526 0.757 0 C-N-CA 121.117 -0.563 . . . . 70.22 113.594 -178.949 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . 68.23 151.64 0.13 Allowed Pre-proline 0 CA--C 1.544 0.739 0 C-N-CA 122.75 0.42 . . . . 52.42 111.828 -178.055 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 70' ' ' PRO . . . . . 0.472 ' HB2' ' HG3' ' A' ' 73' ' ' PRO . 87.8 Cg_exo -48.43 110.73 0.36 Allowed 'Trans proline' 0 CA--C 1.542 0.923 0 C-N-CA 122.73 2.287 . . . . 74.31 113.625 179.902 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 71' ' ' LYS . . . . . 0.473 ' NZ ' ' HB2' ' A' ' 71' ' ' LYS . 2.7 ttmp? -72.65 105.38 4.24 Favored 'General case' 0 CA--C 1.537 0.46 0 CA-C-N 116.379 -0.373 . . . . 65.11 110.598 177.173 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . 55.9 76.23 0.52 Allowed Pre-proline 0 CA--C 1.543 0.704 0 CA-C-N 116.151 -0.477 . . . . 73.23 111.231 -174.009 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 73' ' ' PRO . . . . . 0.472 ' HG3' ' HB2' ' A' ' 70' ' ' PRO . 51.9 Cg_exo -54.26 80.43 0.03 OUTLIER 'Trans proline' 0 CA--C 1.543 0.931 0 C-N-CA 123.402 2.735 . . . . 64.35 114.272 -172.993 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . 50.76 27.56 3.12 Favored 'General case' 0 CA--C 1.541 0.603 0 C-N-CA 123.22 0.608 . . . . 72.43 112.576 177.349 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.252 1.222 0 CA-C-O 118.922 -0.561 . . . . 52.14 112.276 -178.465 . . . . . . . . 0 0 . 1 . 018 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 44.0 tpp . . . . . 0 N--CA 1.487 1.425 0 CA-C-O 120.919 0.39 . . . . 73.02 111.52 . . . . . . . . . 0 0 . 1 . 018 nuclear build full ' A' A ' 2' ' ' GLY . . . . . 0.463 ' O ' ' N ' ' A' ' 4' ' ' HIS . . . 82.24 56.92 2.74 Favored Glycine 0 CA--C 1.53 1.002 0 C-N-CA 121.069 -0.586 . . . . 60.51 114.448 174.641 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 3' ' ' HIS . . . . . . . . . . . . . 10.3 p80 42.31 -75.59 0.0 OUTLIER 'General case' 0 N--CA 1.487 1.41 0 N-CA-C 115.27 1.581 . . . . 63.45 115.27 172.205 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 4' ' ' HIS . . . . . 0.463 ' N ' ' O ' ' A' ' 2' ' ' GLY . 67.4 t60 -131.86 121.24 23.75 Favored 'General case' 0 N--CA 1.472 0.664 0 O-C-N 121.94 -0.475 . . . . 74.52 111.58 -172.534 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 5' ' ' HIS . . . . . . . . . . . . . 77.5 m-70 -142.06 74.66 1.46 Allowed 'General case' 0 N--CA 1.476 0.838 0 N-CA-C 112.288 0.477 . . . . 64.22 112.288 177.913 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 2.9 p80 177.48 115.42 0.03 OUTLIER 'General case' 0 N--CA 1.476 0.873 0 C-N-CA 123.394 0.677 . . . . 61.33 110.315 173.957 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 7.5 p-80 -109.21 -175.48 2.77 Favored 'General case' 0 N--CA 1.472 0.656 0 CA-C-O 121.09 0.471 . . . . 53.21 112.138 -176.787 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 8' ' ' HIS . . . . . . . . . . . . . 13.9 p80 -137.79 114.51 10.53 Favored 'General case' 0 N--CA 1.471 0.581 0 CA-C-N 116.351 -0.386 . . . . 71.1 111.045 176.745 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 77.4 p -101.56 173.71 6.3 Favored 'General case' 0 N--CA 1.474 0.759 0 CA-C-O 121.114 0.483 . . . . 74.51 111.834 -176.672 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 26.7 p-80 -135.09 92.84 2.92 Favored 'General case' 0 CA--C 1.543 0.676 0 CA-C-O 120.932 0.396 . . . . 73.51 111.732 178.786 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 11' ' ' MET . . . . . . . . . . . . . 62.9 mtt -92.17 140.36 29.7 Favored 'General case' 0 N--CA 1.472 0.674 0 CA-C-N 116.568 -0.287 . . . . 65.33 111.082 177.601 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 40.6 t -90.8 -33.85 15.54 Favored 'General case' 0 N--CA 1.473 0.713 0 N-CA-C 112.021 0.378 . . . . 64.04 112.021 -179.589 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 13' ' ' THR . . . . . . . . . . . . . 13.3 p 62.96 143.74 0.07 OUTLIER Pre-proline 0 N--CA 1.483 1.221 0 C-N-CA 123.992 0.917 . . . . 74.21 112.402 -177.627 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 14' ' ' PRO . . . . . . . . . . . . . 52.4 Cg_exo -55.6 164.02 4.7 Favored 'Trans proline' 0 CA--C 1.544 0.979 0 C-N-CA 122.766 2.311 . . . . 72.42 113.848 -178.928 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 15' ' ' LEU . . . . . 0.449 HD23 ' H ' ' A' ' 15' ' ' LEU . 1.1 pt? -120.88 164.09 17.2 Favored 'General case' 0 CA--C 1.536 0.419 0 CA-C-O 120.909 0.385 . . . . 73.25 111.32 179.596 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 16' ' ' THR . . . . . . . . . . . . . 71.3 p -68.84 113.82 6.62 Favored 'General case' 0 N--CA 1.471 0.619 0 N-CA-C 112.884 0.698 . . . . 70.11 112.884 -174.175 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . -72.88 125.94 10.21 Favored Glycine 0 CA--C 1.525 0.662 0 N-CA-C 111.562 -0.615 . . . . 74.13 111.562 172.136 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 19.2 pttm -160.34 146.83 11.9 Favored Pre-proline 0 CA--C 1.538 0.512 0 N-CA-C 112.092 0.404 . . . . 72.14 112.092 -170.662 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 72.2 Cg_endo -77.38 117.95 4.49 Favored 'Trans proline' 0 CA--C 1.541 0.85 0 C-N-CA 122.347 2.031 . . . . 74.33 111.923 172.007 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . -53.11 -36.42 51.93 Favored Glycine 0 CA--C 1.527 0.841 0 C-N-CA 121.28 -0.486 . . . . 74.32 113.045 -179.821 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -145.05 169.96 17.11 Favored 'General case' 0 CA--C 1.536 0.434 0 CA-C-O 120.778 0.323 . . . . 44.33 110.787 176.389 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 92.1 mt -98.39 152.43 37.94 Favored Pre-proline 0 CA--C 1.541 0.602 0 CA-C-N 116.717 -0.22 . . . . 75.24 110.989 179.3 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 23' ' ' PRO . . . . . . . . . . . . . 19.2 Cg_endo -59.21 142.24 98.96 Favored 'Trans proline' 0 CA--C 1.54 0.82 0 C-N-CA 122.692 2.261 . . . . 70.02 112.931 -179.818 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -75.26 -24.41 57.61 Favored 'General case' 0 N--CA 1.469 0.49 0 CA-C-O 120.861 0.363 . . . . 54.2 111.833 -179.853 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 85.5 m-20 -86.49 36.67 0.71 Allowed 'General case' 0 CA--C 1.544 0.715 0 N-CA-C 112.873 0.694 . . . . 63.13 112.873 -175.705 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 26' ' ' LEU . . . . . 0.539 HD23 ' SD ' ' A' ' 29' ' ' MET . 87.5 mt -55.74 -29.28 59.29 Favored 'General case' 0 N--CA 1.475 0.795 0 CA-C-O 121.111 0.482 . . . . 65.22 110.856 175.433 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 3.6 m-20 -64.47 -35.33 80.58 Favored 'General case' 0 CA--C 1.541 0.627 0 CA-C-N 116.073 -0.512 . . . . 65.05 111.343 176.019 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 31.3 m-20 -81.71 -22.28 37.48 Favored 'General case' 0 CA--C 1.537 0.467 0 CA-C-O 121.062 0.458 . . . . 65.31 111.306 177.452 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 29' ' ' MET . . . . . 0.539 ' SD ' HD23 ' A' ' 26' ' ' LEU . 85.1 mtp -72.47 124.42 25.15 Favored 'General case' 0 CA--C 1.536 0.436 0 CA-C-O 120.958 0.409 . . . . 75.42 110.512 175.104 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 61.1 mtpt -72.42 170.53 14.08 Favored 'General case' 0 CA--C 1.537 0.459 0 CA-C-O 120.988 0.423 . . . . 72.22 111.807 -177.04 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 45.8 t -53.19 -46.76 56.41 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.659 0 CA-C-N 116.039 -0.528 . . . . 72.04 111.8 -175.475 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -61.45 -40.55 94.89 Favored 'General case' 0 N--CA 1.469 0.507 0 N-CA-C 112.064 0.394 . . . . 64.1 112.064 179.441 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 39.7 mt-10 -64.28 -46.39 83.87 Favored 'General case' 0 CA--C 1.537 0.471 0 CA-C-O 120.991 0.424 . . . . 73.15 111.117 179.42 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 92.9 mt -63.81 -49.17 73.93 Favored 'General case' 0 N--CA 1.47 0.53 0 CA-C-N 116.159 -0.473 . . . . 63.31 111.646 178.18 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 35' ' ' LYS . . . . . 0.427 ' HG2' ' HB ' ' A' ' 45' ' ' VAL . 56.1 mtpt -52.83 -45.18 67.18 Favored 'General case' 0 N--CA 1.473 0.678 0 CA-C-O 121.203 0.525 . . . . 71.21 111.149 175.252 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 36' ' ' GLN . . . . . 0.548 ' O ' ' HG ' ' A' ' 40' ' ' LEU . 1.0 OUTLIER -57.75 -49.6 76.02 Favored 'General case' 0 CA--C 1.541 0.632 0 CA-C-N 115.761 -0.654 . . . . 65.35 110.673 177.553 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 37' ' ' GLU . . . . . 0.416 ' HB3' ' NH2' ' A' ' 41' ' ' ARG . 55.8 mm-40 -62.47 -35.14 78.39 Favored 'General case' 0 N--CA 1.471 0.578 0 N-CA-C 112.183 0.438 . . . . 73.05 112.183 178.743 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 38' ' ' LEU . . . . . 0.49 ' HB2' HG12 ' A' ' 45' ' ' VAL . 91.9 mt -66.53 -54.6 21.97 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-O 120.929 0.395 . . . . 63.41 111.591 177.88 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 17.6 ptmt -63.87 -24.2 67.65 Favored 'General case' 0 CA--C 1.541 0.616 0 N-CA-C 112.337 0.495 . . . . 60.14 112.337 -174.229 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 40' ' ' LEU . . . . . 0.548 ' HG ' ' O ' ' A' ' 36' ' ' GLN . 78.6 mt -58.03 -38.52 76.39 Favored 'General case' 0 N--CA 1.472 0.661 0 CA-C-O 121.421 0.629 . . . . 75.11 111.017 172.804 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 41' ' ' ARG . . . . . 0.416 ' NH2' ' HB3' ' A' ' 37' ' ' GLU . 41.6 mtm-85 -108.72 25.27 11.94 Favored 'General case' 0 CA--C 1.539 0.54 0 CA-C-N 115.514 -0.766 . . . . 73.13 111.724 -175.831 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 48.7 m 64.88 15.77 10.1 Favored 'General case' 0 N--CA 1.48 1.045 0 N-CA-C 112.877 0.695 . . . . 53.41 112.877 175.619 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 75.4 mt -79.57 140.52 55.55 Favored Pre-proline 0 CA--C 1.54 0.579 0 C-N-CA 122.029 0.132 . . . . 74.3 111.221 178.998 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 44' ' ' PRO . . . . . 0.458 ' HD2' ' HD3' ' A' ' 55' ' ' ARG . 41.4 Cg_endo -66.0 126.1 15.28 Favored 'Trans proline' 0 CA--C 1.538 0.717 0 C-N-CA 122.227 1.951 . . . . 73.2 112.452 -178.829 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 45' ' ' VAL . . . . . 0.49 HG12 ' HB2' ' A' ' 38' ' ' LEU . 21.5 m -94.04 -8.23 9.92 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.476 0 CA-C-O 121.103 0.478 . . . . 73.11 111.767 -177.352 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 38.6 m -76.7 74.85 3.37 Favored 'General case' 0 N--CA 1.47 0.534 0 CA-C-O 121.119 0.485 . . . . 60.52 111.938 -177.615 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . -166.89 177.2 41.71 Favored Glycine 0 CA--C 1.524 0.62 0 C-N-CA 121.298 -0.477 . . . . 71.54 112.909 176.2 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 48' ' ' THR . . . . . 0.552 ' O ' ' HG ' ' A' ' 52' ' ' LEU . 31.1 p -72.04 159.06 34.83 Favored 'General case' 0 N--CA 1.471 0.614 0 O-C-N 122.535 -0.391 . . . . 73.52 110.957 179.178 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 49' ' ' LYS . . . . . 0.424 ' HE3' ' O ' ' A' ' 29' ' ' MET . 87.4 tttt -48.84 -35.98 15.82 Favored 'General case' 0 N--CA 1.471 0.585 0 CA-C-O 121.174 0.511 . . . . 73.2 110.897 176.481 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 50' ' ' THR . . . . . 0.427 ' O ' ' HG3' ' A' ' 54' ' ' GLU . 10.1 m -58.24 -53.87 53.36 Favored 'General case' 0 N--CA 1.467 0.399 0 CA-C-N 115.726 -0.67 . . . . 64.53 110.979 176.367 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 41.1 mt-10 -58.16 -40.38 81.25 Favored 'General case' 0 N--CA 1.468 0.467 0 CA-C-N 116.076 -0.511 . . . . 64.21 111.66 178.526 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 52' ' ' LEU . . . . . 0.552 ' HG ' ' O ' ' A' ' 48' ' ' THR . 22.4 mt -60.68 -43.49 97.66 Favored 'General case' 0 CA--C 1.542 0.638 0 CA-C-O 121.155 0.502 . . . . 62.31 111.123 -179.843 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 53' ' ' ILE . . . . . . . . . . . . . 78.7 mt -65.5 -52.03 56.25 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.686 0 CA-C-N 116.162 -0.472 . . . . 65.45 111.36 177.065 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 54' ' ' GLU . . . . . 0.427 ' HG3' ' O ' ' A' ' 50' ' ' THR . 45.5 mt-10 -55.88 -42.54 76.09 Favored 'General case' 0 N--CA 1.471 0.622 0 CA-C-O 121.204 0.526 . . . . 65.31 111.068 178.966 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 55' ' ' ARG . . . . . 0.458 ' HD3' ' HD2' ' A' ' 44' ' ' PRO . 30.0 ttm180 -65.22 -43.89 90.02 Favored 'General case' 0 CA--C 1.539 0.55 0 CA-C-N 115.681 -0.69 . . . . 75.42 112.187 -177.171 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 51.1 mt -62.35 -47.28 84.91 Favored 'General case' 0 CA--C 1.54 0.561 0 O-C-N 122.249 -0.282 . . . . 74.23 111.288 175.881 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 98.3 mtt180 -57.92 -51.46 69.52 Favored 'General case' 0 N--CA 1.471 0.577 0 CA-C-O 120.971 0.415 . . . . 72.22 111.139 176.788 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -61.36 -37.87 84.92 Favored 'General case' 0 N--CA 1.47 0.563 0 CA-C-N 116.143 -0.48 . . . . 70.04 112.276 -178.854 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 59' ' ' TYR . . . . . . . . . . . . . 69.7 t80 -68.98 -44.34 73.08 Favored 'General case' 0 CA--C 1.538 0.507 0 CA-C-O 120.765 0.317 . . . . 62.23 111.523 179.069 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 60' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -65.62 -41.92 92.13 Favored 'General case' 0 CA--C 1.542 0.655 0 CA-C-O 121.596 0.712 . . . . 74.11 109.993 177.403 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 61' ' ' ASP . . . . . . . . . . . . . 21.6 t70 -60.16 -29.91 68.97 Favored 'General case' 0 CA--C 1.543 0.684 0 CA-C-N 115.486 -0.779 . . . . 75.34 112.189 -178.762 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 62' ' ' GLN . . . . . . . . . . . . . 10.9 pt20 -93.11 1.66 57.09 Favored 'General case' 0 N--CA 1.473 0.723 0 N-CA-C 112.468 0.544 . . . . 65.45 112.468 -178.33 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 63' ' ' ILE . . . . . . . . . . . . . 33.4 pt -122.73 -3.28 7.51 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.77 0 CA-C-O 121.098 0.475 . . . . 72.53 111.464 174.959 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 39.9 t -115.02 147.92 39.41 Favored Pre-proline 0 N--CA 1.472 0.655 0 CA-C-N 116.23 -0.441 . . . . 73.33 111.12 178.736 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 65' ' ' PRO . . . . . . . . . . . . . 29.1 Cg_endo -61.94 140.64 86.0 Favored 'Trans proline' 0 CA--C 1.539 0.771 0 C-N-CA 122.244 1.962 . . . . 74.01 112.743 177.827 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 66' ' ' VAL . . . . . . . . . . . . . 33.6 m -60.96 155.68 52.51 Favored Pre-proline 0 CA--C 1.544 0.732 0 CA-C-N 116.272 -0.422 . . . . 72.41 112.035 -178.397 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 67' ' ' PRO . . . . . . . . . . . . . 88.8 Cg_exo -49.1 -34.4 29.99 Favored 'Trans proline' 0 CA--C 1.543 0.95 0 C-N-CA 122.946 2.431 . . . . 64.11 113.321 177.669 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . -62.68 -20.55 61.87 Favored Glycine 0 CA--C 1.53 0.991 0 C-N-CA 121.386 -0.435 . . . . 74.31 113.491 178.421 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 69' ' ' ALA . . . . . 0.435 ' HA ' ' HD3' ' A' ' 70' ' ' PRO . . . -87.6 136.87 32.47 Favored Pre-proline 0 CA--C 1.538 0.516 0 O-C-N 122.466 -0.432 . . . . 70.41 110.929 177.232 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 70' ' ' PRO . . . . . 0.435 ' HD3' ' HA ' ' A' ' 69' ' ' ALA . 22.8 Cg_exo -65.05 92.34 0.21 Allowed 'Trans proline' 0 CA--C 1.541 0.86 0 C-N-CA 122.56 2.174 . . . . 72.03 113.282 -179.22 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 71' ' ' LYS . . . . . 0.401 ' HE3' ' N ' ' A' ' 72' ' ' ALA . 0.0 OUTLIER -81.1 111.55 17.65 Favored 'General case' 0 CA--C 1.539 0.528 0 CA-C-O 120.941 0.401 . . . . 74.41 111.132 177.768 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 72' ' ' ALA . . . . . 0.401 ' N ' ' HE3' ' A' ' 71' ' ' LYS . . . -70.72 125.31 91.98 Favored Pre-proline 0 CA--C 1.539 0.549 0 CA-C-N 116.379 -0.373 . . . . 74.33 111.49 178.857 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 73' ' ' PRO . . . . . . . . . . . . . 69.7 Cg_endo -72.17 153.96 56.93 Favored 'Trans proline' 0 CA--C 1.539 0.728 0 C-N-CA 122.621 2.214 . . . . 73.3 113.231 -178.338 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -92.46 112.56 24.55 Favored 'General case' 0 CA--C 1.537 0.474 0 CA-C-N 116.254 -0.43 . . . . 64.24 111.438 178.958 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.252 1.206 0 CA-C-O 118.739 -0.648 . . . . 73.21 111.655 179.559 . . . . . . . . 0 0 . 1 . 019 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 24.6 mmt . . . . . 0 N--CA 1.489 1.496 0 CA-C-O 120.914 0.387 . . . . 62.33 110.592 . . . . . . . . . 0 0 . 1 . 019 nuclear build full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . -154.94 98.16 0.18 Allowed Glycine 0 CA--C 1.524 0.626 0 C-N-CA 121.022 -0.609 . . . . 71.2 113.208 -176.566 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 3' ' ' HIS . . . . . . . . . . . . . 49.2 t-80 -147.21 103.44 3.58 Favored 'General case' 0 CA--C 1.539 0.54 0 CA-C-O 120.752 0.311 . . . . 64.12 110.601 176.369 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 4' ' ' HIS . . . . . . . . . . . . . 92.2 m-70 -133.45 178.83 6.61 Favored 'General case' 0 N--CA 1.471 0.611 0 CA-C-O 121.387 0.613 . . . . 71.34 112.076 -176.658 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 5' ' ' HIS . . . . . . . . . . . . . 61.1 m80 -122.26 137.83 54.7 Favored 'General case' 0 CA--C 1.536 0.43 0 CA-C-N 115.839 -0.618 . . . . 71.45 110.752 178.562 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 83.4 t60 -172.08 136.24 0.85 Allowed 'General case' 0 N--CA 1.471 0.599 0 N-CA-C 111.737 0.273 . . . . 74.25 111.737 -178.398 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 22.9 p-80 -158.0 136.31 10.98 Favored 'General case' 0 N--CA 1.471 0.608 0 N-CA-C 111.967 0.358 . . . . 64.41 111.967 176.128 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 8' ' ' HIS . . . . . . . . . . . . . 60.7 t60 -173.27 115.39 0.25 Allowed 'General case' 0 N--CA 1.47 0.553 0 CA-C-O 120.825 0.345 . . . . 73.33 110.646 173.827 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 40.0 t -161.38 141.08 10.44 Favored 'General case' 0 N--CA 1.469 0.515 0 CA-C-O 121.373 0.606 . . . . 74.33 112.168 179.866 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 53.4 m80 -139.43 87.32 2.18 Favored 'General case' 0 N--CA 1.466 0.373 0 CA-C-N 115.805 -0.634 . . . . 64.41 110.076 173.378 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 11' ' ' MET . . . . . . . . . . . . . 65.8 mtt -81.23 134.15 35.56 Favored 'General case' 0 CA--C 1.536 0.418 0 CA-C-N 116.158 -0.474 . . . . 71.1 111.298 -176.52 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 38.8 t -96.81 160.87 14.12 Favored 'General case' 0 N--CA 1.471 0.606 0 CA-C-O 121.081 0.467 . . . . 74.11 112.046 -175.644 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 13' ' ' THR . . . . . . . . . . . . . 62.2 p -119.87 126.43 26.9 Favored Pre-proline 0 N--CA 1.471 0.588 0 CA-C-N 115.984 -0.553 . . . . 75.54 111.218 178.937 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 14' ' ' PRO . . . . . . . . . . . . . 16.7 Cg_exo -67.82 77.81 0.56 Allowed 'Trans proline' 0 CA--C 1.54 0.794 0 C-N-CA 122.696 2.264 . . . . 70.01 112.759 176.977 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 15' ' ' LEU . . . . . 0.417 ' H ' HD23 ' A' ' 15' ' ' LEU . 2.4 pt? -62.83 131.46 48.88 Favored 'General case' 0 CA--C 1.542 0.636 0 CA-C-N 116.443 -0.344 . . . . 70.14 111.257 177.166 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 16' ' ' THR . . . . . . . . . . . . . 71.5 p -69.32 -68.99 0.36 Allowed 'General case' 0 N--CA 1.469 0.521 0 O-C-N 122.208 -0.308 . . . . 70.5 111.361 -178.157 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . 42.74 51.45 5.74 Favored Glycine 0 CA--C 1.53 1.017 0 N-CA-C 114.268 0.467 . . . . 64.44 114.268 175.352 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 22.9 pttp -93.76 147.76 34.14 Favored Pre-proline 0 CA--C 1.541 0.618 0 CA-C-N 117.081 0.441 . . . . 73.31 111.235 -179.388 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 89.0 Cg_exo -48.18 109.83 0.28 Allowed 'Trans proline' 0 CA--C 1.541 0.84 0 C-N-CA 122.976 2.451 . . . . 64.51 113.597 -179.441 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . -93.53 -5.3 63.38 Favored Glycine 0 CA--C 1.528 0.853 0 C-N-CA 121.264 -0.493 . . . . 64.25 113.398 -177.792 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -162.39 171.26 17.45 Favored 'General case' 0 N--CA 1.469 0.476 0 CA-C-O 120.928 0.394 . . . . 42.31 111.483 178.659 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 22' ' ' LEU . . . . . 0.405 ' HA ' ' HD3' ' A' ' 23' ' ' PRO . 86.9 mt -78.96 135.63 58.71 Favored Pre-proline 0 CA--C 1.536 0.411 0 CA-C-N 116.702 -0.226 . . . . 53.31 110.957 176.579 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 23' ' ' PRO . . . . . 0.592 ' O ' ' HG ' ' A' ' 26' ' ' LEU . 28.0 Cg_exo -62.03 147.19 95.61 Favored 'Trans proline' 0 CA--C 1.537 0.67 0 C-N-CA 122.213 1.942 . . . . 74.24 112.109 176.448 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -67.18 -20.16 65.68 Favored 'General case' 0 CA--C 1.538 0.511 0 CA-C-O 121.166 0.507 . . . . 64.15 111.33 177.563 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 25' ' ' ASN . . . . . 0.45 ' O ' ' HG3' ' A' ' 29' ' ' MET . 8.1 m120 -89.33 23.3 2.57 Favored 'General case' 0 CA--C 1.547 0.85 0 N-CA-C 112.694 0.628 . . . . 71.34 112.694 -174.875 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 26' ' ' LEU . . . . . 0.592 ' HG ' ' O ' ' A' ' 23' ' ' PRO . 67.7 mt -48.04 -56.61 7.31 Favored 'General case' 0 N--CA 1.478 0.952 0 N-CA-C 112.851 0.686 . . . . 74.13 112.851 -177.151 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 8.2 p-10 -77.48 -7.91 56.95 Favored 'General case' 0 CA--C 1.541 0.614 0 N-CA-C 112.294 0.479 . . . . 54.25 112.294 -176.226 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 16.4 m-20 -90.85 -26.87 19.17 Favored 'General case' 0 CA--C 1.542 0.637 0 N-CA-C 111.75 0.278 . . . . 71.32 111.75 177.604 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 29' ' ' MET . . . . . 0.45 ' HG3' ' O ' ' A' ' 25' ' ' ASN . 59.1 mtm -70.65 169.26 14.73 Favored 'General case' 0 N--CA 1.472 0.659 0 CA-C-O 121.366 0.603 . . . . 75.03 112.194 -178.558 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 30' ' ' LYS . . . . . 0.455 ' HB2' ' HG2' ' A' ' 33' ' ' GLU . 52.1 mtpt -76.98 157.66 31.1 Favored 'General case' 0 CA--C 1.536 0.427 0 CA-C-N 115.99 -0.55 . . . . 74.41 111.441 177.118 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 87.9 t -57.58 -40.17 73.59 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.5 0 CA-C-O 121.024 0.44 . . . . 63.44 110.643 175.451 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -59.51 -36.19 75.61 Favored 'General case' 0 CA--C 1.539 0.542 0 CA-C-N 116.135 -0.484 . . . . 75.43 111.775 177.04 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 33' ' ' GLU . . . . . 0.455 ' HG2' ' HB2' ' A' ' 30' ' ' LYS . 16.8 mm-40 -70.72 -40.99 72.47 Favored 'General case' 0 N--CA 1.47 0.536 0 CA-C-O 120.995 0.426 . . . . 63.01 110.73 178.309 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 34' ' ' LEU . . . . . 0.442 HD13 ' HB2' ' A' ' 52' ' ' LEU . 94.9 mt -59.07 -47.19 86.15 Favored 'General case' 0 CA--C 1.538 0.499 0 CA-C-O 121.021 0.439 . . . . 74.44 110.578 174.471 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 35' ' ' LYS . . . . . 0.57 ' HA ' HD12 ' A' ' 38' ' ' LEU . 95.5 mttt -59.72 -33.76 72.04 Favored 'General case' 0 N--CA 1.47 0.545 0 CA-C-N 116.295 -0.411 . . . . 74.13 111.469 176.253 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 36' ' ' GLN . . . . . 0.416 ' O ' ' HG ' ' A' ' 40' ' ' LEU . 22.8 tm0? -60.93 -47.99 83.85 Favored 'General case' 0 CA--C 1.537 0.448 0 CA-C-N 116.385 -0.37 . . . . 73.32 110.936 178.261 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 37' ' ' GLU . . . . . 0.468 ' HB3' ' NH2' ' A' ' 41' ' ' ARG . 29.5 mt-10 -67.86 -39.39 83.78 Favored 'General case' 0 CA--C 1.54 0.576 0 CA-C-O 120.824 0.345 . . . . 71.31 111.904 176.616 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 38' ' ' LEU . . . . . 0.57 HD12 ' HA ' ' A' ' 35' ' ' LYS . 83.9 mt -57.42 -55.42 34.99 Favored 'General case' 0 N--CA 1.471 0.606 0 N-CA-C 111.921 0.341 . . . . 70.42 111.921 179.189 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 17.7 ptpt -57.35 -30.6 64.97 Favored 'General case' 0 CA--C 1.542 0.645 0 N-CA-C 112.251 0.463 . . . . 75.13 112.251 -176.72 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 40' ' ' LEU . . . . . 0.416 ' HG ' ' O ' ' A' ' 36' ' ' GLN . 89.3 mt -68.2 -38.98 82.55 Favored 'General case' 0 N--CA 1.469 0.524 0 CA-C-O 120.926 0.393 . . . . 55.3 111.389 177.29 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 41' ' ' ARG . . . . . 0.685 HH21 HD22 ' A' ' 56' ' ' LEU . 0.0 OUTLIER -100.32 22.2 11.93 Favored 'General case' 0 CA--C 1.543 0.696 0 N-CA-C 112.055 0.391 . . . . 74.34 112.055 -179.211 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 44.1 t 62.32 27.96 16.67 Favored 'General case' 0 N--CA 1.481 1.087 0 N-CA-C 112.462 0.542 . . . . 74.43 112.462 174.619 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 70.6 mt -93.37 143.41 26.64 Favored Pre-proline 0 CA--C 1.543 0.705 0 CA-C-N 116.385 -0.371 . . . . 44.05 111.915 -179.312 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 44' ' ' PRO . . . . . 0.489 ' HD2' ' HD3' ' A' ' 55' ' ' ARG . 41.4 Cg_exo -57.07 119.54 6.86 Favored 'Trans proline' 0 CA--C 1.542 0.901 0 C-N-CA 122.743 2.295 . . . . 62.11 112.954 177.51 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 45' ' ' VAL . . . . . 0.469 ' O ' ' HE2' ' A' ' 35' ' ' LYS . 35.6 m -86.17 -16.73 9.59 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.675 0 N-CA-C 112.574 0.583 . . . . 62.41 112.574 -178.802 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 52.0 m -77.24 36.01 0.18 Allowed 'General case' 0 N--CA 1.478 0.952 0 N-CA-C 113.628 0.973 . . . . 73.04 113.628 -173.498 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . -112.15 176.34 17.88 Favored Glycine 0 CA--C 1.528 0.89 0 C-N-CA 120.892 -0.67 . . . . 73.5 112.912 177.71 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 48' ' ' THR . . . . . 0.58 ' O ' ' HG ' ' A' ' 52' ' ' LEU . 59.3 p -82.6 169.74 15.95 Favored 'General case' 0 N--CA 1.473 0.719 0 O-C-N 122.462 -0.434 . . . . 74.23 111.727 178.039 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 49' ' ' LYS . . . . . 0.43 ' O ' HG13 ' A' ' 53' ' ' ILE . 24.0 tptm -44.21 -59.64 2.27 Favored 'General case' 0 N--CA 1.473 0.713 0 C-N-CA 122.994 0.518 . . . . 70.42 112.227 -179.583 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 50' ' ' THR . . . . . 0.525 ' HA ' HD12 ' A' ' 53' ' ' ILE . 86.6 m -65.73 -38.19 88.46 Favored 'General case' 0 CA--C 1.541 0.598 0 N-CA-C 112.328 0.492 . . . . 71.33 112.328 -177.42 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 42.5 mt-10 -58.0 -50.83 72.07 Favored 'General case' 0 N--CA 1.473 0.699 0 CA-C-O 120.82 0.343 . . . . 74.43 111.533 177.613 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 52' ' ' LEU . . . . . 0.58 ' HG ' ' O ' ' A' ' 48' ' ' THR . 26.1 mt -59.1 -38.08 78.7 Favored 'General case' 0 CA--C 1.538 0.504 0 CA-C-N 116.435 -0.348 . . . . 75.14 111.441 -177.73 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 53' ' ' ILE . . . . . 0.525 HD12 ' HA ' ' A' ' 50' ' ' THR . 71.8 mt -57.69 -58.08 7.7 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.515 0 CA-C-O 121.093 0.473 . . . . 73.43 111.11 175.899 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 54' ' ' GLU . . . . . 0.445 ' HG2' HH11 ' A' ' 57' ' ' ARG . 44.4 mt-10 -65.7 -24.53 67.01 Favored 'General case' 0 N--CA 1.469 0.504 0 CA-C-N 116.207 -0.451 . . . . 71.41 111.864 179.697 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 55' ' ' ARG . . . . . 0.489 ' HD3' ' HD2' ' A' ' 44' ' ' PRO . 38.6 ttm180 -71.77 -44.46 63.98 Favored 'General case' 0 CA--C 1.54 0.57 0 CA-C-O 120.92 0.39 . . . . 70.13 110.912 177.329 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 56' ' ' LEU . . . . . 0.685 HD22 HH21 ' A' ' 41' ' ' ARG . 85.9 mt -58.96 -46.33 88.32 Favored 'General case' 0 N--CA 1.47 0.557 0 CA-C-O 121.236 0.541 . . . . 74.45 110.396 171.367 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 57' ' ' ARG . . . . . 0.445 HH11 ' HG2' ' A' ' 54' ' ' GLU . 48.6 mtp180 -59.47 -41.56 90.02 Favored 'General case' 0 CA--C 1.535 0.376 0 CA-C-N 115.499 -0.773 . . . . 70.22 111.419 177.58 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -59.55 -43.82 93.42 Favored 'General case' 0 CA--C 1.537 0.461 0 CA-C-N 116.472 -0.331 . . . . 54.21 111.663 179.218 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 59' ' ' TYR . . . . . . . . . . . . . 57.4 t80 -65.42 -48.28 73.33 Favored 'General case' 0 CA--C 1.54 0.56 0 CA-C-O 120.994 0.426 . . . . 64.13 110.918 178.368 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 60' ' ' GLN . . . . . . . . . . . . . 54.8 tp60 -59.89 -39.44 85.37 Favored 'General case' 0 CA--C 1.539 0.545 0 CA-C-O 121.347 0.594 . . . . 63.12 110.845 178.395 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 61' ' ' ASP . . . . . . . . . . . . . 24.2 t70 -56.21 -27.63 55.46 Favored 'General case' 0 CA--C 1.542 0.636 0 CA-C-N 115.459 -0.791 . . . . 72.21 111.821 178.048 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 62' ' ' GLN . . . . . . . . . . . . . 74.0 mt-30 -90.39 -36.4 14.63 Favored 'General case' 0 CA--C 1.542 0.639 0 N-CA-C 112.41 0.522 . . . . 75.32 112.41 -177.775 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 63' ' ' ILE . . . . . . . . . . . . . 43.8 pt -92.55 -20.85 6.4 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.72 0 N-CA-C 112.749 0.648 . . . . 65.45 112.749 -176.078 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 64' ' ' SER . . . . . 0.403 ' HA ' ' HD3' ' A' ' 65' ' ' PRO . 37.6 t -69.03 141.63 92.2 Favored Pre-proline 0 N--CA 1.474 0.755 0 N-CA-C 112.4 0.519 . . . . 61.41 112.4 -176.668 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 65' ' ' PRO . . . . . 0.403 ' HD3' ' HA ' ' A' ' 64' ' ' SER . 19.2 Cg_exo -68.64 -169.38 0.27 Allowed 'Trans proline' 0 CA--C 1.544 0.985 0 C-N-CA 122.741 2.294 . . . . 63.44 112.039 171.387 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 66' ' ' VAL . . . . . . . . . . . . . 29.7 m -67.55 128.09 93.51 Favored Pre-proline 0 CA--C 1.544 0.733 0 O-C-N 122.132 -0.355 . . . . 72.24 111.724 177.906 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 67' ' ' PRO . . . . . . . . . . . . . 72.6 Cg_endo -77.56 -44.79 0.17 Allowed 'Trans proline' 0 CA--C 1.543 0.945 0 C-N-CA 122.444 2.096 . . . . 73.22 113.279 -178.731 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . -80.08 -41.72 11.78 Favored Glycine 0 CA--C 1.524 0.599 0 C-N-CA 121.164 -0.541 . . . . 63.41 112.624 179.767 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . 69.06 130.49 0.03 OUTLIER Pre-proline 0 CA--C 1.542 0.665 0 C-N-CA 123.255 0.622 . . . . 72.31 112.196 178.583 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 70' ' ' PRO . . . . . . . . . . . . . 46.9 Cg_exo -56.85 105.36 0.17 Allowed 'Trans proline' 0 CA--C 1.541 0.838 0 C-N-CA 122.585 2.19 . . . . 75.02 112.606 177.486 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 97.3 mttt -74.35 101.19 3.99 Favored 'General case' 0 CA--C 1.537 0.445 0 CA-C-O 120.782 0.325 . . . . 74.44 111.818 -177.193 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 72' ' ' ALA . . . . . 0.412 ' HA ' ' HD3' ' A' ' 73' ' ' PRO . . . 68.26 129.87 0.03 OUTLIER Pre-proline 0 CA--C 1.544 0.739 0 N-CA-C 112.667 0.617 . . . . 53.31 112.667 177.214 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 73' ' ' PRO . . . . . 0.412 ' HD3' ' HA ' ' A' ' 72' ' ' ALA . 32.4 Cg_exo -59.57 114.09 1.9 Allowed 'Trans proline' 0 C--N 1.352 0.748 0 C-N-CA 122.533 2.156 . . . . 72.13 112.484 176.668 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -63.5 132.21 50.6 Favored 'General case' 0 CA--C 1.538 0.495 0 N-CA-C 112.151 0.426 . . . . 71.52 112.151 -179.119 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.253 1.257 0 CA-C-O 118.808 -0.615 . . . . 74.51 111.635 178.51 . . . . . . . . 0 0 . 1 . 020 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 64.2 mtt . . . . . 0 N--CA 1.489 1.503 0 CA-C-O 120.897 0.379 . . . . 61.41 111.264 . . . . . . . . . 0 0 . 1 . 020 nuclear build full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . 76.49 167.77 26.28 Favored Glycine 0 CA--C 1.528 0.867 0 CA-C-N 116.121 -0.49 . . . . 31.1 113.996 178.061 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 3' ' ' HIS . . . . . . . . . . . . . 94.2 m-70 -137.07 98.29 3.71 Favored 'General case' 0 N--CA 1.468 0.458 0 C-N-CA 122.776 0.43 . . . . 64.33 110.163 175.629 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 4' ' ' HIS . . . . . . . . . . . . . 34.5 m80 -69.02 123.84 22.12 Favored 'General case' 0 CA--C 1.542 0.661 0 CA-C-O 120.789 0.328 . . . . 63.43 111.279 -177.815 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 5' ' ' HIS . . . . . . . . . . . . . 40.2 m80 -108.35 111.62 23.65 Favored 'General case' 0 CA--C 1.538 0.481 0 N-CA-C 112.265 0.468 . . . . 64.44 112.265 -176.57 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 83.8 t60 -178.47 107.59 0.05 OUTLIER 'General case' 0 N--CA 1.471 0.59 0 CA-C-N 115.898 -0.592 . . . . 73.31 110.668 176.708 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 30.6 m170 -127.66 167.44 16.42 Favored 'General case' 0 N--CA 1.47 0.56 0 CA-C-O 121.06 0.457 . . . . 73.03 111.76 177.775 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 8' ' ' HIS . . . . . . . . . . . . . 17.8 p80 -157.19 114.34 3.06 Favored 'General case' 0 CA--C 1.538 0.514 0 CA-C-N 115.705 -0.68 . . . . 62.22 110.46 179.467 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 82.0 p -133.81 87.29 2.36 Favored 'General case' 0 N--CA 1.471 0.623 0 N-CA-C 112.507 0.558 . . . . 64.44 112.507 -177.902 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 32.5 p-80 -164.0 150.42 11.43 Favored 'General case' 0 N--CA 1.47 0.553 0 CA-C-N 116.479 -0.328 . . . . 65.44 110.985 173.131 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 11' ' ' MET . . . . . . . . . . . . . 26.3 ptt? -123.96 152.07 42.91 Favored 'General case' 0 N--CA 1.469 0.499 0 CA-C-O 120.931 0.396 . . . . 74.23 111.226 179.645 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 53.9 m -138.4 109.14 6.64 Favored 'General case' 0 N--CA 1.473 0.678 0 CA-C-O 120.802 0.334 . . . . 75.24 111.419 179.013 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 13' ' ' THR . . . . . 0.411 ' HA ' ' HD3' ' A' ' 14' ' ' PRO . 71.8 p -102.73 135.06 19.54 Favored Pre-proline 0 N--CA 1.473 0.686 0 N-CA-C 112.054 0.39 . . . . 54.31 112.054 -177.986 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 14' ' ' PRO . . . . . 0.411 ' HD3' ' HA ' ' A' ' 13' ' ' THR . 10.9 Cg_exo -72.77 139.19 30.22 Favored 'Trans proline' 0 CA--C 1.539 0.743 0 C-N-CA 122.729 2.286 . . . . 73.03 111.776 172.204 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 15' ' ' LEU . . . . . 0.468 HD22 ' N ' ' A' ' 15' ' ' LEU . 2.9 mm? -92.54 -47.13 7.29 Favored 'General case' 0 CA--C 1.539 0.555 0 CA-C-O 120.834 0.349 . . . . 73.03 111.805 -177.187 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 16' ' ' THR . . . . . . . . . . . . . 89.5 m -115.39 141.74 47.64 Favored 'General case' 0 N--CA 1.473 0.68 0 N-CA-C 112.304 0.483 . . . . 70.35 112.304 -175.704 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . 145.48 99.32 0.26 Allowed Glycine 0 CA--C 1.532 1.105 0 CA-C-N 116.11 -0.495 . . . . 65.24 113.047 177.784 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 22.7 pttp -148.12 125.23 5.6 Favored Pre-proline 0 CA--C 1.546 0.808 0 CA-C-N 117.185 0.493 . . . . 74.53 111.984 -179.114 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 74.5 Cg_endo -83.93 -165.7 0.32 Allowed 'Trans proline' 0 CA--C 1.542 0.915 0 C-N-CA 122.946 2.43 . . . . 75.21 113.113 178.977 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . 76.54 21.12 75.72 Favored Glycine 0 CA--C 1.527 0.781 0 C-N-CA 121.346 -0.454 . . . . 74.34 113.15 -179.344 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -164.29 -175.55 4.0 Favored 'General case' 0 CA--C 1.541 0.615 0 CA-C-O 121.396 0.617 . . . . 23.3 112.035 -177.031 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 22' ' ' LEU . . . . . 0.524 ' HG ' ' HG3' ' A' ' 60' ' ' GLN . 82.4 mt -82.52 159.34 64.36 Favored Pre-proline 0 CA--C 1.537 0.464 0 CA-C-N 115.936 -0.575 . . . . 53.33 111.713 179.978 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 23' ' ' PRO . . . . . 0.532 ' HD2' HD21 ' A' ' 26' ' ' LEU . 52.0 Cg_exo -57.77 150.52 61.92 Favored 'Trans proline' 0 CA--C 1.543 0.968 0 C-N-CA 122.403 2.069 . . . . 73.42 112.84 171.645 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -83.4 -9.45 59.02 Favored 'General case' 0 CA--C 1.539 0.54 0 N-CA-C 112.203 0.445 . . . . 42.4 112.203 -178.285 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 25' ' ' ASN . . . . . 0.524 ' HB3' ' HB3' ' A' ' 28' ' ' ASP . 15.4 m120 -112.67 24.98 11.89 Favored 'General case' 0 CA--C 1.541 0.632 0 N-CA-C 112.477 0.547 . . . . 71.44 112.477 -176.096 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 26' ' ' LEU . . . . . 0.532 HD21 ' HD2' ' A' ' 23' ' ' PRO . 95.1 mt -45.67 -47.29 15.05 Favored 'General case' 0 N--CA 1.48 1.033 0 N-CA-C 112.242 0.46 . . . . 60.23 112.242 -178.67 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 19.7 t70 -71.58 -30.9 66.36 Favored 'General case' 0 CA--C 1.539 0.526 0 CA-C-O 121.0 0.429 . . . . 75.42 111.533 -179.648 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 28' ' ' ASP . . . . . 0.524 ' HB3' ' HB3' ' A' ' 25' ' ' ASN . 20.9 t70 -78.23 -23.69 47.31 Favored 'General case' 0 CA--C 1.542 0.655 0 CA-C-O 121.193 0.52 . . . . 75.42 110.927 -179.89 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 29' ' ' MET . . . . . . . . . . . . . 71.5 mtp -73.23 -179.52 3.39 Favored 'General case' 0 CA--C 1.539 0.526 0 CA-C-N 115.823 -0.626 . . . . 72.52 111.966 -179.805 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 49.8 mtmt -95.76 153.81 17.55 Favored 'General case' 0 CA--C 1.54 0.562 0 CA-C-N 116.242 -0.435 . . . . 72.34 111.723 -176.654 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 31' ' ' VAL . . . . . 0.401 ' O ' ' HG3' ' A' ' 35' ' ' LYS . 57.7 t -51.55 -47.85 36.43 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.751 0 CA-C-N 116.196 -0.457 . . . . 74.51 111.924 -179.463 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -54.65 -45.37 73.79 Favored 'General case' 0 N--CA 1.473 0.679 0 CA-C-O 120.807 0.337 . . . . 43.45 111.752 178.687 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 13.8 mm-40 -53.58 -50.66 65.1 Favored 'General case' 0 N--CA 1.47 0.528 0 CA-C-O 121.193 0.52 . . . . 64.23 111.294 178.417 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 62.1 mt -62.63 -46.58 87.58 Favored 'General case' 0 CA--C 1.536 0.413 0 CA-C-N 115.497 -0.774 . . . . 53.23 111.422 -179.896 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 35' ' ' LYS . . . . . 0.401 ' HG3' ' O ' ' A' ' 31' ' ' VAL . 59.2 mtpt -56.22 -38.77 71.49 Favored 'General case' 0 CA--C 1.535 0.384 0 CA-C-N 116.284 -0.416 . . . . 73.51 111.549 179.834 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 90.0 mm-40 -64.55 -51.34 63.37 Favored 'General case' 0 CA--C 1.537 0.468 0 CA-C-N 116.546 -0.297 . . . . 62.24 111.581 178.197 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 45.4 mt-10 -62.64 -20.75 65.11 Favored 'General case' 0 N--CA 1.473 0.71 0 CA-C-O 120.915 0.388 . . . . 75.55 111.86 179.893 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 38' ' ' LEU . . . . . 0.442 HD11 ' HA ' ' A' ' 52' ' ' LEU . 77.0 mt -76.18 -62.27 1.67 Allowed 'General case' 0 N--CA 1.47 0.527 0 CA-C-O 120.827 0.346 . . . . 72.15 111.211 170.734 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 14.1 ptmm? -62.41 -33.33 74.56 Favored 'General case' 0 CA--C 1.542 0.641 0 N-CA-C 112.31 0.485 . . . . 64.31 112.31 -173.861 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 95.2 mt -62.54 -27.28 69.05 Favored 'General case' 0 N--CA 1.473 0.707 0 CA-C-O 120.924 0.392 . . . . 65.24 111.164 174.765 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 41' ' ' ARG . . . . . 0.706 HH21 HD23 ' A' ' 56' ' ' LEU . 55.8 mtm180 -104.7 19.04 21.16 Favored 'General case' 0 CA--C 1.543 0.698 0 CA-C-N 116.418 -0.355 . . . . 75.5 111.132 179.386 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 25.7 m 68.72 13.26 8.87 Favored 'General case' 0 N--CA 1.479 1.008 0 C-N-CA 123.309 0.643 . . . . 42.44 112.715 177.154 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 80.6 mt -83.67 136.86 41.72 Favored Pre-proline 0 CA--C 1.54 0.572 0 O-C-N 122.316 -0.24 . . . . 72.41 111.085 178.33 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 44' ' ' PRO . . . . . . . . . . . . . 72.6 Cg_endo -74.94 126.83 10.26 Favored 'Trans proline' 0 CA--C 1.54 0.811 0 C-N-CA 122.55 2.167 . . . . 73.05 113.545 -178.621 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 26.1 m -85.48 20.93 0.3 Allowed 'Isoleucine or valine' 0 CA--C 1.544 0.736 0 CA-C-N 116.069 -0.514 . . . . 73.33 112.114 179.751 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 15.1 m -78.48 62.77 3.17 Favored 'General case' 0 N--CA 1.47 0.573 0 CA-C-O 120.821 0.343 . . . . 64.03 111.724 -176.308 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . -169.75 -177.34 40.13 Favored Glycine 0 CA--C 1.528 0.855 0 C-N-CA 120.598 -0.811 . . . . 72.21 113.961 -179.819 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 48' ' ' THR . . . . . 0.537 ' O ' ' HG ' ' A' ' 52' ' ' LEU . 47.6 p -82.25 171.65 14.02 Favored 'General case' 0 N--CA 1.473 0.677 0 C-N-CA 122.491 0.317 . . . . 70.21 111.38 179.705 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 79.8 tttt -48.0 -46.74 33.18 Favored 'General case' 0 N--CA 1.476 0.826 0 CA-C-O 120.999 0.428 . . . . 61.33 111.513 177.995 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 50' ' ' THR . . . . . 0.4 ' O ' ' HG3' ' A' ' 54' ' ' GLU . 13.6 m -58.77 -46.69 86.92 Favored 'General case' 0 CA--C 1.535 0.394 0 CA-C-N 116.053 -0.522 . . . . 45.45 111.229 179.726 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 74.8 mm-40 -59.09 -41.69 88.66 Favored 'General case' 0 N--CA 1.47 0.559 0 CA-C-O 120.915 0.388 . . . . 73.22 111.401 179.559 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 52' ' ' LEU . . . . . 0.537 ' HG ' ' O ' ' A' ' 48' ' ' THR . 30.1 mt -57.71 -50.39 73.37 Favored 'General case' 0 CA--C 1.538 0.486 0 CA-C-O 121.334 0.588 . . . . 74.42 110.767 179.371 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 53' ' ' ILE . . . . . . . . . . . . . 67.9 mt -60.46 -53.72 44.94 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.44 0 CA-C-N 115.607 -0.724 . . . . 65.23 111.541 178.7 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 54' ' ' GLU . . . . . 0.4 ' HG3' ' O ' ' A' ' 50' ' ' THR . 85.6 mt-10 -60.69 -37.91 83.22 Favored 'General case' 0 CA--C 1.537 0.468 0 CA-C-N 115.795 -0.639 . . . . 74.42 112.123 -177.084 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 55' ' ' ARG . . . . . 0.426 HH11 ' HD2' ' A' ' 55' ' ' ARG . 14.9 ttt180 -73.78 -37.77 64.87 Favored 'General case' 0 CA--C 1.539 0.528 0 O-C-N 122.14 -0.35 . . . . 73.41 111.21 179.863 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 56' ' ' LEU . . . . . 0.706 HD23 HH21 ' A' ' 41' ' ' ARG . 51.1 mt -53.03 -47.64 68.2 Favored 'General case' 0 N--CA 1.47 0.539 0 CA-C-O 121.028 0.442 . . . . 71.23 109.951 170.355 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 16.3 mtp180 -64.5 -57.02 10.37 Favored 'General case' 0 CA--C 1.539 0.548 0 CA-C-N 115.452 -0.794 . . . . 72.51 112.03 179.386 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -52.5 -44.85 65.93 Favored 'General case' 0 N--CA 1.472 0.666 0 CA-C-O 121.02 0.438 . . . . 21.31 112.074 -178.713 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 59' ' ' TYR . . . . . . . . . . . . . 79.4 t80 -67.28 -41.16 85.93 Favored 'General case' 0 CA--C 1.541 0.606 0 CA-C-N 116.397 -0.365 . . . . 73.42 111.793 178.952 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 60' ' ' GLN . . . . . 0.524 ' HG3' ' HG ' ' A' ' 22' ' ' LEU . 19.3 tm0? -70.56 -33.97 71.71 Favored 'General case' 0 CA--C 1.54 0.573 0 CA-C-O 121.207 0.527 . . . . 61.01 110.692 179.958 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 61' ' ' ASP . . . . . . . . . . . . . 24.8 t70 -66.92 -48.21 69.36 Favored 'General case' 0 CA--C 1.541 0.615 0 CA-C-N 115.993 -0.549 . . . . 74.35 111.801 179.304 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 62' ' ' GLN . . . . . . . . . . . . . 19.7 pt20 -62.5 -37.67 86.9 Favored 'General case' 0 N--CA 1.474 0.761 0 N-CA-C 111.829 0.307 . . . . 55.44 111.829 -179.025 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 63' ' ' ILE . . . . . . . . . . . . . 30.4 pt -78.52 -22.03 13.17 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.475 0 CA-C-O 120.8 0.333 . . . . 74.25 110.592 174.518 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 64' ' ' SER . . . . . 0.461 ' HA ' ' HD3' ' A' ' 65' ' ' PRO . 14.9 t 75.1 137.51 0.05 OUTLIER Pre-proline 0 N--CA 1.479 0.986 0 N-CA-C 113.049 0.759 . . . . 73.5 113.049 173.148 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 65' ' ' PRO . . . . . 0.461 ' HD3' ' HA ' ' A' ' 64' ' ' SER . 13.5 Cg_exo -70.59 -168.18 0.3 Allowed 'Trans proline' 0 C--N 1.355 0.873 0 C-N-CA 122.897 2.398 . . . . 74.52 112.936 176.234 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 66' ' ' VAL . . . . . 0.442 ' HA ' ' HD3' ' A' ' 67' ' ' PRO . 23.5 m -63.76 116.27 25.27 Favored Pre-proline 0 CA--C 1.548 0.873 0 CA-C-O 120.907 0.384 . . . . 72.15 111.975 178.515 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 67' ' ' PRO . . . . . 0.442 ' HD3' ' HA ' ' A' ' 66' ' ' VAL . 27.5 Cg_exo -63.89 -31.82 66.91 Favored 'Trans proline' 0 C--N 1.352 0.711 0 C-N-CA 122.863 2.375 . . . . 74.01 112.681 -179.724 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . -55.88 -56.98 21.16 Favored Glycine 0 CA--C 1.525 0.68 0 C-N-CA 121.051 -0.595 . . . . 74.33 112.012 174.788 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . 64.42 152.29 0.12 Allowed Pre-proline 0 CA--C 1.545 0.757 0 N-CA-C 113.323 0.86 . . . . 64.11 113.323 174.032 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 70' ' ' PRO . . . . . . . . . . . . . 2.7 Cg_exo -77.67 120.67 5.24 Favored 'Trans proline' 0 CA--C 1.54 0.821 0 C-N-CA 122.845 2.363 . . . . 63.11 112.025 173.327 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 87.2 tttt -72.77 140.04 47.49 Favored 'General case' 0 CA--C 1.538 0.51 0 CA-C-O 120.958 0.408 . . . . 70.32 111.256 -179.433 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 72' ' ' ALA . . . . . 0.476 ' HA ' ' HD3' ' A' ' 73' ' ' PRO . . . -66.82 133.59 94.03 Favored Pre-proline 0 CA--C 1.542 0.636 0 CA-C-N 116.361 -0.381 . . . . 45.54 111.579 179.232 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 73' ' ' PRO . . . . . 0.476 ' HD3' ' HA ' ' A' ' 72' ' ' ALA . 35.6 Cg_exo -62.24 -165.19 0.04 OUTLIER 'Trans proline' 0 CA--C 1.543 0.93 0 C-N-CA 123.006 2.471 . . . . 72.32 113.175 178.624 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -72.95 66.19 0.78 Allowed 'General case' 0 CA--C 1.542 0.658 0 N-CA-C 111.924 0.342 . . . . 72.13 111.924 178.348 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.252 1.193 0 CA-C-O 118.527 -0.749 . . . . 70.1 112.608 -178.225 . . . . . . . . 0 0 . 1 . 001 nuclear nobuild core ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 83.4 mt . . . . . 0 CA--C 1.543 0.692 0 CA-C-O 120.632 0.253 . . . . 74.12 111.559 . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild core ' A' A ' 23' ' ' PRO . . . . . 0.49 ' O ' ' HG ' ' A' ' 26' ' ' LEU . 38.7 Cg_exo -61.26 125.3 16.62 Favored 'Trans proline' 0 CA--C 1.541 0.84 0 C-N-CA 122.353 2.035 . . . . 74.52 112.459 177.364 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -77.73 -2.52 36.61 Favored 'General case' 0 N--CA 1.472 0.629 0 N-CA-C 112.087 0.403 . . . . 72.51 112.087 -178.122 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 23.0 m120 -101.93 31.37 3.92 Favored 'General case' 0 CA--C 1.54 0.562 0 N-CA-C 112.108 0.411 . . . . 73.15 112.108 179.94 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 26' ' ' LEU . . . . . 0.49 ' HG ' ' O ' ' A' ' 23' ' ' PRO . 92.5 mt -56.94 -44.29 82.37 Favored 'General case' 0 N--CA 1.471 0.578 0 CA-C-O 120.98 0.419 . . . . 71.53 111.122 177.307 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 5.4 m-20 -63.14 -31.8 73.03 Favored 'General case' 0 CA--C 1.54 0.579 0 CA-C-N 116.078 -0.51 . . . . 65.21 111.728 178.046 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 22.3 m-20 -75.59 -23.15 56.46 Favored 'General case' 0 CA--C 1.536 0.431 0 CA-C-N 116.244 -0.435 . . . . 65.01 112.13 -177.966 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 29' ' ' MET . . . . . . . . . . . . . 65.8 mtm -85.86 179.36 7.04 Favored 'General case' 0 CA--C 1.538 0.482 0 CA-C-O 121.498 0.666 . . . . 62.34 112.325 -177.278 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 30' ' ' LYS . . . . . 0.567 ' HB2' ' HG2' ' A' ' 33' ' ' GLU . 45.7 mtpt -85.69 158.71 19.99 Favored 'General case' 0 CA--C 1.538 0.493 0 CA-C-N 115.647 -0.706 . . . . 54.11 111.246 -179.255 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 60.9 t -57.04 -40.98 76.52 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.506 0 CA-C-O 121.055 0.455 . . . . 63.41 110.76 177.669 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -56.94 -43.98 82.05 Favored 'General case' 0 CA--C 1.538 0.494 0 CA-C-N 115.871 -0.604 . . . . 71.05 111.875 177.759 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 33' ' ' GLU . . . . . 0.567 ' HG2' ' HB2' ' A' ' 30' ' ' LYS . 5.4 mm-40 -60.13 -41.58 92.97 Favored 'General case' 0 N--CA 1.47 0.562 0 CA-C-O 121.112 0.482 . . . . 75.33 110.649 179.928 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 70.6 mt -62.95 -45.63 91.56 Favored 'General case' 0 N--CA 1.468 0.446 0 CA-C-N 115.952 -0.567 . . . . 64.43 110.685 176.88 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 28.1 mtpp -60.52 -34.12 73.64 Favored 'General case' 0 CA--C 1.542 0.635 0 CA-C-N 115.974 -0.557 . . . . 73.54 110.979 176.449 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 36' ' ' GLN . . . . . 0.411 HE21 HD11 ' A' ' 40' ' ' LEU . 56.9 tp60 -64.76 -50.31 67.34 Favored 'General case' 0 CA--C 1.541 0.6 0 CA-C-O 121.024 0.44 . . . . 73.11 111.057 175.711 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 37' ' ' GLU . . . . . 0.402 ' O ' ' HG3' ' A' ' 41' ' ' ARG . 23.2 mm-40 -58.64 -40.0 82.15 Favored 'General case' 0 CA--C 1.539 0.546 0 CA-C-N 116.293 -0.412 . . . . 75.51 111.832 177.199 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 38' ' ' LEU . . . . . 0.5 ' HB2' HG12 ' A' ' 45' ' ' VAL . 92.3 mt -64.36 -56.04 17.07 Favored 'General case' 0 CA--C 1.538 0.49 0 N-CA-C 112.089 0.403 . . . . 74.01 112.089 178.422 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 19.8 ptpt -55.51 -40.88 72.35 Favored 'General case' 0 N--CA 1.473 0.703 0 N-CA-C 112.02 0.378 . . . . 72.03 112.02 -175.367 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 40' ' ' LEU . . . . . 0.411 HD11 HE21 ' A' ' 36' ' ' GLN . 93.4 mt -66.13 -22.72 66.39 Favored 'General case' 0 N--CA 1.471 0.596 0 CA-C-O 120.883 0.373 . . . . 63.31 111.85 -179.255 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 41' ' ' ARG . . . . . 0.402 ' HG3' ' O ' ' A' ' 37' ' ' GLU . 75.7 mtt-85 -104.22 18.24 22.49 Favored 'General case' 0 CA--C 1.541 0.61 0 CA-C-O 120.73 0.3 . . . . 75.12 111.441 -179.676 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 33.1 t 67.0 16.57 10.38 Favored 'General case' 0 N--CA 1.478 0.932 0 C-N-CA 122.949 0.5 . . . . 63.24 112.315 178.458 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 65.6 mt -90.52 143.38 29.12 Favored Pre-proline 0 CA--C 1.542 0.641 0 N-CA-C 111.947 0.351 . . . . 64.13 111.947 -178.851 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 44' ' ' PRO . . . . . . . . . . . . . 42.9 Cg_endo -67.89 132.41 26.47 Favored 'Trans proline' 0 CA--C 1.542 0.891 0 C-N-CA 122.622 2.215 . . . . 63.54 113.008 176.812 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 45' ' ' VAL . . . . . 0.5 HG12 ' HB2' ' A' ' 38' ' ' LEU . 33.6 m -96.49 36.47 0.13 Allowed 'Isoleucine or valine' 0 N--CA 1.471 0.622 0 CA-C-N 116.122 -0.49 . . . . 61.32 111.806 -177.375 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 17.4 m -80.65 -61.67 1.9 Allowed 'General case' 0 CA--C 1.542 0.657 0 N-CA-C 114.064 1.135 . . . . 61.54 114.064 -168.777 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . -66.91 -170.82 4.4 Favored Glycine 0 CA--C 1.53 0.976 0 N-CA-C 115.996 1.159 . . . . 64.33 115.996 -166.944 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 48' ' ' THR . . . . . 0.586 ' O ' ' HG ' ' A' ' 52' ' ' LEU . 62.4 p -74.38 175.5 7.62 Favored 'General case' 0 N--CA 1.471 0.584 0 CA-C-N 115.295 -0.453 . . . . 51.12 111.749 -178.337 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 49' ' ' LYS . . . . . 0.423 ' O ' HG13 ' A' ' 53' ' ' ILE . 87.8 tttt -49.96 -53.79 24.11 Favored 'General case' 0 CA--C 1.543 0.677 0 N-CA-C 111.847 0.314 . . . . 53.51 111.847 -178.868 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 50' ' ' THR . . . . . . . . . . . . . 47.8 m -59.24 -43.28 92.39 Favored 'General case' 0 N--CA 1.473 0.705 0 CA-C-O 120.799 0.333 . . . . 71.25 111.595 179.351 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 51' ' ' GLU . . . . . 0.422 ' CD ' HH21 ' A' ' 55' ' ' ARG . 0.7 OUTLIER -53.61 -54.5 36.72 Favored 'General case' 0 CA--C 1.539 0.542 0 CA-C-O 120.941 0.401 . . . . 73.43 110.512 176.632 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 52' ' ' LEU . . . . . 0.586 ' HG ' ' O ' ' A' ' 48' ' ' THR . 25.7 mt -57.2 -47.62 80.81 Favored 'General case' 0 CA--C 1.54 0.586 0 CA-C-N 116.024 -0.534 . . . . 55.34 111.199 -179.718 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 53' ' ' ILE . . . . . 0.423 HG13 ' O ' ' A' ' 49' ' ' LYS . 91.2 mt -54.52 -52.73 37.57 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.616 0 CA-C-O 121.304 0.573 . . . . 52.5 111.678 177.951 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 54' ' ' GLU . . . . . 0.415 ' HA ' ' HE ' ' A' ' 57' ' ' ARG . 35.0 mt-10 -70.95 -24.86 62.51 Favored 'General case' 0 CA--C 1.536 0.432 0 N-CA-C 112.164 0.431 . . . . 74.34 112.164 -178.253 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 55' ' ' ARG . . . . . 0.422 HH21 ' CD ' ' A' ' 51' ' ' GLU . 46.6 ttm-85 -68.52 -36.45 78.88 Favored 'General case' 0 CA--C 1.538 0.502 0 CA-C-O 121.095 0.474 . . . . 73.41 110.257 175.639 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 89.9 mt -61.4 -44.73 96.65 Favored 'General case' 0 N--CA 1.469 0.495 0 CA-C-N 116.176 -0.466 . . . . 64.11 110.81 172.556 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 57' ' ' ARG . . . . . 0.415 ' HE ' ' HA ' ' A' ' 54' ' ' GLU . 40.3 mtm180 -62.89 -42.42 99.77 Favored 'General case' 0 N--CA 1.471 0.582 0 CA-C-O 121.027 0.442 . . . . 72.44 111.061 176.751 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -61.65 -39.45 91.39 Favored 'General case' 0 N--CA 1.469 0.495 0 CA-C-O 121.113 0.483 . . . . 51.13 111.482 178.027 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 59' ' ' TYR . . . . . . . . . . . . . 63.2 t80 -62.78 -47.17 84.63 Favored 'General case' 0 CA--C 1.537 0.462 0 CA-C-O 121.094 0.474 . . . . 75.51 110.806 176.021 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 60' ' ' GLN . . . . . . . . . . . . . 7.5 tp-100 -58.44 -44.62 89.26 Favored 'General case' 0 N--CA 1.468 0.468 0 CA-C-N 116.027 -0.533 . . . . 74.24 110.941 176.163 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 61' ' ' ASP . . . . . . . . . . . . . 31.9 t70 -59.03 -23.0 61.59 Favored 'General case' 0 CA--C 1.545 0.774 0 CA-C-O 121.208 0.527 . . . . 71.14 111.699 -178.401 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 62' ' ' GLN . . . . . . . . . . . . . 48.5 mt-30 . . . . . 0 CA--C 1.54 0.592 0 CA-C-N 116.299 -0.409 . . . . 75.13 111.683 178.675 . . . . . . . . 0 0 . 1 . 002 nuclear nobuild core ' A' A ' 22' ' ' LEU . . . . . 0.577 ' HG ' ' HG3' ' A' ' 60' ' ' GLN . 97.0 mt . . . . . 0 N--CA 1.473 0.72 0 N-CA-C 112.331 0.493 . . . . 72.2 112.331 . . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 23' ' ' PRO . . . . . . . . . . . . . 5.3 Cg_endo -85.97 149.14 9.51 Favored 'Trans proline' 0 CA--C 1.542 0.88 0 C-N-CA 123.133 2.555 . . . . 74.21 111.764 171.987 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -74.96 -10.33 59.38 Favored 'General case' 0 N--CA 1.471 0.59 0 N-CA-C 112.108 0.41 . . . . 54.21 112.108 -179.081 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 14.1 m120 -84.97 28.75 0.68 Allowed 'General case' 0 CA--C 1.546 0.81 0 N-CA-C 112.586 0.587 . . . . 64.32 112.586 -177.554 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 85.5 mt -57.75 -62.23 1.95 Allowed 'General case' 0 N--CA 1.473 0.711 0 N-CA-C 112.606 0.595 . . . . 74.24 112.606 -177.059 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 27' ' ' ASP . . . . . 0.518 ' HA ' ' HE2' ' A' ' 49' ' ' LYS . 29.9 t70 -71.61 -20.23 62.01 Favored 'General case' 0 N--CA 1.471 0.589 0 CA-C-O 121.012 0.434 . . . . 70.24 111.13 -179.127 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 5.6 m-20 -67.77 -29.02 68.12 Favored 'General case' 0 CA--C 1.538 0.504 0 CA-C-N 116.49 -0.323 . . . . 73.24 110.941 175.087 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 29' ' ' MET . . . . . 0.485 ' O ' ' HE3' ' A' ' 49' ' ' LYS . 59.8 mtm -83.25 164.32 20.19 Favored 'General case' 0 CA--C 1.539 0.521 0 CA-C-O 120.739 0.304 . . . . 63.32 110.57 172.04 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 59.2 mtpt -86.45 166.25 15.67 Favored 'General case' 0 CA--C 1.54 0.587 0 CA-C-O 121.441 0.639 . . . . 65.14 112.676 -177.08 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 31' ' ' VAL . . . . . 0.506 HG13 HD11 ' A' ' 52' ' ' LEU . 61.4 t -53.34 -47.94 57.02 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.798 0 CA-C-N 115.694 -0.685 . . . . 62.32 112.096 -177.812 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -61.33 -27.28 68.38 Favored 'General case' 0 CA--C 1.539 0.526 0 N-CA-C 112.221 0.452 . . . . 60.1 112.221 -179.598 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 33' ' ' GLU . . . . . 0.43 ' O ' ' HB3' ' A' ' 36' ' ' GLN . 40.9 mt-10 -78.79 -39.58 35.41 Favored 'General case' 0 N--CA 1.47 0.574 0 CA-C-O 121.035 0.445 . . . . 72.04 111.334 -179.925 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 92.9 mt -66.74 -40.87 88.5 Favored 'General case' 0 CA--C 1.538 0.513 0 CA-C-O 120.703 0.287 . . . . 71.13 111.385 177.478 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 35' ' ' LYS . . . . . 0.518 ' HA ' HD12 ' A' ' 38' ' ' LEU . 96.3 mttt -61.23 -30.28 70.35 Favored 'General case' 0 CA--C 1.538 0.518 0 CA-C-O 120.872 0.368 . . . . 63.12 111.218 176.194 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 36' ' ' GLN . . . . . 0.437 HE21 HD11 ' A' ' 40' ' ' LEU . 2.5 tt0 -61.82 -54.15 46.2 Favored 'General case' 0 CA--C 1.538 0.514 0 CA-C-O 121.125 0.488 . . . . 75.11 110.115 171.694 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 36.6 mm-40 -57.57 -26.22 61.14 Favored 'General case' 0 CA--C 1.54 0.594 0 CA-C-N 115.916 -0.583 . . . . 62.33 112.133 177.575 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 38' ' ' LEU . . . . . 0.518 HD12 ' HA ' ' A' ' 35' ' ' LYS . 93.7 mt -72.5 -56.91 4.64 Favored 'General case' 0 CA--C 1.535 0.381 0 CA-C-O 120.931 0.396 . . . . 52.43 111.571 175.182 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 39' ' ' LYS . . . . . 0.414 ' HE2' ' HB3' ' A' ' 39' ' ' LYS . 16.9 ptpt -61.86 -30.13 70.65 Favored 'General case' 0 CA--C 1.539 0.557 0 N-CA-C 112.197 0.443 . . . . 61.52 112.197 -175.734 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 40' ' ' LEU . . . . . 0.437 HD11 HE21 ' A' ' 36' ' ' GLN . 75.8 mt -58.05 -25.6 61.41 Favored 'General case' 0 N--CA 1.473 0.676 0 CA-C-O 120.891 0.377 . . . . 73.23 111.754 174.867 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 41' ' ' ARG . . . . . . . . . . . . . 13.7 mtm180 -121.71 24.55 9.69 Favored 'General case' 0 CA--C 1.539 0.539 0 CA-C-O 120.778 0.323 . . . . 70.24 111.761 -178.567 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 23.2 t 62.46 33.51 16.08 Favored 'General case' 0 N--CA 1.475 0.807 0 N-CA-C 112.336 0.495 . . . . 73.32 112.336 174.935 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 43' ' ' LEU . . . . . 0.408 ' HB3' HD22 ' A' ' 38' ' ' LEU . 76.3 mt -97.01 147.56 33.09 Favored Pre-proline 0 CA--C 1.542 0.661 0 CA-C-O 120.72 0.295 . . . . 64.22 111.596 178.546 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 44' ' ' PRO . . . . . . . . . . . . . 35.6 Cg_endo -64.16 122.81 10.92 Favored 'Trans proline' 0 CA--C 1.541 0.844 0 C-N-CA 122.859 2.373 . . . . 71.4 113.445 -178.04 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 33.7 m -98.93 31.19 0.41 Allowed 'Isoleucine or valine' 0 CA--C 1.545 0.767 0 CA-C-N 116.184 -0.462 . . . . 74.33 112.027 -177.498 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 78.5 p -93.94 -41.08 9.79 Favored 'General case' 0 N--CA 1.473 0.716 0 N-CA-C 112.754 0.65 . . . . 75.43 112.754 -175.514 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . -66.69 -179.33 10.68 Favored Glycine 0 CA--C 1.534 1.254 0 N-CA-C 115.078 0.791 . . . . 73.41 115.078 -174.021 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 48' ' ' THR . . . . . 0.618 ' O ' ' HG ' ' A' ' 52' ' ' LEU . 50.8 p -85.39 179.56 7.14 Favored 'General case' 0 N--CA 1.475 0.791 0 C-N-CA 122.811 0.444 . . . . 72.2 112.164 -178.254 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 49' ' ' LYS . . . . . 0.518 ' HE2' ' HA ' ' A' ' 27' ' ' ASP . 24.1 tptm -41.82 -58.7 1.93 Allowed 'General case' 0 N--CA 1.476 0.831 0 C-N-CA 123.418 0.687 . . . . 73.42 112.561 179.506 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 50' ' ' THR . . . . . . . . . . . . . 24.1 m -60.96 -38.32 85.5 Favored 'General case' 0 CA--C 1.537 0.467 0 CA-C-O 120.866 0.365 . . . . 73.21 111.583 -178.315 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 51' ' ' GLU . . . . . 0.461 ' O ' ' HB2' ' A' ' 55' ' ' ARG . 57.4 mm-40 -60.95 -42.44 98.23 Favored 'General case' 0 N--CA 1.469 0.524 0 CA-C-N 116.445 -0.343 . . . . 71.03 111.08 178.542 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 52' ' ' LEU . . . . . 0.618 ' HG ' ' O ' ' A' ' 48' ' ' THR . 14.3 mt -61.68 -45.48 93.8 Favored 'General case' 0 N--CA 1.467 0.406 0 CA-C-O 121.085 0.469 . . . . 74.32 110.628 179.15 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 53' ' ' ILE . . . . . . . . . . . . . 68.3 mt -58.5 -53.85 41.06 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.49 0 CA-C-N 115.746 -0.661 . . . . 72.41 111.332 178.341 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 40.5 mt-10 -65.07 -32.64 74.45 Favored 'General case' 0 CA--C 1.536 0.419 0 CA-C-N 116.394 -0.367 . . . . 71.34 111.38 -179.76 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 55' ' ' ARG . . . . . 0.473 ' HB3' HD21 ' A' ' 38' ' ' LEU . 0.0 OUTLIER -60.1 -53.23 60.25 Favored 'General case' 0 CA--C 1.537 0.45 0 CA-C-O 121.19 0.519 . . . . 74.14 110.588 177.573 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 98.3 mt -57.29 -50.93 71.36 Favored 'General case' 0 CA--C 1.537 0.444 0 CA-C-N 115.834 -0.621 . . . . 73.12 111.363 176.269 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 19.9 mtp180 -63.81 -30.49 71.58 Favored 'General case' 0 CA--C 1.541 0.602 0 N-CA-C 112.187 0.44 . . . . 75.53 112.187 -178.487 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -71.46 -48.08 51.6 Favored 'General case' 0 N--CA 1.469 0.516 0 CA-C-O 121.216 0.531 . . . . 72.31 110.921 175.896 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 59' ' ' TYR . . . . . . . . . . . . . 74.1 t80 -61.21 -42.66 98.98 Favored 'General case' 0 CA--C 1.539 0.527 0 CA-C-O 121.074 0.464 . . . . 73.33 111.234 177.841 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 60' ' ' GLN . . . . . 0.577 ' HG3' ' HG ' ' A' ' 22' ' ' LEU . 21.7 tm0? -71.82 -36.83 70.34 Favored 'General case' 0 CA--C 1.538 0.516 0 CA-C-N 116.255 -0.43 . . . . 75.04 111.145 -178.528 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 61' ' ' ASP . . . . . . . . . . . . . 20.7 t70 -56.33 -40.77 74.98 Favored 'General case' 0 N--CA 1.47 0.556 0 CA-C-O 121.306 0.574 . . . . 71.24 111.064 178.984 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 62' ' ' GLN . . . . . . . . . . . . . 48.1 mt-30 . . . . . 0 CA--C 1.542 0.644 0 CA-C-N 115.377 -0.829 . . . . 70.14 112.148 -179.331 . . . . . . . . 0 0 . 1 . 003 nuclear nobuild core ' A' A ' 22' ' ' LEU . . . . . 0.622 ' HG ' ' HG3' ' A' ' 60' ' ' GLN . 91.6 mt . . . . . 0 N--CA 1.472 0.655 0 N-CA-C 111.916 0.339 . . . . 75.44 111.916 . . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 23' ' ' PRO . . . . . . . . . . . . . 32.9 Cg_exo -62.19 166.61 12.42 Favored 'Trans proline' 0 CA--C 1.541 0.844 0 C-N-CA 122.656 2.237 . . . . 73.52 111.845 169.233 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -76.36 -65.07 0.97 Allowed 'General case' 0 CA--C 1.54 0.577 0 CA-C-O 120.963 0.411 . . . . 62.45 112.053 -177.532 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 25' ' ' ASN . . . . . 0.594 ' HB3' ' HB2' ' A' ' 28' ' ' ASP . 1.8 m-20 -81.27 67.54 7.25 Favored 'General case' 0 CA--C 1.541 0.613 0 CA-C-O 121.086 0.47 . . . . 70.44 111.85 -175.578 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 26' ' ' LEU . . . . . 0.445 HD21 ' HB3' ' A' ' 22' ' ' LEU . 95.4 mt -58.87 -51.75 68.66 Favored 'General case' 0 CA--C 1.542 0.635 0 N-CA-C 112.834 0.679 . . . . 72.12 112.834 -176.284 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 35.4 t70 -71.81 -17.01 62.19 Favored 'General case' 0 CA--C 1.54 0.578 0 CA-C-O 121.03 0.443 . . . . 71.41 111.622 -177.975 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 28' ' ' ASP . . . . . 0.594 ' HB2' ' HB3' ' A' ' 25' ' ' ASN . 6.0 m-20 -80.5 -25.26 38.85 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-O 120.775 0.322 . . . . 73.15 110.986 174.802 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 29' ' ' MET . . . . . 0.434 ' HG3' ' O ' ' A' ' 25' ' ' ASN . 87.4 mtp -67.74 139.95 56.69 Favored 'General case' 0 CA--C 1.537 0.448 0 CA-C-O 121.129 0.49 . . . . 73.11 110.575 173.835 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 49.9 mtmt -66.41 151.96 46.07 Favored 'General case' 0 CA--C 1.538 0.484 0 CA-C-O 121.023 0.439 . . . . 73.5 111.769 -176.514 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 31' ' ' VAL . . . . . 0.48 HG12 ' HE3' ' A' ' 35' ' ' LYS . 39.8 t -49.67 -42.74 17.87 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.684 0 CA-C-N 116.085 -0.507 . . . . 74.54 112.288 -176.842 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -63.04 -37.54 87.6 Favored 'General case' 0 CA--C 1.539 0.556 0 N-CA-C 111.854 0.316 . . . . 53.15 111.854 178.041 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 38.2 mt-10 -64.29 -40.55 96.17 Favored 'General case' 0 N--CA 1.469 0.518 0 CA-C-O 120.987 0.423 . . . . 75.31 111.114 179.114 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 88.1 mt -61.96 -46.17 90.47 Favored 'General case' 0 N--CA 1.468 0.47 0 CA-C-N 116.111 -0.495 . . . . 72.12 110.911 176.487 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 35' ' ' LYS . . . . . 0.48 ' HE3' HG12 ' A' ' 31' ' ' VAL . 98.0 mttt -63.8 -32.74 74.34 Favored 'General case' 0 CA--C 1.539 0.538 0 CA-C-N 116.199 -0.455 . . . . 71.12 111.602 177.311 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 36' ' ' GLN . . . . . 0.474 ' O ' ' HG ' ' A' ' 40' ' ' LEU . 25.6 tm0? -62.92 -41.75 99.57 Favored 'General case' 0 CA--C 1.538 0.502 0 CA-C-O 120.844 0.354 . . . . 74.14 110.704 176.744 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 52.9 mm-40 -67.18 -46.69 73.2 Favored 'General case' 0 CA--C 1.542 0.641 0 CA-C-O 120.907 0.384 . . . . 61.13 111.513 174.219 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 38' ' ' LEU . . . . . 0.405 ' CD1' HD22 ' A' ' 52' ' ' LEU . 81.1 mt -53.57 -52.51 59.52 Favored 'General case' 0 N--CA 1.47 0.574 0 N-CA-C 112.472 0.545 . . . . 64.11 112.472 179.942 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 18.4 ptpt -58.59 -40.37 82.98 Favored 'General case' 0 N--CA 1.473 0.678 0 N-CA-C 111.751 0.278 . . . . 72.42 111.751 -177.7 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 40' ' ' LEU . . . . . 0.474 ' HG ' ' O ' ' A' ' 36' ' ' GLN . 94.9 mt -59.69 -30.09 68.54 Favored 'General case' 0 N--CA 1.472 0.642 0 CA-C-O 121.341 0.591 . . . . 54.55 110.993 176.963 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 41' ' ' ARG . . . . . 0.43 ' NH1' ' OE1' ' A' ' 60' ' ' GLN . 60.2 mtt-85 -99.67 14.07 31.37 Favored 'General case' 0 CA--C 1.537 0.466 0 CA-C-N 115.695 -0.684 . . . . 74.31 111.778 -175.804 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 47.7 m 64.16 19.51 11.8 Favored 'General case' 0 N--CA 1.479 0.986 0 CA-C-O 121.066 0.46 . . . . 72.43 111.985 179.045 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 74.3 mt -91.03 146.52 33.83 Favored Pre-proline 0 CA--C 1.541 0.599 0 CA-C-N 116.085 -0.507 . . . . 62.05 111.639 -178.88 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 44' ' ' PRO . . . . . 0.528 ' HD2' ' HD3' ' A' ' 55' ' ' ARG . 33.6 Cg_exo -57.99 134.06 59.83 Favored 'Trans proline' 0 CA--C 1.545 1.03 0 C-N-CA 122.305 2.003 . . . . 75.42 112.546 174.737 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 34.0 m -105.64 -12.91 9.54 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.772 0 N-CA-C 112.57 0.581 . . . . 72.12 112.57 -175.197 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 57.4 p -85.0 37.13 0.65 Allowed 'General case' 0 N--CA 1.478 0.948 0 N-CA-C 112.802 0.667 . . . . 65.43 112.802 -174.933 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . -108.54 174.11 18.41 Favored Glycine 0 CA--C 1.529 0.92 0 C-N-CA 121.277 -0.487 . . . . 61.31 112.946 177.638 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 48' ' ' THR . . . . . 0.496 ' O ' ' HG ' ' A' ' 52' ' ' LEU . 70.6 p -80.96 162.1 24.01 Favored 'General case' 0 N--CA 1.474 0.76 0 O-C-N 122.437 -0.449 . . . . 74.31 111.476 177.811 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 49' ' ' LYS . . . . . 0.406 ' HD3' HG22 ' A' ' 31' ' ' VAL . 22.8 tptm -37.99 -60.44 0.75 Allowed 'General case' 0 N--CA 1.478 0.946 0 N-CA-C 113.106 0.78 . . . . 70.33 113.106 -177.561 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 50' ' ' THR . . . . . . . . . . . . . 60.3 m -58.99 -41.01 86.59 Favored 'General case' 0 N--CA 1.472 0.629 0 N-CA-C 112.146 0.424 . . . . 73.21 112.146 -178.072 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 47.3 mt-10 -62.54 -41.99 99.24 Favored 'General case' 0 N--CA 1.469 0.489 0 CA-C-O 120.803 0.335 . . . . 63.14 111.274 179.784 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 52' ' ' LEU . . . . . 0.496 ' HG ' ' O ' ' A' ' 48' ' ' THR . 42.4 mt -57.63 -46.94 83.49 Favored 'General case' 0 N--CA 1.47 0.527 0 CA-C-O 121.254 0.549 . . . . 70.02 110.803 179.783 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 53' ' ' ILE . . . . . . . . . . . . . 66.3 mt -63.81 -57.5 11.42 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.55 0 CA-C-N 115.578 -0.737 . . . . 71.02 111.934 -179.685 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 21.0 mm-40 -60.03 -33.14 71.61 Favored 'General case' 0 CA--C 1.538 0.485 0 CA-C-N 116.277 -0.419 . . . . 72.02 111.86 -177.918 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 55' ' ' ARG . . . . . 0.528 ' HD3' ' HD2' ' A' ' 44' ' ' PRO . 40.5 ttm180 -64.19 -44.93 90.5 Favored 'General case' 0 CA--C 1.542 0.666 0 CA-C-O 120.814 0.34 . . . . 72.25 111.161 175.576 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 81.1 mt -57.73 -45.87 85.23 Favored 'General case' 0 N--CA 1.471 0.619 0 CA-C-O 121.232 0.539 . . . . 64.53 111.184 174.561 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 81.2 mtp180 -65.26 -43.11 92.34 Favored 'General case' 0 CA--C 1.536 0.439 0 CA-C-N 115.88 -0.6 . . . . 61.34 111.442 -179.041 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 58' ' ' ALA . . . . . 0.404 ' O ' ' HG3' ' A' ' 62' ' ' GLN . . . -60.93 -40.43 93.17 Favored 'General case' 0 CA--C 1.535 0.392 0 CA-C-O 120.916 0.389 . . . . 53.4 111.269 178.775 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 59' ' ' TYR . . . . . . . . . . . . . 81.5 t80 -59.55 -49.92 75.91 Favored 'General case' 0 CA--C 1.54 0.571 0 CA-C-N 115.848 -0.615 . . . . 63.31 111.395 176.396 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 60' ' ' GLN . . . . . 0.622 ' HG3' ' HG ' ' A' ' 22' ' ' LEU . 14.3 mm100 -66.75 -30.19 70.35 Favored 'General case' 0 N--CA 1.471 0.614 0 N-CA-C 111.885 0.328 . . . . 73.42 111.885 178.969 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 61' ' ' ASP . . . . . . . . . . . . . 17.2 t70 -63.37 -40.87 98.43 Favored 'General case' 0 CA--C 1.539 0.545 0 CA-C-O 120.942 0.401 . . . . 65.44 111.437 177.799 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 62' ' ' GLN . . . . . 0.404 ' HG3' ' O ' ' A' ' 58' ' ' ALA . 51.1 mt-30 . . . . . 0 CA--C 1.537 0.469 0 CA-C-N 116.319 -0.4 . . . . 72.21 111.768 179.389 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 76.2 mt . . . . . 0 N--CA 1.472 0.644 0 CA-C-O 120.843 0.354 . . . . 51.44 111.783 . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild core ' A' A ' 23' ' ' PRO . . . . . . . . . . . . . 87.4 Cg_endo -83.54 171.14 11.2 Favored 'Trans proline' 0 CA--C 1.538 0.704 0 C-N-CA 122.797 2.331 . . . . 64.52 112.37 171.643 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -92.97 -2.7 55.53 Favored 'General case' 0 CA--C 1.541 0.631 0 CA-C-O 120.816 0.341 . . . . 73.12 111.481 176.31 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 1.5 m-20 -88.35 19.86 3.59 Favored 'General case' 0 N--CA 1.473 0.687 0 N-CA-C 112.203 0.446 . . . . 65.55 112.203 -177.138 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 99.1 mt -54.14 -51.83 63.0 Favored 'General case' 0 CA--C 1.545 0.767 0 N-CA-C 112.877 0.695 . . . . 64.42 112.877 -174.544 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 17.6 t70 -76.86 -16.47 59.4 Favored 'General case' 0 CA--C 1.543 0.709 0 CA-C-O 121.001 0.429 . . . . 61.55 111.571 -179.15 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 24.7 t70 -81.12 -29.14 34.87 Favored 'General case' 0 CA--C 1.543 0.694 0 CA-C-O 120.89 0.376 . . . . 74.13 111.474 179.985 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 29' ' ' MET . . . . . . . . . . . . . 58.2 mtm -81.55 172.66 13.21 Favored 'General case' 0 CA--C 1.541 0.623 0 CA-C-O 121.368 0.604 . . . . 51.0 111.989 -179.491 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 48.8 mtmt -77.95 156.04 30.47 Favored 'General case' 0 CA--C 1.539 0.544 0 CA-C-N 115.672 -0.694 . . . . 41.11 111.563 -179.402 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 59.7 t -57.79 -35.22 50.35 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.584 0 CA-C-O 120.934 0.397 . . . . 72.24 111.31 179.183 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -59.87 -37.17 78.56 Favored 'General case' 0 CA--C 1.54 0.559 0 CA-C-N 116.523 -0.308 . . . . 53.44 111.659 176.659 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 23.5 mm-40 -64.63 -45.86 85.03 Favored 'General case' 0 N--CA 1.469 0.476 0 CA-C-O 121.224 0.535 . . . . 61.1 110.824 178.046 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 63.1 mt -58.43 -51.29 70.47 Favored 'General case' 0 CA--C 1.537 0.444 0 CA-C-N 115.8 -0.636 . . . . 62.45 110.887 176.907 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 56.7 mtmt -60.82 -31.19 70.61 Favored 'General case' 0 CA--C 1.54 0.592 0 CA-C-N 116.085 -0.507 . . . . 71.23 111.374 177.183 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER -64.57 -45.62 86.29 Favored 'General case' 0 CA--C 1.54 0.571 0 CA-C-N 116.206 -0.452 . . . . 72.45 110.621 177.387 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 42.1 mm-40 -66.11 -40.91 91.08 Favored 'General case' 0 CA--C 1.538 0.488 0 CA-C-O 120.995 0.426 . . . . 54.43 111.505 176.446 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 38' ' ' LEU . . . . . 0.436 HD11 ' HB3' ' A' ' 52' ' ' LEU . 94.5 mt -58.28 -53.67 55.61 Favored 'General case' 0 CA--C 1.538 0.483 0 N-CA-C 112.07 0.396 . . . . 61.35 112.07 178.547 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 39' ' ' LYS . . . . . 0.446 ' NZ ' ' HB3' ' A' ' 39' ' ' LYS . 0.5 OUTLIER -59.59 -31.97 69.96 Favored 'General case' 0 N--CA 1.472 0.649 0 N-CA-C 112.11 0.411 . . . . 64.1 112.11 -176.224 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 78.2 mt -68.26 -28.1 66.91 Favored 'General case' 0 N--CA 1.469 0.503 0 CA-C-O 121.038 0.447 . . . . 72.44 111.364 176.584 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 41' ' ' ARG . . . . . . . . . . . . . 53.1 mtt-85 -103.23 16.18 27.26 Favored 'General case' 0 CA--C 1.539 0.537 0 CA-C-N 116.368 -0.378 . . . . 71.01 111.663 -175.91 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 51.1 m 62.45 24.69 14.71 Favored 'General case' 0 N--CA 1.48 1.028 0 CA-C-O 121.144 0.497 . . . . 75.43 111.888 -179.475 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 78.1 mt -95.2 135.8 23.12 Favored Pre-proline 0 CA--C 1.542 0.65 0 CA-C-N 116.135 -0.484 . . . . 71.43 111.592 -179.039 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 44' ' ' PRO . . . . . 0.408 ' HG2' ' NH1' ' A' ' 55' ' ' ARG . 58.6 Cg_endo -70.98 143.56 45.3 Favored 'Trans proline' 0 CA--C 1.545 1.027 0 C-N-CA 122.752 2.301 . . . . 54.2 113.57 179.392 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 27.5 m -100.26 34.92 0.26 Allowed 'Isoleucine or valine' 0 N--CA 1.475 0.776 0 CA-C-O 121.389 0.614 . . . . 61.04 111.254 -179.718 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 37.3 m -74.94 -26.33 59.53 Favored 'General case' 0 N--CA 1.473 0.712 0 N-CA-C 114.009 1.115 . . . . 74.41 114.009 -169.371 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . -94.95 -171.95 37.24 Favored Glycine 0 CA--C 1.529 0.919 0 C-N-CA 120.655 -0.783 . . . . 73.35 114.522 -175.281 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 48' ' ' THR . . . . . 0.523 ' O ' ' HG ' ' A' ' 52' ' ' LEU . 81.3 p -84.77 179.67 7.29 Favored 'General case' 0 N--CA 1.471 0.584 0 C-N-CA 122.581 0.353 . . . . 64.42 111.273 178.097 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 49' ' ' LYS . . . . . 0.429 ' O ' HG13 ' A' ' 53' ' ' ILE . 87.4 tttt -46.23 -59.92 2.62 Favored 'General case' 0 N--CA 1.475 0.812 0 N-CA-C 112.32 0.489 . . . . 74.21 112.32 -178.384 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 50' ' ' THR . . . . . . . . . . . . . 94.9 m -58.62 -39.86 81.66 Favored 'General case' 0 N--CA 1.472 0.627 0 N-CA-C 111.869 0.322 . . . . 61.02 111.869 -178.845 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -57.44 -54.08 50.91 Favored 'General case' 0 CA--C 1.536 0.433 0 CA-C-O 120.924 0.392 . . . . 71.35 110.819 176.989 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 52' ' ' LEU . . . . . 0.523 ' HG ' ' O ' ' A' ' 48' ' ' THR . 42.6 mt -54.64 -41.42 70.04 Favored 'General case' 0 CA--C 1.538 0.495 0 CA-C-O 121.229 0.538 . . . . 53.32 111.088 178.969 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 53' ' ' ILE . . . . . 0.477 HG22 ' HD3' ' A' ' 57' ' ' ARG . 77.6 mt -62.16 -47.78 91.53 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.636 0 CA-C-N 115.946 -0.57 . . . . 72.24 111.258 176.711 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 36.6 mm-40 -62.5 -35.56 79.77 Favored 'General case' 0 N--CA 1.468 0.472 0 CA-C-N 116.471 -0.332 . . . . 72.33 111.506 177.387 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 55' ' ' ARG . . . . . 0.408 ' NH1' ' HG2' ' A' ' 44' ' ' PRO . 47.9 ttm-85 -65.08 -45.09 86.71 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-O 120.953 0.406 . . . . 72.33 110.995 178.009 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 81.9 mt -59.17 -48.49 81.4 Favored 'General case' 0 CA--C 1.537 0.479 0 CA-C-O 120.99 0.424 . . . . 73.23 110.918 174.76 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 57' ' ' ARG . . . . . 0.477 ' HD3' HG22 ' A' ' 53' ' ' ILE . 7.8 mtp85 -64.37 -41.16 96.87 Favored 'General case' 0 N--CA 1.471 0.597 0 CA-C-N 116.268 -0.424 . . . . 64.34 112.139 179.859 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -67.63 -30.64 70.26 Favored 'General case' 0 N--CA 1.469 0.479 0 CA-C-O 121.147 0.499 . . . . 64.24 111.514 177.92 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 59' ' ' TYR . . . . . . . . . . . . . 77.0 t80 -74.93 -44.47 48.43 Favored 'General case' 0 CA--C 1.539 0.527 0 CA-C-O 121.069 0.462 . . . . 74.34 110.986 175.956 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 60' ' ' GLN . . . . . . . . . . . . . 8.9 tp-100 -65.52 -36.39 83.7 Favored 'General case' 0 CA--C 1.537 0.449 0 CA-C-N 116.367 -0.379 . . . . 75.11 110.912 178.409 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 61' ' ' ASP . . . . . . . . . . . . . 14.9 t70 -49.27 -32.44 10.84 Favored 'General case' 0 CA--C 1.543 0.69 0 CA-C-O 121.35 0.595 . . . . 50.11 111.404 175.771 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 62' ' ' GLN . . . . . . . . . . . . . 60.8 mt-30 . . . . . 0 CA--C 1.543 0.696 0 CA-C-N 115.99 -0.55 . . . . 74.0 112.457 -176.923 . . . . . . . . 0 0 . 1 . 005 nuclear nobuild core ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 95.1 mt . . . . . 0 N--CA 1.468 0.431 0 CA-C-O 120.624 0.25 . . . . 71.12 111.503 . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild core ' A' A ' 23' ' ' PRO . . . . . 0.488 ' O ' ' HG ' ' A' ' 26' ' ' LEU . 72.3 Cg_endo -75.61 135.58 18.15 Favored 'Trans proline' 0 CA--C 1.539 0.763 0 C-N-CA 122.333 2.022 . . . . 51.45 112.478 177.31 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -59.41 -16.42 23.19 Favored 'General case' 0 CA--C 1.542 0.647 0 CA-C-O 121.151 0.5 . . . . 75.33 111.707 178.657 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 25' ' ' ASN . . . . . 0.405 ' O ' ' HG3' ' A' ' 29' ' ' MET . 17.5 m120 -71.94 -2.64 18.82 Favored 'General case' 0 CA--C 1.541 0.609 0 N-CA-C 113.171 0.804 . . . . 71.34 113.171 -179.565 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 26' ' ' LEU . . . . . 0.488 ' HG ' ' O ' ' A' ' 23' ' ' PRO . 89.4 mt -54.8 -31.64 59.25 Favored 'General case' 0 N--CA 1.474 0.744 0 CA-C-O 121.415 0.626 . . . . 74.12 110.531 174.392 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 13.3 t70 -62.09 -48.81 78.51 Favored 'General case' 0 CA--C 1.542 0.654 0 CA-C-N 115.697 -0.683 . . . . 74.43 110.901 173.09 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 20.7 m-20 -66.61 -35.37 80.03 Favored 'General case' 0 CA--C 1.543 0.698 0 CA-C-N 115.983 -0.553 . . . . 75.14 111.609 -179.877 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 29' ' ' MET . . . . . 0.445 ' SD ' HD23 ' A' ' 26' ' ' LEU . 83.6 mtp -62.01 146.87 48.9 Favored 'General case' 0 CA--C 1.537 0.463 0 CA-C-O 121.249 0.547 . . . . 62.31 111.935 -178.43 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 30' ' ' LYS . . . . . 0.585 ' HB2' ' HG2' ' A' ' 33' ' ' GLU . 22.1 mtpp -75.24 170.08 16.77 Favored 'General case' 0 CA--C 1.538 0.501 0 CA-C-N 115.76 -0.655 . . . . 62.01 111.682 -176.298 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 31' ' ' VAL . . . . . 0.499 HG12 ' HE3' ' A' ' 35' ' ' LYS . 45.7 t -60.48 -46.4 95.43 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.669 0 CA-C-N 116.017 -0.538 . . . . 71.42 111.796 -177.354 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -63.99 -36.66 84.71 Favored 'General case' 0 N--CA 1.47 0.532 0 N-CA-C 112.069 0.396 . . . . 51.35 112.069 -179.785 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 33' ' ' GLU . . . . . 0.585 ' HG2' ' HB2' ' A' ' 30' ' ' LYS . 3.3 mm-40 -64.21 -45.65 87.32 Favored 'General case' 0 N--CA 1.471 0.578 0 CA-C-O 121.076 0.465 . . . . 64.23 110.806 -179.032 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 87.6 mt -59.4 -44.57 92.79 Favored 'General case' 0 CA--C 1.539 0.543 0 CA-C-N 116.032 -0.531 . . . . 62.32 110.903 177.607 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 35' ' ' LYS . . . . . 0.499 ' HE3' HG12 ' A' ' 31' ' ' VAL . 99.2 mttt -59.35 -35.87 74.68 Favored 'General case' 0 N--CA 1.469 0.488 0 CA-C-N 116.267 -0.424 . . . . 75.01 111.36 176.101 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 36' ' ' GLN . . . . . 0.513 ' O ' ' HG ' ' A' ' 40' ' ' LEU . 54.4 tp60 -59.69 -43.93 93.85 Favored 'General case' 0 CA--C 1.535 0.392 0 CA-C-N 116.371 -0.377 . . . . 71.23 111.217 178.916 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 37' ' ' GLU . . . . . 0.479 ' O ' ' HG3' ' A' ' 41' ' ' ARG . 35.1 mt-10 -67.63 -42.76 81.8 Favored 'General case' 0 CA--C 1.537 0.464 0 C-N-CA 121.082 -0.247 . . . . 75.15 111.224 176.33 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 38' ' ' LEU . . . . . . . . . . . . . 78.7 mt -52.07 -58.84 5.35 Favored 'General case' 0 N--CA 1.472 0.673 0 N-CA-C 111.863 0.32 . . . . 73.34 111.863 177.295 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 39' ' ' LYS . . . . . 0.409 ' HG2' ' O ' ' A' ' 36' ' ' GLN . 16.1 ptpt -55.98 -36.63 68.07 Favored 'General case' 0 N--CA 1.473 0.692 0 N-CA-C 111.891 0.33 . . . . 75.43 111.891 -177.999 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 40' ' ' LEU . . . . . 0.513 ' HG ' ' O ' ' A' ' 36' ' ' GLN . 92.3 mt -68.72 -29.76 68.26 Favored 'General case' 0 CA--C 1.538 0.501 0 CA-C-O 121.015 0.436 . . . . 73.13 111.33 178.083 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 41' ' ' ARG . . . . . 0.479 ' HG3' ' O ' ' A' ' 37' ' ' GLU . 53.9 mtt-85 -96.01 16.04 18.98 Favored 'General case' 0 CA--C 1.541 0.617 0 CA-C-N 116.327 -0.397 . . . . 75.41 111.454 -179.921 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 50.5 m 65.66 27.52 11.35 Favored 'General case' 0 N--CA 1.48 1.067 0 CA-C-O 121.356 0.598 . . . . 61.42 112.154 178.268 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 49.1 mt -102.28 144.75 29.22 Favored Pre-proline 0 CA--C 1.544 0.734 0 CA-C-N 116.192 -0.458 . . . . 75.12 111.385 -179.916 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 44' ' ' PRO . . . . . . . . . . . . . 57.6 Cg_endo -70.13 123.84 10.36 Favored 'Trans proline' 0 CA--C 1.542 0.888 0 C-N-CA 122.479 2.12 . . . . 70.33 112.944 178.802 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 28.3 m -82.27 -15.04 12.11 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.596 0 N-CA-C 112.853 0.686 . . . . 71.15 112.853 -174.598 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 65.9 m -71.18 79.56 0.7 Allowed 'General case' 0 N--CA 1.472 0.658 0 N-CA-C 112.358 0.503 . . . . 61.22 112.358 -178.272 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . -158.05 173.41 35.27 Favored Glycine 0 CA--C 1.526 0.764 0 C-N-CA 121.239 -0.505 . . . . 74.5 113.193 177.404 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 48' ' ' THR . . . . . 0.539 ' O ' ' HG ' ' A' ' 52' ' ' LEU . 72.3 p -77.58 158.53 29.78 Favored 'General case' 0 N--CA 1.474 0.739 0 O-C-N 122.779 -0.248 . . . . 51.33 110.715 176.808 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 60.0 tttm -49.04 -40.95 33.31 Favored 'General case' 0 N--CA 1.476 0.846 0 CA-C-O 120.729 0.299 . . . . 64.32 111.596 -177.228 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 50' ' ' THR . . . . . 0.464 ' O ' ' HG2' ' A' ' 54' ' ' GLU . 89.2 m -60.63 -54.77 41.32 Favored 'General case' 0 N--CA 1.469 0.481 0 CA-C-O 120.818 0.342 . . . . 71.35 110.96 174.714 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 10.0 mm-40 -54.5 -35.15 62.81 Favored 'General case' 0 N--CA 1.47 0.541 0 CA-C-N 116.22 -0.445 . . . . 72.41 111.971 -179.564 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 52' ' ' LEU . . . . . 0.539 ' HG ' ' O ' ' A' ' 48' ' ' THR . 46.5 mt -62.36 -49.77 74.24 Favored 'General case' 0 CA--C 1.537 0.466 0 CA-C-O 120.977 0.418 . . . . 72.5 110.912 177.962 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 53' ' ' ILE . . . . . 0.512 ' O ' ' HG3' ' A' ' 57' ' ' ARG . 66.6 mt -60.71 -51.61 71.13 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.481 0 CA-C-N 116.149 -0.478 . . . . 74.12 110.847 177.757 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 54' ' ' GLU . . . . . 0.464 ' HG2' ' O ' ' A' ' 50' ' ' THR . 7.5 mm-40 -55.54 -40.75 72.26 Favored 'General case' 0 N--CA 1.47 0.548 0 CA-C-O 121.155 0.503 . . . . 74.51 111.205 178.778 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 23.7 ttm180 -67.37 -38.6 85.0 Favored 'General case' 0 CA--C 1.536 0.428 0 CA-C-N 116.048 -0.524 . . . . 71.44 111.333 -178.685 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 89.7 mt -60.63 -41.45 94.92 Favored 'General case' 0 CA--C 1.535 0.401 0 CA-C-O 120.916 0.388 . . . . 65.22 110.555 172.292 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 57' ' ' ARG . . . . . 0.512 ' HG3' ' O ' ' A' ' 53' ' ' ILE . 44.2 mtm180 -60.98 -53.99 50.42 Favored 'General case' 0 C--O 1.221 -0.41 0 CA-C-N 116.29 -0.413 . . . . 72.45 111.018 177.902 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 58' ' ' ALA . . . . . 0.437 ' O ' ' HG3' ' A' ' 62' ' ' GLN . . . -49.74 -48.82 49.85 Favored 'General case' 0 N--CA 1.471 0.582 0 N-CA-C 112.302 0.482 . . . . 71.24 112.302 -178.518 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 59' ' ' TYR . . . . . 0.455 ' HA ' HE21 ' A' ' 62' ' ' GLN . 70.1 t80 -57.63 -56.83 16.79 Favored 'General case' 0 CA--C 1.54 0.587 0 CA-C-O 120.94 0.4 . . . . 64.42 111.714 178.022 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 60' ' ' GLN . . . . . . . . . . . . . 25.7 tm0? -66.47 -31.99 73.08 Favored 'General case' 0 CA--C 1.545 0.774 0 CA-C-N 116.131 -0.486 . . . . 62.23 111.485 -176.825 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 61' ' ' ASP . . . . . . . . . . . . . 32.6 t70 -64.34 -30.29 71.34 Favored 'General case' 0 CA--C 1.541 0.616 0 C-N-CA 123.267 0.627 . . . . 75.33 112.032 -177.622 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 62' ' ' GLN . . . . . 0.455 HE21 ' HA ' ' A' ' 59' ' ' TYR . 47.2 mt-30 . . . . . 0 N--CA 1.472 0.652 0 CA-C-O 120.93 0.395 . . . . 74.13 111.61 179.712 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 22' ' ' LEU . . . . . 0.446 ' HG ' ' HG3' ' A' ' 60' ' ' GLN . 95.9 mt . . . . . 0 N--CA 1.471 0.615 0 CA-C-O 120.619 0.247 . . . . 75.33 111.378 . . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 23' ' ' PRO . . . . . 0.412 ' HD2' HD21 ' A' ' 26' ' ' LEU . 39.3 Cg_exo -62.44 140.41 81.97 Favored 'Trans proline' 0 CA--C 1.543 0.97 0 C-N-CA 122.195 1.93 . . . . 73.43 112.249 171.562 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -60.66 -55.35 34.32 Favored 'General case' 0 CA--C 1.541 0.6 0 N-CA-C 112.235 0.458 . . . . 75.14 112.235 -178.907 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 61.7 m-20 -91.84 84.84 5.44 Favored 'General case' 0 CA--C 1.536 0.43 0 CA-C-O 120.914 0.388 . . . . 71.15 111.813 -177.021 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 26' ' ' LEU . . . . . 0.412 HD21 ' HD2' ' A' ' 23' ' ' PRO . 98.6 mt -84.12 -32.98 24.42 Favored 'General case' 0 CA--C 1.538 0.496 0 CA-C-O 120.881 0.372 . . . . 62.21 111.062 176.886 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 4.7 m-20 -66.29 -40.81 90.29 Favored 'General case' 0 CA--C 1.538 0.517 0 CA-C-N 116.308 -0.406 . . . . 64.51 111.562 -179.898 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 1.9 m-20 -60.39 -44.65 95.46 Favored 'General case' 0 CA--C 1.538 0.494 0 CA-C-N 116.21 -0.45 . . . . 65.33 112.05 179.506 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 29' ' ' MET . . . . . . . . . . . . . 59.0 mtm -66.46 157.48 31.94 Favored 'General case' 0 CA--C 1.54 0.573 0 CA-C-O 120.995 0.426 . . . . 63.24 111.429 179.874 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 30' ' ' LYS . . . . . 0.477 ' HB2' ' HG2' ' A' ' 33' ' ' GLU . 46.5 mtmt -78.71 160.88 27.25 Favored 'General case' 0 N--CA 1.47 0.551 0 CA-C-O 120.978 0.418 . . . . 74.51 111.902 -174.659 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 31' ' ' VAL . . . . . 0.411 HG12 ' HE3' ' A' ' 35' ' ' LYS . 47.9 t -54.8 -40.34 51.76 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.547 0 CA-C-O 121.19 0.519 . . . . 72.11 110.941 177.011 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -59.59 -39.44 84.18 Favored 'General case' 0 CA--C 1.54 0.565 0 CA-C-N 116.043 -0.526 . . . . 41.2 111.656 176.834 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 33' ' ' GLU . . . . . 0.477 ' HG2' ' HB2' ' A' ' 30' ' ' LYS . 45.8 mm-40 -64.27 -45.89 86.11 Favored 'General case' 0 CA--C 1.537 0.444 0 CA-C-O 121.195 0.522 . . . . 62.01 110.559 178.134 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 94.3 mt -59.5 -40.78 88.16 Favored 'General case' 0 N--CA 1.468 0.442 0 CA-C-N 115.963 -0.562 . . . . 72.12 111.484 178.597 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 35' ' ' LYS . . . . . 0.436 ' HA ' HD12 ' A' ' 38' ' ' LEU . 99.6 mttt -61.6 -36.93 82.11 Favored 'General case' 0 CA--C 1.538 0.517 0 CA-C-O 121.022 0.439 . . . . 60.42 111.428 177.082 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 36' ' ' GLN . . . . . 0.428 ' O ' ' HG2' ' A' ' 39' ' ' LYS . 8.4 tm0? -63.58 -42.38 98.3 Favored 'General case' 0 CA--C 1.539 0.555 0 CA-C-O 121.105 0.479 . . . . 74.43 110.748 174.357 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 37' ' ' GLU . . . . . 0.447 ' HA ' HH21 ' A' ' 41' ' ' ARG . 18.0 mm-40 -65.16 -40.52 94.44 Favored 'General case' 0 CA--C 1.541 0.6 0 CA-C-N 116.437 -0.347 . . . . 73.24 111.775 175.433 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 38' ' ' LEU . . . . . 0.516 HD11 HD22 ' A' ' 52' ' ' LEU . 86.0 mt -57.0 -52.74 64.06 Favored 'General case' 0 N--CA 1.468 0.464 0 N-CA-C 112.142 0.423 . . . . 73.1 112.142 179.377 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 39' ' ' LYS . . . . . 0.428 ' HG2' ' O ' ' A' ' 36' ' ' GLN . 17.6 ptpt -58.3 -33.92 69.98 Favored 'General case' 0 CA--C 1.542 0.64 0 CA-C-O 120.757 0.313 . . . . 75.54 111.737 -178.135 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 65.4 mt -69.06 -22.5 64.02 Favored 'General case' 0 N--CA 1.471 0.615 0 CA-C-O 121.016 0.436 . . . . 62.14 111.373 176.119 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 41' ' ' ARG . . . . . 0.447 HH21 ' HA ' ' A' ' 37' ' ' GLU . 0.6 OUTLIER -101.8 14.16 32.77 Favored 'General case' 0 CA--C 1.543 0.687 0 CA-C-N 116.12 -0.491 . . . . 72.1 111.415 178.354 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 62.5 m 63.01 18.84 11.24 Favored 'General case' 0 N--CA 1.48 1.058 0 CA-C-O 121.107 0.48 . . . . 72.23 112.237 -179.178 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 43' ' ' LEU . . . . . 0.402 HD22 ' HG2' ' A' ' 55' ' ' ARG . 76.3 mt -93.14 146.64 32.32 Favored Pre-proline 0 CA--C 1.542 0.64 0 C-N-CA 122.714 0.406 . . . . 72.03 111.526 -179.131 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 44' ' ' PRO . . . . . . . . . . . . . 73.8 Cg_endo -73.26 145.51 38.88 Favored 'Trans proline' 0 CA--C 1.541 0.841 0 C-N-CA 122.58 2.187 . . . . 61.43 112.799 178.092 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 34.1 m -88.93 19.08 0.59 Allowed 'Isoleucine or valine' 0 CA--C 1.544 0.733 0 N-CA-C 112.583 0.586 . . . . 74.41 112.583 -175.439 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 46.7 t -100.49 104.15 15.52 Favored 'General case' 0 N--CA 1.475 0.787 0 CA-C-O 120.814 0.34 . . . . 51.34 111.724 -177.929 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 171.24 -175.22 44.9 Favored Glycine 0 CA--C 1.527 0.817 0 C-N-CA 121.052 -0.594 . . . . 54.31 113.417 178.844 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 48' ' ' THR . . . . . 0.548 ' O ' ' HG ' ' A' ' 52' ' ' LEU . 43.8 p -96.98 169.2 9.99 Favored 'General case' 0 N--CA 1.472 0.666 0 O-C-N 122.661 -0.317 . . . . 63.44 111.537 -179.957 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 49' ' ' LYS . . . . . 0.404 ' HD3' HG22 ' A' ' 31' ' ' VAL . 21.4 tptm -50.16 -55.22 15.97 Favored 'General case' 0 N--CA 1.473 0.683 0 N-CA-C 111.924 0.342 . . . . 63.45 111.924 -179.686 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 50' ' ' THR . . . . . 0.44 ' O ' ' HG2' ' A' ' 54' ' ' GLU . 91.5 m -63.64 -43.77 95.82 Favored 'General case' 0 N--CA 1.471 0.583 0 CA-C-O 120.791 0.329 . . . . 75.2 111.536 178.049 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 51' ' ' GLU . . . . . 0.424 ' HB2' ' OG1' ' A' ' 48' ' ' THR . 2.6 tm-20 -55.19 -54.74 39.53 Favored 'General case' 0 CA--C 1.539 0.557 0 C-N-CA 122.896 0.478 . . . . 64.01 111.838 -177.656 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 52' ' ' LEU . . . . . 0.548 ' HG ' ' O ' ' A' ' 48' ' ' THR . 40.8 mt -55.12 -39.39 69.34 Favored 'General case' 0 N--CA 1.471 0.583 0 CA-C-O 120.902 0.382 . . . . 75.43 111.851 -177.15 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 53' ' ' ILE . . . . . . . . . . . . . 77.9 mt -61.41 -45.01 99.5 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.442 0 CA-C-O 121.31 0.576 . . . . 73.21 110.821 175.364 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 54' ' ' GLU . . . . . 0.477 ' CD ' HH21 ' A' ' 57' ' ' ARG . 8.9 mm-40 -64.93 -35.45 81.2 Favored 'General case' 0 N--CA 1.468 0.426 0 CA-C-N 115.772 -0.649 . . . . 63.35 111.207 179.064 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 55' ' ' ARG . . . . . 0.447 HH11 ' HD3' ' A' ' 55' ' ' ARG . 13.2 ttm180 -68.61 -39.76 80.69 Favored 'General case' 0 CA--C 1.541 0.599 0 CA-C-N 116.16 -0.473 . . . . 72.03 110.647 178.165 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 59.1 mt -59.75 -53.23 60.34 Favored 'General case' 0 N--CA 1.47 0.559 0 CA-C-N 116.293 -0.412 . . . . 72.14 111.228 174.138 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 57' ' ' ARG . . . . . 0.477 HH21 ' CD ' ' A' ' 54' ' ' GLU . 40.5 mtm105 -57.38 -45.89 83.97 Favored 'General case' 0 CA--C 1.537 0.47 0 CA-C-O 120.687 0.279 . . . . 75.04 111.442 179.594 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 58' ' ' ALA . . . . . 0.427 ' O ' ' HG3' ' A' ' 62' ' ' GLN . . . -60.33 -34.39 73.75 Favored 'General case' 0 N--CA 1.47 0.531 0 N-CA-C 112.115 0.413 . . . . 51.03 112.115 -179.624 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 59' ' ' TYR . . . . . . . . . . . . . 71.2 t80 -75.27 -54.17 7.53 Favored 'General case' 0 CA--C 1.539 0.549 0 CA-C-O 120.962 0.411 . . . . 74.22 111.555 179.176 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 60' ' ' GLN . . . . . 0.446 ' HG3' ' HG ' ' A' ' 22' ' ' LEU . 24.4 tm0? -60.26 -32.57 71.29 Favored 'General case' 0 CA--C 1.542 0.66 0 CA-C-O 120.923 0.392 . . . . 73.31 111.072 -177.865 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 61' ' ' ASP . . . . . . . . . . . . . 15.8 t70 -57.53 -29.96 64.79 Favored 'General case' 0 CA--C 1.545 0.756 0 C-N-CA 122.977 0.511 . . . . 70.53 111.909 175.169 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 62' ' ' GLN . . . . . 0.427 ' HG3' ' O ' ' A' ' 58' ' ' ALA . 68.9 mt-30 . . . . . 0 N--CA 1.473 0.68 0 CA-C-O 120.889 0.376 . . . . 64.33 112.002 -177.487 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 22' ' ' LEU . . . . . 0.542 ' HG ' ' HG3' ' A' ' 60' ' ' GLN . 97.2 mt . . . . . 0 CA--C 1.539 0.527 0 N-CA-C 111.83 0.308 . . . . 73.33 111.83 . . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 23' ' ' PRO . . . . . 0.449 ' O ' ' HG ' ' A' ' 26' ' ' LEU . 39.8 Cg_endo -67.82 120.7 7.71 Favored 'Trans proline' 0 CA--C 1.539 0.735 0 C-N-CA 122.186 1.924 . . . . 71.42 111.715 174.409 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -57.06 -11.95 1.84 Allowed 'General case' 0 N--CA 1.475 0.798 0 N-CA-C 112.861 0.689 . . . . 52.3 112.861 -177.201 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 25' ' ' ASN . . . . . 0.544 ' HB3' ' HB2' ' A' ' 28' ' ' ASP . 18.8 m120 -92.38 33.76 1.08 Allowed 'General case' 0 CA--C 1.542 0.651 0 N-CA-C 112.265 0.468 . . . . 72.43 112.265 179.408 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 26' ' ' LEU . . . . . 0.449 ' HG ' ' O ' ' A' ' 23' ' ' PRO . 95.6 mt -54.23 -33.16 57.73 Favored 'General case' 0 N--CA 1.474 0.762 0 CA-C-O 120.785 0.326 . . . . 72.34 111.859 -179.671 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 11.3 m-20 -69.15 -38.94 79.04 Favored 'General case' 0 N--CA 1.47 0.548 0 CA-C-O 120.826 0.346 . . . . 73.53 111.554 175.159 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 28' ' ' ASP . . . . . 0.544 ' HB2' ' HB3' ' A' ' 25' ' ' ASN . 6.3 m-20 -69.64 -32.61 71.38 Favored 'General case' 0 CA--C 1.539 0.549 0 CA-C-N 116.285 -0.416 . . . . 55.01 111.319 179.057 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 29' ' ' MET . . . . . . . . . . . . . 84.2 mtp -66.32 140.33 58.1 Favored 'General case' 0 N--CA 1.468 0.426 0 CA-C-O 121.001 0.429 . . . . 74.53 111.307 178.82 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 55.1 mtmt -79.1 158.94 27.7 Favored 'General case' 0 CA--C 1.541 0.605 0 CA-C-O 120.945 0.403 . . . . 72.33 111.899 -177.892 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 94.9 t -49.58 -49.26 19.45 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.7 0 N-CA-C 112.842 0.682 . . . . 51.34 112.842 -176.097 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -57.92 -37.69 74.53 Favored 'General case' 0 N--CA 1.469 0.524 0 CA-C-O 120.855 0.359 . . . . 70.24 111.591 179.657 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 40.6 mt-10 -65.84 -48.55 71.26 Favored 'General case' 0 N--CA 1.466 0.338 0 CA-C-N 116.214 -0.448 . . . . 73.54 111.172 178.347 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 91.5 mt -58.55 -45.37 89.07 Favored 'General case' 0 N--CA 1.469 0.477 0 CA-C-O 120.965 0.412 . . . . 74.24 111.293 178.25 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 35' ' ' LYS . . . . . 0.499 ' HA ' HD12 ' A' ' 38' ' ' LEU . 98.0 mttt -62.83 -31.28 72.25 Favored 'General case' 0 CA--C 1.54 0.592 0 CA-C-O 121.003 0.43 . . . . 74.34 111.565 177.159 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 36' ' ' GLN . . . . . 0.407 ' O ' ' HG ' ' A' ' 40' ' ' LEU . 23.7 tm0? -70.05 -43.91 70.24 Favored 'General case' 0 CA--C 1.542 0.656 0 CA-C-O 121.06 0.457 . . . . 54.45 109.85 175.192 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 37' ' ' GLU . . . . . 0.474 ' HB3' ' NH2' ' A' ' 41' ' ' ARG . 52.8 mm-40 -58.15 -32.66 68.39 Favored 'General case' 0 N--CA 1.473 0.682 0 CA-C-N 115.945 -0.571 . . . . 63.42 111.86 174.436 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 38' ' ' LEU . . . . . 0.499 HD12 ' HA ' ' A' ' 35' ' ' LYS . 99.1 mt -69.45 -58.23 4.25 Favored 'General case' 0 CA--C 1.539 0.547 0 CA-C-N 116.289 -0.414 . . . . 53.1 111.913 178.116 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 39' ' ' LYS . . . . . 0.4 ' HB3' ' NZ ' ' A' ' 39' ' ' LYS . 0.3 OUTLIER -57.83 -31.62 66.82 Favored 'General case' 0 N--CA 1.474 0.741 0 N-CA-C 112.373 0.508 . . . . 75.41 112.373 -174.059 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 40' ' ' LEU . . . . . 0.407 ' HG ' ' O ' ' A' ' 36' ' ' GLN . 95.9 mt -58.96 -35.2 72.76 Favored 'General case' 0 N--CA 1.474 0.74 0 CA-C-O 121.18 0.514 . . . . 74.04 111.764 176.908 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 41' ' ' ARG . . . . . 0.508 ' HB3' ' CE2' ' A' ' 59' ' ' TYR . 16.5 mtm180 -114.21 34.25 4.79 Favored 'General case' 0 CA--C 1.54 0.573 0 CA-C-N 116.034 -0.53 . . . . 74.32 112.366 -173.505 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 32.4 t 69.05 10.17 7.77 Favored 'General case' 0 N--CA 1.479 0.99 0 N-CA-C 113.048 0.759 . . . . 72.24 113.048 172.482 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 43' ' ' LEU . . . . . 0.428 HD22 ' HG2' ' A' ' 55' ' ' ARG . 83.4 mt -88.8 142.0 30.28 Favored Pre-proline 0 CA--C 1.543 0.676 0 N-CA-C 112.126 0.417 . . . . 32.54 112.126 -177.562 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 44' ' ' PRO . . . . . 0.49 ' HG2' HH11 ' A' ' 55' ' ' ARG . 75.6 Cg_endo -76.05 143.38 25.81 Favored 'Trans proline' 0 CA--C 1.544 0.988 0 C-N-CA 123.036 2.491 . . . . 53.2 113.362 178.754 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 25.8 m -97.57 -0.05 10.47 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.711 0 N-CA-C 112.716 0.636 . . . . 53.53 112.716 -176.006 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 19.7 p -79.83 45.89 0.74 Allowed 'General case' 0 N--CA 1.475 0.806 0 N-CA-C 112.866 0.691 . . . . 64.41 112.866 -176.258 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . -131.54 173.77 20.35 Favored Glycine 0 CA--C 1.531 1.032 0 C-N-CA 121.079 -0.582 . . . . 63.42 113.6 179.607 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 48' ' ' THR . . . . . 0.59 ' O ' ' HG ' ' A' ' 52' ' ' LEU . 68.7 p -81.43 173.45 12.42 Favored 'General case' 0 N--CA 1.473 0.7 0 C-N-CA 122.487 0.315 . . . . 74.03 111.287 177.548 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 24.3 tptm -50.17 -50.38 49.35 Favored 'General case' 0 N--CA 1.473 0.709 0 CA-C-O 120.829 0.347 . . . . 75.5 111.599 -179.871 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 50' ' ' THR . . . . . . . . . . . . . 86.5 m -62.84 -39.93 95.88 Favored 'General case' 0 N--CA 1.47 0.542 0 CA-C-N 116.351 -0.386 . . . . 34.35 111.368 177.365 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 61.4 mm-40 -61.06 -42.2 98.05 Favored 'General case' 0 N--CA 1.469 0.501 0 N-CA-C 111.892 0.33 . . . . 71.34 111.892 178.423 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 52' ' ' LEU . . . . . 0.59 ' HG ' ' O ' ' A' ' 48' ' ' THR . 31.4 mt -58.16 -49.84 75.62 Favored 'General case' 0 CA--C 1.538 0.519 0 CA-C-O 121.323 0.582 . . . . 51.15 110.294 177.999 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 53' ' ' ILE . . . . . 0.466 ' O ' ' HG3' ' A' ' 57' ' ' ARG . 72.5 mt -63.4 -55.71 21.42 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.666 0 CA-C-N 115.623 -0.717 . . . . 64.34 111.944 179.704 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 15.3 mm-40 -59.39 -42.36 91.55 Favored 'General case' 0 N--CA 1.472 0.663 0 N-CA-C 112.233 0.457 . . . . 72.22 112.233 -177.96 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 55' ' ' ARG . . . . . 0.49 HH11 ' HG2' ' A' ' 44' ' ' PRO . 10.5 ttm180 -66.11 -35.23 79.95 Favored 'General case' 0 CA--C 1.539 0.553 0 CA-C-O 120.892 0.377 . . . . 65.12 110.792 -178.743 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 45.8 mt -63.04 -51.48 66.57 Favored 'General case' 0 N--CA 1.469 0.507 0 CA-C-N 116.355 -0.384 . . . . 75.42 111.254 172.696 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 57' ' ' ARG . . . . . 0.466 ' HG3' ' O ' ' A' ' 53' ' ' ILE . 29.3 mtp-105 -58.53 -51.66 68.96 Favored 'General case' 0 N--CA 1.47 0.549 0 CA-C-N 116.424 -0.353 . . . . 74.24 111.647 -177.041 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -57.8 -53.21 60.78 Favored 'General case' 0 CA--C 1.539 0.553 0 CA-C-N 116.297 -0.411 . . . . 71.34 111.893 -179.702 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 59' ' ' TYR . . . . . 0.508 ' CE2' ' HB3' ' A' ' 41' ' ' ARG . 72.1 t80 -57.59 -58.68 7.26 Favored 'General case' 0 N--CA 1.471 0.58 0 CA-C-O 121.041 0.448 . . . . 73.22 111.778 179.772 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 60' ' ' GLN . . . . . 0.542 ' HG3' ' HG ' ' A' ' 22' ' ' LEU . 0.6 OUTLIER -56.69 -31.38 64.41 Favored 'General case' 0 CA--C 1.546 0.819 0 CA-C-N 116.147 -0.478 . . . . 74.34 111.349 -175.278 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 61' ' ' ASP . . . . . . . . . . . . . 17.8 t70 -79.35 -45.77 18.95 Favored 'General case' 0 CA--C 1.542 0.657 0 CA-C-O 120.862 0.363 . . . . 45.22 111.884 -179.865 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 62' ' ' GLN . . . . . . . . . . . . . 3.4 pt20 . . . . . 0 CA--C 1.542 0.655 0 N-CA-C 112.455 0.539 . . . . 70.41 112.455 -174.654 . . . . . . . . 0 0 . 1 . 008 nuclear nobuild core ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 92.9 mt . . . . . 0 CA--C 1.544 0.75 0 N-CA-C 110.441 -0.207 . . . . 72.33 110.441 . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild core ' A' A ' 23' ' ' PRO . . . . . . . . . . . . . 35.9 Cg_endo -65.99 131.87 28.42 Favored 'Trans proline' 0 CA--C 1.544 0.978 0 C-N-CA 122.042 1.828 . . . . 71.1 112.283 174.859 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -68.08 -27.94 66.93 Favored 'General case' 0 N--CA 1.472 0.643 0 N-CA-C 112.266 0.469 . . . . 73.3 112.266 -177.02 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 19.6 m120 -87.18 52.41 2.5 Favored 'General case' 0 CA--C 1.539 0.543 0 CA-C-O 121.058 0.456 . . . . 63.42 112.056 -179.799 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 26' ' ' LEU . . . . . 0.456 ' HB2' HG23 ' A' ' 53' ' ' ILE . 87.5 mt -60.75 -27.71 68.15 Favored 'General case' 0 N--CA 1.469 0.518 0 CA-C-O 121.251 0.548 . . . . 62.24 110.662 173.835 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 7.6 p-10 -67.82 -28.91 67.98 Favored 'General case' 0 CA--C 1.54 0.579 0 CA-C-N 115.836 -0.62 . . . . 74.21 111.63 176.69 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 26.0 t70 -76.7 -39.71 51.12 Favored 'General case' 0 CA--C 1.54 0.578 0 CA-C-N 116.463 -0.335 . . . . 74.43 111.776 -178.963 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 29' ' ' MET . . . . . . . . . . . . . 58.6 mtm -68.56 157.62 35.65 Favored 'General case' 0 N--CA 1.471 0.614 0 CA-C-O 121.549 0.69 . . . . 65.55 112.366 -177.398 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 30' ' ' LYS . . . . . 0.44 ' HB2' ' HG2' ' A' ' 33' ' ' GLU . 50.5 mtmt -69.92 156.58 38.88 Favored 'General case' 0 CA--C 1.539 0.524 0 CA-C-N 115.535 -0.757 . . . . 75.51 112.138 -179.289 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 42.2 t -54.51 -42.71 60.79 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.561 0 CA-C-N 116.12 -0.491 . . . . 70.04 111.273 178.039 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -60.87 -33.74 73.54 Favored 'General case' 0 CA--C 1.54 0.57 0 CA-C-N 116.061 -0.518 . . . . 62.45 111.778 177.913 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 33' ' ' GLU . . . . . 0.44 ' HG2' ' HB2' ' A' ' 30' ' ' LYS . 36.9 mm-40 -67.37 -45.01 77.54 Favored 'General case' 0 N--CA 1.468 0.441 0 CA-C-O 121.122 0.487 . . . . 73.34 110.662 177.185 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 63.4 mt -58.75 -48.3 81.66 Favored 'General case' 0 CA--C 1.537 0.459 0 CA-C-N 115.954 -0.566 . . . . 75.33 110.973 177.481 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 35' ' ' LYS . . . . . 0.418 ' HA ' HD12 ' A' ' 38' ' ' LEU . 98.7 mttt -63.1 -29.6 70.94 Favored 'General case' 0 CA--C 1.54 0.564 0 CA-C-N 116.182 -0.463 . . . . 65.21 111.603 176.964 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 36' ' ' GLN . . . . . 0.553 ' HA ' ' HE3' ' A' ' 39' ' ' LYS . 56.8 tp60 -65.5 -49.72 67.95 Favored 'General case' 0 CA--C 1.537 0.474 0 CA-C-O 121.011 0.434 . . . . 73.34 110.654 174.701 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 7.8 mm-40 -63.45 -21.84 66.53 Favored 'General case' 0 CA--C 1.545 0.759 0 CA-C-O 121.128 0.49 . . . . 75.43 111.621 178.794 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 38' ' ' LEU . . . . . 0.46 ' CD1' HD22 ' A' ' 52' ' ' LEU . 94.8 mt -75.65 -56.24 4.88 Favored 'General case' 0 CA--C 1.539 0.531 0 CA-C-N 116.445 -0.343 . . . . 75.34 111.583 174.736 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 39' ' ' LYS . . . . . 0.553 ' HE3' ' HA ' ' A' ' 36' ' ' GLN . 17.0 ptpt -57.64 -35.96 71.21 Favored 'General case' 0 CA--C 1.543 0.682 0 CA-C-O 120.7 0.286 . . . . 74.32 111.682 -176.727 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 40' ' ' LEU . . . . . 0.469 ' HG ' ' O ' ' A' ' 36' ' ' GLN . 88.3 mt -66.32 -23.56 66.39 Favored 'General case' 0 N--CA 1.472 0.673 0 N-CA-C 111.855 0.317 . . . . 75.4 111.855 -179.793 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 41' ' ' ARG . . . . . 0.784 HH22 ' HA ' ' A' ' 56' ' ' LEU . 52.5 mtm180 -114.07 15.41 18.35 Favored 'General case' 0 CA--C 1.541 0.629 0 N-CA-C 111.987 0.366 . . . . 72.33 111.987 -176.612 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 33.3 t 63.23 73.68 0.45 Allowed 'General case' 0 N--CA 1.477 0.892 0 CA-C-O 121.146 0.498 . . . . 74.12 111.896 -179.056 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 43' ' ' LEU . . . . . 0.425 HD21 ' CD2' ' A' ' 59' ' ' TYR . 68.3 mt -144.3 143.74 23.21 Favored Pre-proline 0 N--CA 1.47 0.557 0 CA-C-N 116.183 -0.462 . . . . 63.14 111.616 -177.773 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 44' ' ' PRO . . . . . . . . . . . . . 56.7 Cg_endo -69.54 127.62 15.03 Favored 'Trans proline' 0 CA--C 1.543 0.933 0 C-N-CA 122.704 2.269 . . . . 74.03 113.09 178.868 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 33.6 m -96.91 23.05 0.94 Allowed 'Isoleucine or valine' 0 CA--C 1.544 0.736 0 CA-C-O 120.978 0.418 . . . . 64.11 112.068 -177.226 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 54.0 m -84.73 -8.33 58.88 Favored 'General case' 0 N--CA 1.477 0.917 0 N-CA-C 113.206 0.817 . . . . 53.21 113.206 -175.023 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . -87.3 170.74 41.3 Favored Glycine 0 CA--C 1.531 1.046 0 C-N-CA 120.928 -0.653 . . . . 73.34 113.824 -176.485 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 48' ' ' THR . . . . . 0.606 ' O ' ' HG ' ' A' ' 52' ' ' LEU . 63.1 p -77.31 167.69 21.29 Favored 'General case' 0 N--CA 1.477 0.91 0 O-C-N 122.637 -0.331 . . . . 64.12 111.359 177.511 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 65.0 tttm -48.37 -48.34 36.75 Favored 'General case' 0 N--CA 1.476 0.825 0 N-CA-C 112.357 0.503 . . . . 72.53 112.357 -176.364 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 50' ' ' THR . . . . . . . . . . . . . 87.3 m -64.55 -39.75 94.32 Favored 'General case' 0 N--CA 1.474 0.743 0 CA-C-O 120.949 0.404 . . . . 64.24 111.904 178.748 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 43.5 mt-10 -64.88 -40.71 95.54 Favored 'General case' 0 N--CA 1.472 0.634 0 CA-C-O 120.86 0.362 . . . . 71.12 111.331 177.933 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 52' ' ' LEU . . . . . 0.606 ' HG ' ' O ' ' A' ' 48' ' ' THR . 47.7 mt -58.34 -50.99 71.67 Favored 'General case' 0 CA--C 1.535 0.398 0 CA-C-O 121.082 0.468 . . . . 73.04 110.024 176.754 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 53' ' ' ILE . . . . . 0.456 HG23 ' HB2' ' A' ' 26' ' ' LEU . 85.2 mt -53.26 -54.73 16.19 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.577 0 CA-C-N 115.742 -0.663 . . . . 63.42 111.732 177.036 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -58.57 -38.43 77.87 Favored 'General case' 0 CA--C 1.537 0.443 0 CA-C-N 116.386 -0.37 . . . . 64.44 111.859 -178.974 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 55' ' ' ARG . . . . . 0.425 HH11 ' HD2' ' A' ' 55' ' ' ARG . 15.9 ttt180 -76.89 -25.1 52.64 Favored 'General case' 0 CA--C 1.541 0.613 0 O-C-N 122.112 -0.367 . . . . 52.44 111.257 -179.792 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 56' ' ' LEU . . . . . 0.784 ' HA ' HH22 ' A' ' 41' ' ' ARG . 85.2 mt -62.82 -49.34 75.31 Favored 'General case' 0 C--O 1.236 0.362 0 CA-C-O 121.126 0.489 . . . . 72.32 109.843 170.48 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 58.6 mtp180 -62.91 -47.83 81.59 Favored 'General case' 0 CA--C 1.538 0.518 0 CA-C-N 115.316 -0.856 . . . . 75.21 110.828 177.078 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 58' ' ' ALA . . . . . 0.513 ' O ' ' HG3' ' A' ' 62' ' ' GLN . . . -55.67 -57.43 12.0 Favored 'General case' 0 N--CA 1.469 0.495 0 CA-C-N 116.032 -0.531 . . . . 74.4 112.17 179.821 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 59' ' ' TYR . . . . . 0.425 ' CD2' HD21 ' A' ' 43' ' ' LEU . 54.1 t80 -54.46 -38.87 66.86 Favored 'General case' 0 N--CA 1.473 0.692 0 CA-C-O 120.993 0.425 . . . . 74.01 111.363 179.635 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 60' ' ' GLN . . . . . . . . . . . . . 23.9 tm0? -69.68 -34.75 74.38 Favored 'General case' 0 CA--C 1.538 0.492 0 CA-C-O 121.094 0.473 . . . . 73.3 110.461 177.614 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 61' ' ' ASP . . . . . . . . . . . . . 34.3 t70 -70.5 -33.63 71.44 Favored 'General case' 0 CA--C 1.543 0.692 0 CA-C-N 116.175 -0.466 . . . . 74.02 111.408 178.338 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 62' ' ' GLN . . . . . 0.513 ' HG3' ' O ' ' A' ' 58' ' ' ALA . 84.7 mt-30 . . . . . 0 N--CA 1.473 0.724 0 CA-C-O 121.147 0.498 . . . . 72.24 111.345 178.43 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 22' ' ' LEU . . . . . 0.452 HD12 ' HB2' ' A' ' 60' ' ' GLN . 79.4 mt . . . . . 0 CA--C 1.54 0.576 0 CA-C-O 120.437 0.161 . . . . 62.04 111.086 . . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 23' ' ' PRO . . . . . 0.523 ' O ' ' HG ' ' A' ' 26' ' ' LEU . 74.5 Cg_exo -50.92 136.84 44.04 Favored 'Trans proline' 0 CA--C 1.539 0.764 0 C-N-CA 122.925 2.416 . . . . 71.14 113.644 -177.243 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -80.15 -15.12 57.76 Favored 'General case' 0 N--CA 1.467 0.421 0 CA-C-O 120.965 0.412 . . . . 72.14 111.309 177.167 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 25' ' ' ASN . . . . . 0.432 ' HB3' ' HB3' ' A' ' 28' ' ' ASP . 14.9 m120 -92.77 27.07 2.47 Favored 'General case' 0 CA--C 1.542 0.67 0 N-CA-C 112.161 0.43 . . . . 64.02 112.161 -177.807 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 26' ' ' LEU . . . . . 0.523 ' HG ' ' O ' ' A' ' 23' ' ' PRO . 82.8 mt -51.07 -38.26 50.59 Favored 'General case' 0 N--CA 1.476 0.839 0 N-CA-C 112.949 0.722 . . . . 75.45 112.949 -176.873 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 35.2 t70 -75.53 -31.25 60.04 Favored 'General case' 0 CA--C 1.541 0.62 0 O-C-N 122.091 -0.38 . . . . 72.45 111.332 179.077 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 28' ' ' ASP . . . . . 0.432 ' HB3' ' HB3' ' A' ' 25' ' ' ASN . 22.1 t70 -73.14 -23.3 60.45 Favored 'General case' 0 CA--C 1.541 0.627 0 CA-C-O 121.124 0.488 . . . . 61.42 110.254 175.791 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 29' ' ' MET . . . . . 0.401 ' SD ' HD23 ' A' ' 26' ' ' LEU . 76.3 mtp -70.83 160.67 32.33 Favored 'General case' 0 CA--C 1.537 0.479 0 CA-C-O 121.295 0.569 . . . . 73.44 111.559 176.038 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 46.3 mtpt -92.9 157.68 16.23 Favored 'General case' 0 CA--C 1.539 0.531 0 CA-C-N 115.898 -0.592 . . . . 72.22 112.003 -177.926 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 57.3 t -52.13 -47.86 43.17 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.693 0 CA-C-N 115.909 -0.587 . . . . 51.21 112.27 -176.418 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -61.73 -35.96 79.6 Favored 'General case' 0 N--CA 1.471 0.575 0 CA-C-O 120.919 0.39 . . . . 73.41 111.874 179.853 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 41.7 mt-10 -72.01 -35.47 69.43 Favored 'General case' 0 N--CA 1.47 0.546 0 CA-C-N 116.297 -0.41 . . . . 65.14 111.126 -178.895 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 90.6 mt -65.79 -50.45 64.66 Favored 'General case' 0 CA--C 1.537 0.473 0 CA-C-N 116.145 -0.48 . . . . 65.14 110.887 174.501 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 35' ' ' LYS . . . . . 0.401 ' HG2' ' HB ' ' A' ' 45' ' ' VAL . 60.3 mttm -54.99 -41.82 71.7 Favored 'General case' 0 N--CA 1.47 0.544 0 CA-C-O 121.043 0.449 . . . . 74.43 111.299 175.667 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 36' ' ' GLN . . . . . 0.485 ' O ' ' HG ' ' A' ' 40' ' ' LEU . 26.0 tm0? -56.15 -47.81 77.5 Favored 'General case' 0 CA--C 1.539 0.539 0 CA-C-N 115.8 -0.636 . . . . 70.22 111.32 -179.489 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 37' ' ' GLU . . . . . 0.726 ' HB3' ' NH2' ' A' ' 41' ' ' ARG . 42.5 mt-10 -70.79 -39.18 73.29 Favored 'General case' 0 CA--C 1.538 0.518 0 N-CA-C 112.095 0.405 . . . . 63.04 112.095 178.151 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 38' ' ' LEU . . . . . 0.416 ' CD1' HD22 ' A' ' 52' ' ' LEU . 77.5 mt -55.84 -54.3 46.21 Favored 'General case' 0 N--CA 1.467 0.424 0 CA-C-O 120.822 0.344 . . . . 73.03 111.573 176.913 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 18.7 ptmt -63.48 -25.68 68.37 Favored 'General case' 0 CA--C 1.541 0.628 0 N-CA-C 112.225 0.454 . . . . 72.04 112.225 -175.006 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 40' ' ' LEU . . . . . 0.485 ' HG ' ' O ' ' A' ' 36' ' ' GLN . 66.1 mt -72.08 -30.03 64.7 Favored 'General case' 0 N--CA 1.471 0.576 0 CA-C-O 120.805 0.336 . . . . 74.3 111.174 175.388 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 41' ' ' ARG . . . . . 0.726 ' NH2' ' HB3' ' A' ' 37' ' ' GLU . 0.0 OUTLIER -97.52 17.07 18.49 Favored 'General case' 0 N--CA 1.472 0.64 0 CA-C-N 116.412 -0.358 . . . . 62.23 111.258 173.951 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 30.0 t 63.32 16.48 9.52 Favored 'General case' 0 N--CA 1.48 1.057 0 N-CA-C 112.706 0.632 . . . . 73.2 112.706 176.989 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 43' ' ' LEU . . . . . 0.426 ' HA ' ' HD3' ' A' ' 44' ' ' PRO . 58.4 mt -79.65 136.2 55.69 Favored Pre-proline 0 CA--C 1.543 0.674 0 N-CA-C 111.914 0.339 . . . . 74.43 111.914 -178.652 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 44' ' ' PRO . . . . . 0.426 ' HD3' ' HA ' ' A' ' 43' ' ' LEU . 51.6 Cg_exo -56.24 120.81 8.9 Favored 'Trans proline' 0 CA--C 1.542 0.905 0 C-N-CA 122.93 2.42 . . . . 61.53 113.227 178.588 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 45' ' ' VAL . . . . . 0.401 ' HB ' ' HG2' ' A' ' 35' ' ' LYS . 34.0 m -94.87 10.17 4.89 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.733 0 N-CA-C 112.719 0.637 . . . . 55.33 112.719 -176.419 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 37.1 t -73.99 -22.17 59.71 Favored 'General case' 0 N--CA 1.478 0.931 0 N-CA-C 113.063 0.764 . . . . 74.33 113.063 -176.226 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . -68.31 169.04 40.91 Favored Glycine 0 CA--C 1.534 1.25 0 C-N-CA 120.968 -0.634 . . . . 53.15 114.055 -176.944 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 48' ' ' THR . . . . . 0.589 ' O ' ' HG ' ' A' ' 52' ' ' LEU . 64.1 p -74.26 170.32 15.81 Favored 'General case' 0 N--CA 1.475 0.799 0 O-C-N 122.558 -0.378 . . . . 74.12 111.115 177.097 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 49' ' ' LYS . . . . . 0.406 ' O ' HG13 ' A' ' 53' ' ' ILE . 64.0 tttm -48.1 -44.98 32.32 Favored 'General case' 0 N--CA 1.471 0.611 0 N-CA-C 112.056 0.391 . . . . 72.33 112.056 -178.875 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 50' ' ' THR . . . . . . . . . . . . . 94.4 m -64.51 -43.86 92.75 Favored 'General case' 0 N--CA 1.472 0.634 0 CA-C-O 120.877 0.37 . . . . 64.23 111.313 177.565 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 44.8 mt-10 -64.6 -34.72 78.92 Favored 'General case' 0 N--CA 1.469 0.518 0 CA-C-N 116.45 -0.341 . . . . 74.43 111.533 -179.878 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 52' ' ' LEU . . . . . 0.589 ' HG ' ' O ' ' A' ' 48' ' ' THR . 44.5 mt -62.03 -44.51 96.55 Favored 'General case' 0 N--CA 1.471 0.6 0 CA-C-O 121.409 0.624 . . . . 72.25 110.318 176.381 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 53' ' ' ILE . . . . . 0.536 HG22 ' HD3' ' A' ' 57' ' ' ARG . 79.7 mt -60.91 -52.38 62.36 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.576 0 CA-C-N 115.525 -0.762 . . . . 73.2 111.301 176.172 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 11.8 mm-40 -61.45 -30.15 70.41 Favored 'General case' 0 N--CA 1.47 0.54 0 CA-C-N 116.204 -0.453 . . . . 54.41 111.757 178.68 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 55' ' ' ARG . . . . . 0.507 ' HA ' ' HE ' ' A' ' 55' ' ' ARG . 0.8 OUTLIER -67.33 -50.03 61.68 Favored 'General case' 0 CA--C 1.54 0.562 0 CA-C-O 120.865 0.364 . . . . 71.14 110.93 179.5 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 56' ' ' LEU . . . . . 0.62 HD22 HH21 ' A' ' 41' ' ' ARG . 60.7 mt -59.77 -51.34 70.16 Favored 'General case' 0 N--CA 1.472 0.667 0 CA-C-O 121.193 0.52 . . . . 64.34 111.126 175.376 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 57' ' ' ARG . . . . . 0.536 ' HD3' HG22 ' A' ' 53' ' ' ILE . 16.7 mtp85 -56.97 -39.11 74.0 Favored 'General case' 0 CA--C 1.539 0.538 0 CA-C-N 116.022 -0.536 . . . . 74.03 112.132 179.806 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -66.75 -40.03 88.14 Favored 'General case' 0 CA--C 1.54 0.575 0 CA-C-O 120.984 0.421 . . . . 74.33 111.5 176.797 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 59' ' ' TYR . . . . . . . . . . . . . 73.5 t80 -63.43 -38.09 89.8 Favored 'General case' 0 CA--C 1.542 0.657 0 CA-C-N 116.237 -0.438 . . . . 53.12 111.348 178.907 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 60' ' ' GLN . . . . . 0.452 ' HB2' HD12 ' A' ' 22' ' ' LEU . 0.0 OUTLIER -76.61 -45.7 29.12 Favored 'General case' 0 CA--C 1.542 0.669 0 CA-C-O 121.282 0.563 . . . . 54.32 110.536 178.618 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 61' ' ' ASP . . . . . . . . . . . . . 27.3 t70 -53.08 -28.77 26.68 Favored 'General case' 0 CA--C 1.545 0.787 0 N-CA-C 112.833 0.679 . . . . 74.12 112.833 -176.988 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 62' ' ' GLN . . . . . . . . . . . . . 10.1 pt20 . . . . . 0 N--CA 1.473 0.699 0 N-CA-C 112.735 0.642 . . . . 50.02 112.735 -178.956 . . . . . . . . 0 0 . 1 . 010 nuclear nobuild core ' A' A ' 22' ' ' LEU . . . . . 0.457 ' HG ' ' HG3' ' A' ' 60' ' ' GLN . 91.3 mt . . . . . 0 N--CA 1.475 0.786 0 CA-C-O 120.577 0.227 . . . . 74.34 111.269 . . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 23' ' ' PRO . . . . . 0.434 ' HG2' HD23 ' A' ' 26' ' ' LEU . 46.9 Cg_endo -70.32 150.34 64.65 Favored 'Trans proline' 0 CA--C 1.541 0.838 0 C-N-CA 122.191 1.927 . . . . 74.23 111.751 170.714 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -67.17 -39.63 86.5 Favored 'General case' 0 N--CA 1.47 0.556 0 CA-C-O 121.023 0.44 . . . . 74.02 112.02 -177.855 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 25' ' ' ASN . . . . . 0.429 ' HB3' ' HB2' ' A' ' 28' ' ' ASP . 1.9 m-20 -92.57 72.44 5.08 Favored 'General case' 0 CA--C 1.537 0.456 0 CA-C-O 121.107 0.479 . . . . 75.34 111.812 -178.613 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 26' ' ' LEU . . . . . 0.434 HD23 ' HG2' ' A' ' 23' ' ' PRO . 92.9 mt -72.28 -33.49 67.48 Favored 'General case' 0 CA--C 1.536 0.412 0 CA-C-N 116.332 -0.395 . . . . 71.41 111.685 179.029 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 36.3 t70 -72.83 -25.17 61.03 Favored 'General case' 0 CA--C 1.538 0.516 0 O-C-N 122.17 -0.331 . . . . 64.43 111.42 178.611 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 28' ' ' ASP . . . . . 0.429 ' HB2' ' HB3' ' A' ' 25' ' ' ASN . 16.3 m-20 -74.91 -15.36 60.7 Favored 'General case' 0 N--CA 1.469 0.508 0 CA-C-O 120.89 0.376 . . . . 74.02 111.296 175.155 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 29' ' ' MET . . . . . . . . . . . . . 86.1 mtp -81.65 137.8 35.4 Favored 'General case' 0 CA--C 1.536 0.419 0 CA-C-O 121.01 0.433 . . . . 65.21 110.947 175.76 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 30' ' ' LYS . . . . . 0.46 ' HB2' ' HG2' ' A' ' 33' ' ' GLU . 51.3 mtmt -66.85 155.41 38.4 Favored 'General case' 0 CA--C 1.541 0.624 0 CA-C-N 116.302 -0.408 . . . . 74.41 111.357 -179.989 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 90.2 t -54.06 -42.4 54.82 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.713 0 N-CA-C 111.963 0.357 . . . . 73.24 111.963 -177.673 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -63.27 -33.08 74.72 Favored 'General case' 0 CA--C 1.539 0.528 0 CA-C-O 120.791 0.329 . . . . 74.51 111.643 177.68 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 33' ' ' GLU . . . . . 0.46 ' HG2' ' HB2' ' A' ' 30' ' ' LYS . 57.9 mm-40 -70.22 -47.61 60.68 Favored 'General case' 0 N--CA 1.468 0.426 0 CA-C-O 120.919 0.39 . . . . 65.4 110.636 177.462 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 97.7 mt -57.35 -46.08 83.68 Favored 'General case' 0 CA--C 1.539 0.535 0 CA-C-N 116.234 -0.439 . . . . 61.24 111.144 176.228 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 55.2 mtmt -63.98 -32.47 74.01 Favored 'General case' 0 CA--C 1.539 0.538 0 CA-C-N 116.426 -0.352 . . . . 74.23 111.568 177.5 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 51.5 tp60 -65.81 -49.6 67.69 Favored 'General case' 0 CA--C 1.539 0.533 0 CA-C-O 121.008 0.433 . . . . 71.51 110.067 175.495 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 37' ' ' GLU . . . . . 0.639 ' HB3' HH21 ' A' ' 41' ' ' ARG . 42.2 mm-40 -54.75 -31.77 59.0 Favored 'General case' 0 N--CA 1.472 0.637 0 CA-C-N 115.921 -0.581 . . . . 70.12 111.591 175.562 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 38' ' ' LEU . . . . . 0.45 ' CD1' HD22 ' A' ' 52' ' ' LEU . 91.5 mt -72.02 -62.2 1.51 Allowed 'General case' 0 CA--C 1.538 0.488 0 CA-C-N 116.284 -0.416 . . . . 73.41 111.92 176.694 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 20.6 ptmt -58.92 -34.28 71.53 Favored 'General case' 0 CA--C 1.541 0.599 0 N-CA-C 112.622 0.601 . . . . 72.21 112.622 -172.929 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 93.0 mt -64.87 -22.46 67.0 Favored 'General case' 0 N--CA 1.475 0.793 0 CA-C-O 121.193 0.521 . . . . 43.22 111.568 177.743 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 41' ' ' ARG . . . . . 0.639 HH21 ' HB3' ' A' ' 37' ' ' GLU . 15.5 mtm180 -109.72 27.12 9.89 Favored 'General case' 0 CA--C 1.541 0.603 0 CA-C-N 116.136 -0.484 . . . . 75.22 111.604 177.77 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 28.0 t 70.23 5.34 5.27 Favored 'General case' 0 N--CA 1.478 0.97 0 N-CA-C 112.809 0.67 . . . . 74.05 112.809 174.818 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 61.4 mt -82.8 142.38 45.26 Favored Pre-proline 0 CA--C 1.542 0.639 0 CA-C-O 120.723 0.297 . . . . 71.52 111.468 -179.569 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 44' ' ' PRO . . . . . 0.434 ' HG2' ' NH1' ' A' ' 55' ' ' ARG . 59.2 Cg_endo -70.13 143.79 50.14 Favored 'Trans proline' 0 C--N 1.352 0.723 0 C-N-CA 122.476 2.117 . . . . 72.32 112.567 178.411 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 30.2 m -95.09 16.45 1.99 Allowed 'Isoleucine or valine' 0 CA--C 1.54 0.59 0 CA-C-O 121.22 0.533 . . . . 71.31 111.93 -177.063 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 33.0 t -90.53 89.42 7.55 Favored 'General case' 0 N--CA 1.47 0.528 0 CA-C-N 116.247 -0.433 . . . . 72.12 111.455 179.713 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . -172.82 174.88 45.88 Favored Glycine 0 CA--C 1.528 0.867 0 C-N-CA 120.711 -0.757 . . . . 62.12 113.851 178.68 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 48' ' ' THR . . . . . 0.601 ' O ' ' HG ' ' A' ' 52' ' ' LEU . 68.3 p -93.12 170.03 9.95 Favored 'General case' 0 N--CA 1.469 0.516 0 C-N-CA 122.58 0.352 . . . . 72.4 111.019 178.748 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 22.8 tptm -44.47 -54.57 5.84 Favored 'General case' 0 N--CA 1.472 0.656 0 N-CA-C 112.135 0.42 . . . . 72.32 112.135 -179.02 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 50' ' ' THR . . . . . . . . . . . . . 51.4 m -69.96 -40.9 75.14 Favored 'General case' 0 CA--C 1.538 0.482 0 CA-C-N 116.405 -0.361 . . . . 72.43 111.781 -179.59 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 2.9 tm-20 -55.17 -48.82 73.24 Favored 'General case' 0 CA--C 1.542 0.647 0 CA-C-N 116.354 -0.384 . . . . 72.23 111.246 179.298 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 52' ' ' LEU . . . . . 0.601 ' HG ' ' O ' ' A' ' 48' ' ' THR . 54.2 mt -56.47 -46.38 80.44 Favored 'General case' 0 N--CA 1.47 0.556 0 CA-C-O 121.137 0.494 . . . . 73.24 111.059 179.169 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 53' ' ' ILE . . . . . . . . . . . . . 78.9 mt -56.23 -53.12 43.28 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.534 0 CA-C-N 115.948 -0.569 . . . . 75.15 111.634 178.162 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 38.9 mt-10 -68.31 -28.14 66.91 Favored 'General case' 0 CA--C 1.536 0.438 0 CA-C-N 116.243 -0.435 . . . . 72.45 111.816 -178.897 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 55' ' ' ARG . . . . . 0.434 ' NH1' ' HG2' ' A' ' 44' ' ' PRO . 41.9 ttm-85 -68.69 -38.71 80.54 Favored 'General case' 0 CA--C 1.537 0.481 0 CA-C-O 121.122 0.486 . . . . 74.23 110.596 176.752 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 62.4 mt -56.73 -48.39 77.88 Favored 'General case' 0 CA--C 1.538 0.494 0 CA-C-N 116.088 -0.506 . . . . 72.31 111.137 173.482 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 54.1 mtm180 -61.48 -41.96 98.05 Favored 'General case' 0 N--CA 1.469 0.497 0 CA-C-N 116.577 -0.283 . . . . 75.45 111.186 177.78 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -55.25 -41.21 71.85 Favored 'General case' 0 N--CA 1.471 0.584 0 CA-C-O 120.943 0.402 . . . . 61.12 111.682 179.703 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 59' ' ' TYR . . . . . . . . . . . . . 87.0 t80 -69.73 -51.57 33.07 Favored 'General case' 0 CA--C 1.536 0.44 0 CA-C-O 121.092 0.472 . . . . 74.32 110.833 176.207 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 60' ' ' GLN . . . . . 0.457 ' HG3' ' HG ' ' A' ' 22' ' ' LEU . 17.6 mm100 -58.42 -29.29 65.99 Favored 'General case' 0 CA--C 1.539 0.547 0 CA-C-N 116.101 -0.499 . . . . 71.11 112.264 179.484 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 61' ' ' ASP . . . . . . . . . . . . . 19.5 t70 -71.91 -45.27 61.8 Favored 'General case' 0 C--N 1.321 -0.65 0 CA-C-N 116.178 -0.465 . . . . 74.25 111.633 179.094 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 62' ' ' GLN . . . . . . . . . . . . . 11.0 pt20 . . . . . 0 CA--C 1.54 0.589 0 N-CA-C 112.706 0.632 . . . . 75.43 112.706 -175.348 . . . . . . . . 0 0 . 1 . 011 nuclear nobuild core ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 98.8 mt . . . . . 0 CA--C 1.541 0.632 0 CA-C-O 120.327 0.108 . . . . 72.23 111.051 . . . . . . . . . 0 0 . 1 . 011 nuclear nobuild core ' A' A ' 23' ' ' PRO . . . . . . . . . . . . . 74.5 Cg_exo -50.81 130.39 30.63 Favored 'Trans proline' 0 CA--C 1.541 0.87 0 C-N-CA 122.538 2.159 . . . . 71.42 112.898 177.266 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -55.33 -43.83 75.32 Favored 'General case' 0 CA--C 1.539 0.523 0 CA-C-O 121.106 0.479 . . . . 44.24 112.132 -178.022 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 14.7 m120 -97.77 67.97 2.03 Favored 'General case' 0 CA--C 1.537 0.455 0 N-CA-C 112.122 0.416 . . . . 62.12 112.122 179.219 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 26' ' ' LEU . . . . . 0.414 ' HB2' HG23 ' A' ' 53' ' ' ILE . 96.5 mt -63.63 -28.58 70.01 Favored 'General case' 0 N--CA 1.47 0.539 0 CA-C-O 121.614 0.721 . . . . 73.34 110.086 170.444 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 8.8 p-10 -64.74 -25.17 67.81 Favored 'General case' 0 CA--C 1.539 0.54 0 CA-C-N 115.346 -0.843 . . . . 72.04 111.835 177.788 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 34.7 t70 -84.23 -6.77 59.44 Favored 'General case' 0 CA--C 1.543 0.698 0 CA-C-O 120.945 0.402 . . . . 73.32 111.65 -179.857 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 29' ' ' MET . . . . . 0.457 ' O ' ' HE3' ' A' ' 49' ' ' LYS . 83.6 mtp -87.66 166.78 14.43 Favored 'General case' 0 CA--C 1.541 0.613 0 CA-C-O 121.062 0.458 . . . . 64.11 111.752 179.875 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 30' ' ' LYS . . . . . 0.573 ' HB2' ' HG2' ' A' ' 33' ' ' GLU . 29.0 mtpp -84.17 153.1 23.87 Favored 'General case' 0 CA--C 1.54 0.585 0 CA-C-N 116.487 -0.324 . . . . 74.1 111.458 179.731 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 65.6 t -53.47 -57.1 5.77 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.772 0 N-CA-C 112.164 0.431 . . . . 71.24 112.164 -178.261 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 32' ' ' ALA . . . . . 0.53 ' HA ' ' HD3' ' A' ' 35' ' ' LYS . . . -58.38 -29.3 65.92 Favored 'General case' 0 N--CA 1.472 0.641 0 N-CA-C 112.214 0.449 . . . . 70.15 112.214 -178.85 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 33' ' ' GLU . . . . . 0.573 ' HG2' ' HB2' ' A' ' 30' ' ' LYS . 13.9 mm-40 -74.41 -38.95 62.94 Favored 'General case' 0 CA--C 1.538 0.519 0 CA-C-O 120.75 0.309 . . . . 74.32 110.938 179.413 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 92.9 mt -63.61 -44.14 94.82 Favored 'General case' 0 N--CA 1.47 0.531 0 CA-C-O 121.271 0.558 . . . . 72.23 110.308 172.925 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 35' ' ' LYS . . . . . 0.53 ' HD3' ' HA ' ' A' ' 32' ' ' ALA . 58.2 mtpt -55.84 -41.26 74.02 Favored 'General case' 0 N--CA 1.468 0.469 0 CA-C-N 115.775 -0.648 . . . . 63.42 111.447 176.658 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 36' ' ' GLN . . . . . 0.414 ' O ' ' HG ' ' A' ' 40' ' ' LEU . 58.3 tp60 -56.69 -52.85 63.34 Favored 'General case' 0 CA--C 1.539 0.531 0 CA-C-O 120.876 0.37 . . . . 55.23 110.775 175.855 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 37' ' ' GLU . . . . . 0.629 ' HB3' ' NH2' ' A' ' 41' ' ' ARG . 25.9 mm-40 -57.91 -36.43 72.43 Favored 'General case' 0 CA--C 1.54 0.594 0 N-CA-C 112.253 0.464 . . . . 71.44 112.253 177.784 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 38' ' ' LEU . . . . . 0.446 ' CD1' HD22 ' A' ' 52' ' ' LEU . 88.0 mt -66.26 -58.33 5.59 Favored 'General case' 0 CA--C 1.539 0.54 0 CA-C-O 120.887 0.375 . . . . 71.41 111.549 177.14 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 20.7 ptmt -61.25 -30.24 70.33 Favored 'General case' 0 CA--C 1.54 0.585 0 N-CA-C 111.99 0.367 . . . . 73.23 111.99 -175.433 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 40' ' ' LEU . . . . . 0.414 ' HG ' ' O ' ' A' ' 36' ' ' GLN . 87.1 mt -68.21 -25.9 65.45 Favored 'General case' 0 CA--C 1.541 0.611 0 O-C-N 122.249 -0.282 . . . . 74.55 111.722 176.851 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 41' ' ' ARG . . . . . 0.678 HH21 HD22 ' A' ' 56' ' ' LEU . 80.8 mtm-85 -110.77 25.5 11.71 Favored 'General case' 0 N--CA 1.472 0.656 0 N-CA-C 112.051 0.389 . . . . 71.24 112.051 179.953 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 31.9 t 63.1 34.15 13.94 Favored 'General case' 0 N--CA 1.479 1.008 0 N-CA-C 112.415 0.524 . . . . 72.24 112.415 174.832 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 64.3 mt -105.16 138.55 19.56 Favored Pre-proline 0 CA--C 1.541 0.625 0 CA-C-N 116.554 -0.293 . . . . 74.15 111.499 179.367 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 44' ' ' PRO . . . . . 0.412 ' HG2' ' NH1' ' A' ' 55' ' ' ARG . 37.2 Cg_endo -66.84 131.64 26.24 Favored 'Trans proline' 0 CA--C 1.544 1.007 0 C-N-CA 122.524 2.149 . . . . 53.22 112.801 178.066 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 34.2 m -102.47 17.22 4.51 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.748 0 N-CA-C 112.356 0.502 . . . . 75.15 112.356 -174.948 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 69.3 m -81.36 13.33 3.0 Favored 'General case' 0 N--CA 1.478 0.942 0 N-CA-C 113.329 0.863 . . . . 61.03 113.329 -175.552 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . -104.45 172.28 20.18 Favored Glycine 0 CA--C 1.529 0.912 0 C-N-CA 120.908 -0.663 . . . . 22.22 113.973 -175.983 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 48' ' ' THR . . . . . 0.575 ' O ' ' HG ' ' A' ' 52' ' ' LEU . 43.4 p -77.0 169.23 18.71 Favored 'General case' 0 N--CA 1.473 0.707 0 O-C-N 122.504 -0.41 . . . . 71.23 110.87 176.785 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 49' ' ' LYS . . . . . 0.512 ' HE2' HD11 ' A' ' 53' ' ' ILE . 23.7 tptm -42.22 -51.15 4.81 Favored 'General case' 0 N--CA 1.475 0.776 0 CA-C-O 120.942 0.401 . . . . 73.43 111.598 176.818 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 50' ' ' THR . . . . . . . . . . . . . 31.1 m -60.88 -47.07 88.08 Favored 'General case' 0 CA--C 1.539 0.548 0 CA-C-N 116.01 -0.541 . . . . 71.35 111.769 -179.919 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 42.4 mt-10 -64.44 -38.13 89.96 Favored 'General case' 0 N--CA 1.472 0.637 0 CA-C-O 120.798 0.332 . . . . 73.41 111.789 -177.018 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 52' ' ' LEU . . . . . 0.575 ' HG ' ' O ' ' A' ' 48' ' ' THR . 43.8 mt -61.24 -44.23 97.59 Favored 'General case' 0 N--CA 1.47 0.542 0 CA-C-O 121.309 0.576 . . . . 72.44 110.458 177.175 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 53' ' ' ILE . . . . . 0.512 HD11 ' HE2' ' A' ' 49' ' ' LYS . 70.0 mt -60.77 -55.82 22.01 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.51 0 CA-C-N 115.643 -0.708 . . . . 75.35 111.149 176.645 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 53.9 mm-40 -54.99 -41.11 70.82 Favored 'General case' 0 CA--C 1.538 0.493 0 CA-C-N 116.161 -0.472 . . . . 73.34 111.74 -179.493 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 55' ' ' ARG . . . . . 0.412 ' NH1' ' HG2' ' A' ' 44' ' ' PRO . 30.9 ttm180 -63.36 -38.12 89.9 Favored 'General case' 0 CA--C 1.541 0.625 0 CA-C-N 116.237 -0.438 . . . . 54.43 111.361 179.643 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 56' ' ' LEU . . . . . 0.678 HD22 HH21 ' A' ' 41' ' ' ARG . 68.6 mt -68.72 -46.81 67.98 Favored 'General case' 0 N--CA 1.472 0.631 0 CA-C-O 120.757 0.313 . . . . 73.41 111.452 174.563 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 57' ' ' ARG . . . . . 0.44 ' HG3' ' O ' ' A' ' 53' ' ' ILE . 69.0 mtp180 -55.79 -46.17 78.03 Favored 'General case' 0 N--CA 1.471 0.593 0 CA-C-O 121.246 0.546 . . . . 54.3 111.073 178.713 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -69.13 -40.97 77.94 Favored 'General case' 0 CA--C 1.536 0.434 0 CA-C-N 116.021 -0.536 . . . . 74.5 112.132 -179.954 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 59' ' ' TYR . . . . . . . . . . . . . 49.6 t80 -63.84 -28.47 69.88 Favored 'General case' 0 N--CA 1.469 0.508 0 CA-C-O 121.051 0.453 . . . . 75.2 110.894 177.695 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 60' ' ' GLN . . . . . . . . . . . . . 17.4 tm0? -78.36 -44.8 24.1 Favored 'General case' 0 CA--C 1.542 0.663 0 CA-C-N 116.196 -0.456 . . . . 75.31 110.355 176.381 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 61' ' ' ASP . . . . . . . . . . . . . 17.1 t70 -55.17 -45.97 75.78 Favored 'General case' 0 CA--C 1.542 0.642 0 N-CA-C 112.36 0.504 . . . . 62.12 112.36 179.359 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 62' ' ' GLN . . . . . . . . . . . . . 9.3 pt20 . . . . . 0 CA--C 1.542 0.671 0 N-CA-C 112.588 0.588 . . . . 71.1 112.588 -177.36 . . . . . . . . 0 0 . 1 . 012 nuclear nobuild core ' A' A ' 22' ' ' LEU . . . . . 0.519 HD12 ' HB2' ' A' ' 60' ' ' GLN . 88.8 mt . . . . . 0 CA--C 1.542 0.655 0 CA-C-O 120.605 0.241 . . . . 74.3 110.984 . . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 23' ' ' PRO . . . . . 0.482 ' HD3' ' HA ' ' A' ' 22' ' ' LEU . 23.3 Cg_exo -62.86 163.1 23.06 Favored 'Trans proline' 0 CA--C 1.539 0.762 0 C-N-CA 123.013 2.475 . . . . 54.34 113.942 -174.554 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -87.27 14.07 8.52 Favored 'General case' 0 N--CA 1.47 0.567 0 CA-C-O 121.269 0.557 . . . . 22.53 111.289 176.293 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 12.0 m120 -104.13 9.27 36.36 Favored 'General case' 0 CA--C 1.536 0.432 0 CA-C-N 116.0 -0.545 . . . . 74.44 111.739 -177.639 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 26' ' ' LEU . . . . . 0.457 HD23 ' SD ' ' A' ' 29' ' ' MET . 63.3 mt -56.39 -27.04 55.1 Favored 'General case' 0 N--CA 1.475 0.812 0 CA-C-O 121.052 0.453 . . . . 53.53 111.849 -174.811 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 5.1 m-20 -61.73 -53.21 59.06 Favored 'General case' 0 CA--C 1.543 0.681 0 CA-C-N 116.07 -0.514 . . . . 60.53 111.158 174.825 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 12.2 m-20 -73.48 -32.55 64.38 Favored 'General case' 0 N--CA 1.471 0.586 0 CA-C-N 116.188 -0.46 . . . . 65.05 111.696 179.484 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 29' ' ' MET . . . . . 0.457 ' SD ' HD23 ' A' ' 26' ' ' LEU . 87.7 mtp -57.13 123.01 13.77 Favored 'General case' 0 N--CA 1.468 0.426 0 CA-C-O 121.049 0.452 . . . . 61.11 110.67 178.461 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 30' ' ' LYS . . . . . 0.451 ' HB2' ' OE1' ' A' ' 33' ' ' GLU . 59.8 mtpt -70.22 167.1 18.62 Favored 'General case' 0 CA--C 1.541 0.624 0 N-CA-C 113.098 0.777 . . . . 75.03 113.098 -170.722 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 46.5 t -50.66 -55.47 6.55 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.681 0 N-CA-C 112.726 0.639 . . . . 64.4 112.726 -174.46 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -60.47 -40.15 90.21 Favored 'General case' 0 N--CA 1.471 0.587 0 CA-C-O 120.979 0.419 . . . . 62.32 111.717 -179.378 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 33' ' ' GLU . . . . . 0.451 ' OE1' ' HB2' ' A' ' 30' ' ' LYS . 0.9 OUTLIER -58.49 -46.19 87.17 Favored 'General case' 0 CA--C 1.541 0.62 0 CA-C-N 115.838 -0.619 . . . . 71.34 111.412 177.113 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 91.6 mt -64.77 -46.43 82.17 Favored 'General case' 0 N--CA 1.471 0.594 0 CA-C-O 121.305 0.574 . . . . 74.43 111.019 176.756 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 35' ' ' LYS . . . . . 0.401 ' HA ' HD12 ' A' ' 38' ' ' LEU . 9.0 mtpm? -60.94 -29.36 69.57 Favored 'General case' 0 CA--C 1.538 0.519 0 CA-C-N 115.882 -0.599 . . . . 71.45 111.929 179.112 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 54.2 tp60 -62.48 -47.63 83.17 Favored 'General case' 0 CA--C 1.538 0.496 0 CA-C-O 120.838 0.352 . . . . 74.1 110.849 176.95 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 29.9 mm-40 -61.92 -45.22 94.67 Favored 'General case' 0 N--CA 1.47 0.555 0 CA-C-O 121.104 0.478 . . . . 75.0 111.129 175.446 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 38' ' ' LEU . . . . . 0.479 ' CD1' HD22 ' A' ' 52' ' ' LEU . 97.3 mt -57.63 -53.95 52.33 Favored 'General case' 0 CA--C 1.541 0.626 0 CA-C-N 116.092 -0.503 . . . . 73.23 112.342 -178.781 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 19.3 ptpt -57.25 -38.25 73.57 Favored 'General case' 0 N--CA 1.474 0.743 0 CA-C-O 120.823 0.344 . . . . 72.35 111.745 -176.975 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 95.8 mt -65.78 -24.34 66.91 Favored 'General case' 0 CA--C 1.538 0.514 0 CA-C-O 121.187 0.518 . . . . 65.34 111.493 178.279 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 41' ' ' ARG . . . . . . . . . . . . . 80.4 mtt-85 -107.13 13.84 26.93 Favored 'General case' 0 CA--C 1.539 0.549 0 CA-C-N 116.143 -0.48 . . . . 73.35 111.754 -177.454 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 69.0 m 62.78 21.75 12.97 Favored 'General case' 0 N--CA 1.478 0.926 0 CA-C-O 121.022 0.439 . . . . 71.14 112.176 178.937 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 57.1 mt -88.57 147.81 40.5 Favored Pre-proline 0 CA--C 1.54 0.575 0 CA-C-N 116.224 -0.443 . . . . 74.03 111.516 -179.563 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 44' ' ' PRO . . . . . 0.527 ' HD2' ' HD3' ' A' ' 55' ' ' ARG . 51.8 Cg_exo -55.47 117.48 4.09 Favored 'Trans proline' 0 C--N 1.353 0.799 0 C-N-CA 122.888 2.392 . . . . 71.01 113.607 177.176 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 33.4 m -92.21 -18.38 7.25 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.579 0 CA-C-N 116.251 -0.431 . . . . 71.02 112.007 -179.944 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 57.2 m -84.51 50.44 1.89 Allowed 'General case' 0 N--CA 1.473 0.705 0 CA-C-O 120.993 0.425 . . . . 71.5 112.025 -177.634 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . -125.16 165.71 18.19 Favored Glycine 0 CA--C 1.526 0.722 0 C-N-CA 121.406 -0.426 . . . . 51.43 112.58 175.486 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 48' ' ' THR . . . . . 0.516 ' O ' ' HG ' ' A' ' 52' ' ' LEU . 68.7 p -76.09 165.05 25.5 Favored 'General case' 0 N--CA 1.472 0.64 0 O-C-N 122.517 -0.402 . . . . 54.15 111.801 178.808 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 49' ' ' LYS . . . . . 0.434 ' O ' HG13 ' A' ' 53' ' ' ILE . 26.7 tptp -44.97 -53.77 7.31 Favored 'General case' 0 N--CA 1.474 0.728 0 C-N-CA 123.234 0.614 . . . . 65.34 112.549 -174.994 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 50' ' ' THR . . . . . . . . . . . . . 60.1 m -62.0 -42.97 99.73 Favored 'General case' 0 N--CA 1.47 0.575 0 CA-C-N 116.617 -0.265 . . . . 72.02 111.703 -179.841 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 44.2 mt-10 -57.4 -41.87 81.13 Favored 'General case' 0 N--CA 1.471 0.622 0 CA-C-O 120.927 0.394 . . . . 72.0 110.933 177.88 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 52' ' ' LEU . . . . . 0.516 ' HG ' ' O ' ' A' ' 48' ' ' THR . 39.1 mt -63.7 -43.21 97.27 Favored 'General case' 0 CA--C 1.539 0.549 0 CA-C-N 116.194 -0.457 . . . . 71.44 111.152 179.376 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 53' ' ' ILE . . . . . 0.434 HG13 ' O ' ' A' ' 49' ' ' LYS . 68.2 mt -65.2 -51.72 61.87 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.524 0 CA-C-N 116.281 -0.418 . . . . 72.15 111.529 -179.917 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 43.7 mt-10 -57.69 -44.47 85.85 Favored 'General case' 0 N--CA 1.47 0.553 0 CA-C-O 120.968 0.413 . . . . 65.32 110.997 177.663 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 55' ' ' ARG . . . . . 0.527 ' HD3' ' HD2' ' A' ' 44' ' ' PRO . 37.2 ttm180 -57.42 -46.49 83.48 Favored 'General case' 0 CA--C 1.539 0.53 0 CA-C-N 115.847 -0.615 . . . . 71.23 111.955 179.496 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 56' ' ' LEU . . . . . 0.449 ' HB3' HD13 ' A' ' 22' ' ' LEU . 77.8 mt -63.78 -49.1 74.28 Favored 'General case' 0 CA--C 1.538 0.485 0 CA-C-O 120.773 0.32 . . . . 52.12 111.725 177.647 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 57' ' ' ARG . . . . . 0.42 ' O ' ' HB2' ' A' ' 61' ' ' ASP . 32.8 mtm180 -64.54 -37.58 88.05 Favored 'General case' 0 CA--C 1.539 0.529 0 N-CA-C 111.83 0.307 . . . . 75.54 111.83 -178.698 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -73.71 -34.57 64.87 Favored 'General case' 0 N--CA 1.47 0.542 0 CA-C-O 121.165 0.507 . . . . 71.14 111.393 178.933 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 59' ' ' TYR . . . . . . . . . . . . . 85.3 t80 -64.43 -55.83 18.31 Favored 'General case' 0 CA--C 1.537 0.453 0 CA-C-O 121.034 0.445 . . . . 74.32 110.701 175.983 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 60' ' ' GLN . . . . . 0.519 ' HB2' HD12 ' A' ' 22' ' ' LEU . 57.0 tp60 -59.99 -38.53 82.84 Favored 'General case' 0 CA--C 1.539 0.544 0 CA-C-N 116.087 -0.506 . . . . 63.34 111.426 178.049 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 61' ' ' ASP . . . . . 0.42 ' HB2' ' O ' ' A' ' 57' ' ' ARG . 15.8 t70 -54.54 -56.71 16.07 Favored 'General case' 0 CA--C 1.541 0.626 0 CA-C-N 116.107 -0.497 . . . . 64.33 112.086 179.107 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 62' ' ' GLN . . . . . . . . . . . . . 11.3 pt20 . . . . . 0 CA--C 1.541 0.619 0 N-CA-C 112.941 0.719 . . . . 65.13 112.941 -173.473 . . . . . . . . 0 0 . 1 . 013 nuclear nobuild core ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 88.5 mt . . . . . 0 CA--C 1.542 0.648 0 N-CA-C 111.675 0.25 . . . . 72.31 111.675 . . . . . . . . . 0 0 . 1 . 013 nuclear nobuild core ' A' A ' 23' ' ' PRO . . . . . 0.473 ' O ' ' HG ' ' A' ' 26' ' ' LEU . 15.6 Cg_exo -68.74 114.21 3.46 Favored 'Trans proline' 0 CA--C 1.541 0.84 0 C-N-CA 122.418 2.079 . . . . 72.33 111.767 172.612 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -47.02 -30.68 2.77 Favored 'General case' 0 N--CA 1.474 0.771 0 N-CA-C 113.122 0.786 . . . . 71.13 113.122 -176.781 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 25' ' ' ASN . . . . . 0.484 ' HB3' ' HB3' ' A' ' 28' ' ' ASP . 14.4 m120 -82.34 33.84 0.41 Allowed 'General case' 0 CA--C 1.545 0.786 0 N-CA-C 112.465 0.542 . . . . 74.44 112.465 -178.719 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 26' ' ' LEU . . . . . 0.473 ' HG ' ' O ' ' A' ' 23' ' ' PRO . 85.6 mt -50.75 -56.84 10.17 Favored 'General case' 0 N--CA 1.476 0.829 0 N-CA-C 112.221 0.452 . . . . 52.21 112.221 179.128 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 15.5 t70 -64.59 -22.54 67.0 Favored 'General case' 0 CA--C 1.544 0.741 0 CA-C-O 120.893 0.378 . . . . 75.23 111.753 -177.768 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 28' ' ' ASP . . . . . 0.484 ' HB3' ' HB3' ' A' ' 25' ' ' ASN . 26.0 t70 -74.56 -34.18 62.86 Favored 'General case' 0 CA--C 1.54 0.591 0 CA-C-N 116.385 -0.371 . . . . 73.42 111.431 178.885 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 29' ' ' MET . . . . . . . . . . . . . 49.4 mtm -73.92 150.97 40.53 Favored 'General case' 0 CA--C 1.537 0.448 0 CA-C-O 121.048 0.451 . . . . 74.31 111.486 -179.694 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 52.0 mtmt -69.12 153.77 43.17 Favored 'General case' 0 CA--C 1.537 0.479 0 CA-C-N 116.162 -0.472 . . . . 73.24 111.822 -178.049 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 31' ' ' VAL . . . . . 0.423 HG13 HD11 ' A' ' 52' ' ' LEU . 91.7 t -49.09 -43.37 15.53 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.679 0 N-CA-C 112.316 0.488 . . . . 72.13 112.316 -177.75 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -58.96 -44.03 91.39 Favored 'General case' 0 N--CA 1.47 0.574 0 CA-C-O 120.814 0.34 . . . . 75.52 111.756 176.687 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 47.3 mt-10 -63.61 -36.36 83.57 Favored 'General case' 0 N--CA 1.47 0.56 0 CA-C-O 120.928 0.394 . . . . 71.25 111.079 178.73 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 34' ' ' LEU . . . . . 0.457 HD21 ' O ' ' A' ' 26' ' ' LEU . 89.4 mt -69.06 -40.83 78.28 Favored 'General case' 0 CA--C 1.539 0.537 0 CA-C-O 120.923 0.392 . . . . 73.51 111.339 176.372 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 94.6 mttt -67.56 -28.15 67.55 Favored 'General case' 0 CA--C 1.536 0.433 0 CA-C-O 120.873 0.368 . . . . 50.31 110.82 174.844 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 53.2 tp60 -64.68 -44.12 91.36 Favored 'General case' 0 N--CA 1.469 0.512 0 N-CA-C 109.89 -0.411 . . . . 70.12 109.89 172.912 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 37' ' ' GLU . . . . . 0.455 ' HB3' ' NH2' ' A' ' 41' ' ' ARG . 55.9 mm-40 -53.23 -40.9 64.89 Favored 'General case' 0 N--CA 1.471 0.607 0 CA-C-N 115.971 -0.559 . . . . 75.12 111.473 174.636 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 38' ' ' LEU . . . . . 0.525 HD13 ' O ' ' A' ' 44' ' ' PRO . 96.6 mt -70.53 -57.48 4.72 Favored 'General case' 0 CA--C 1.538 0.499 0 CA-C-N 115.958 -0.564 . . . . 71.43 112.129 -179.874 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 17.8 ptpt -59.54 -39.13 82.96 Favored 'General case' 0 N--CA 1.472 0.648 0 N-CA-C 112.265 0.469 . . . . 74.13 112.265 -173.99 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 86.0 mt -64.62 -13.6 54.32 Favored 'General case' 0 N--CA 1.473 0.691 0 N-CA-C 112.1 0.408 . . . . 73.52 112.1 179.826 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 41' ' ' ARG . . . . . 0.455 ' NH2' ' HB3' ' A' ' 37' ' ' GLU . 39.0 mtm-85 -124.83 25.59 7.35 Favored 'General case' 0 CA--C 1.543 0.679 0 CA-C-O 120.838 0.351 . . . . 61.45 111.526 179.506 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 73.3 m 63.58 32.44 14.05 Favored 'General case' 0 N--CA 1.48 1.035 0 N-CA-C 113.118 0.785 . . . . 54.44 113.118 174.175 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 43' ' ' LEU . . . . . 0.42 ' HA ' ' HD3' ' A' ' 44' ' ' PRO . 71.6 mt -104.02 145.41 30.6 Favored Pre-proline 0 CA--C 1.544 0.741 0 CA-C-O 120.712 0.292 . . . . 53.13 111.731 178.226 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 44' ' ' PRO . . . . . 0.525 ' O ' HD13 ' A' ' 38' ' ' LEU . 32.1 Cg_exo -62.44 135.59 54.36 Favored 'Trans proline' 0 C--N 1.354 0.849 0 C-N-CA 122.724 2.283 . . . . 54.4 112.898 178.662 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 45' ' ' VAL . . . . . 0.465 HG12 ' HB2' ' A' ' 38' ' ' LEU . 33.1 m -109.39 12.1 8.8 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.853 0 N-CA-C 112.55 0.574 . . . . 71.3 112.55 -176.524 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 46.8 m -79.7 9.17 5.4 Favored 'General case' 0 N--CA 1.476 0.841 0 N-CA-C 113.22 0.822 . . . . 54.31 113.22 -173.869 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . -106.21 170.82 17.0 Favored Glycine 0 CA--C 1.529 0.909 0 C-N-CA 120.797 -0.716 . . . . 43.41 113.911 -178.966 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 48' ' ' THR . . . . . 0.614 ' O ' ' HG ' ' A' ' 52' ' ' LEU . 74.9 p -83.21 178.04 8.27 Favored 'General case' 0 N--CA 1.472 0.645 0 C-N-CA 122.494 0.318 . . . . 73.23 111.446 176.627 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 88.5 tttt -46.42 -47.02 19.05 Favored 'General case' 0 CA--C 1.545 0.782 0 N-CA-C 112.755 0.65 . . . . 71.03 112.755 -175.903 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 50' ' ' THR . . . . . . . . . . . . . 56.7 m -64.43 -44.53 90.87 Favored 'General case' 0 N--CA 1.474 0.775 0 CA-C-O 120.714 0.292 . . . . 75.21 111.243 178.752 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 23.4 mm-40 -55.75 -44.64 77.78 Favored 'General case' 0 N--CA 1.473 0.717 0 CA-C-O 121.167 0.508 . . . . 74.11 111.28 177.101 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 52' ' ' LEU . . . . . 0.614 ' HG ' ' O ' ' A' ' 48' ' ' THR . 28.9 mt -57.63 -51.83 67.89 Favored 'General case' 0 N--CA 1.469 0.491 0 CA-C-N 115.773 -0.649 . . . . 70.33 111.607 -177.771 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 53' ' ' ILE . . . . . 0.401 ' O ' ' HG3' ' A' ' 57' ' ' ARG . 68.2 mt -60.47 -52.54 60.29 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.457 0 CA-C-N 116.352 -0.385 . . . . 65.44 111.772 179.887 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 33.7 mt-10 -60.73 -34.01 73.77 Favored 'General case' 0 N--CA 1.471 0.586 0 CA-C-O 120.931 0.396 . . . . 63.14 111.595 -178.949 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -64.82 -42.87 94.62 Favored 'General case' 0 CA--C 1.54 0.573 0 CA-C-O 121.221 0.534 . . . . 75.14 110.408 177.87 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 56' ' ' LEU . . . . . 0.413 HD22 HH21 ' A' ' 41' ' ' ARG . 97.3 mt -61.45 -46.13 91.37 Favored 'General case' 0 N--CA 1.47 0.53 0 CA-C-N 115.988 -0.551 . . . . 74.31 111.001 174.214 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 57' ' ' ARG . . . . . 0.401 ' HG3' ' O ' ' A' ' 53' ' ' ILE . 66.8 mtp180 -60.67 -36.04 77.73 Favored 'General case' 0 CA--C 1.544 0.73 0 CA-C-N 116.382 -0.372 . . . . 74.23 111.707 179.563 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -67.76 -39.02 84.19 Favored 'General case' 0 N--CA 1.472 0.654 0 CA-C-O 121.1 0.476 . . . . 65.3 111.12 175.797 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 59' ' ' TYR . . . . . . . . . . . . . 75.2 t80 -62.74 -44.82 95.22 Favored 'General case' 0 CA--C 1.542 0.661 0 CA-C-N 116.215 -0.448 . . . . 71.23 111.154 175.772 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 60' ' ' GLN . . . . . . . . . . . . . 15.5 mm100 -65.18 -45.78 83.45 Favored 'General case' 0 N--CA 1.471 0.584 0 CA-C-O 121.12 0.486 . . . . 74.25 111.501 177.494 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 61' ' ' ASP . . . . . . . . . . . . . 27.1 t70 -47.13 -38.83 12.26 Favored 'General case' 0 CA--C 1.543 0.704 0 CA-C-N 115.565 -0.743 . . . . 70.24 112.892 -178.231 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 62' ' ' GLN . . . . . . . . . . . . . 9.6 pt20 . . . . . 0 CA--C 1.544 0.725 0 N-CA-C 112.954 0.724 . . . . 74.13 112.954 -175.612 . . . . . . . . 0 0 . 1 . 014 nuclear nobuild core ' A' A ' 22' ' ' LEU . . . . . 0.548 ' HG ' ' HG3' ' A' ' 60' ' ' GLN . 94.3 mt . . . . . 0 N--CA 1.47 0.568 0 N-CA-C 111.955 0.354 . . . . 72.42 111.955 . . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 23' ' ' PRO . . . . . 0.62 ' O ' ' HG ' ' A' ' 26' ' ' LEU . 22.9 Cg_exo -64.85 125.51 14.9 Favored 'Trans proline' 0 CA--C 1.538 0.701 0 C-N-CA 122.626 2.217 . . . . 71.53 111.773 173.269 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -56.27 -23.96 39.82 Favored 'General case' 0 CA--C 1.542 0.656 0 N-CA-C 112.934 0.716 . . . . 72.31 112.934 -176.339 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 3.7 m-20 -82.23 19.21 1.23 Allowed 'General case' 0 CA--C 1.545 0.772 0 N-CA-C 113.314 0.857 . . . . 72.24 113.314 -177.063 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 26' ' ' LEU . . . . . 0.62 ' HG ' ' O ' ' A' ' 23' ' ' PRO . 77.8 mt -50.32 -47.77 55.61 Favored 'General case' 0 N--CA 1.479 0.996 0 O-C-N 121.946 -0.471 . . . . 74.24 111.771 176.86 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 27' ' ' ASP . . . . . 0.442 ' HB3' HD13 ' A' ' 53' ' ' ILE . 1.0 OUTLIER -71.59 -28.7 64.0 Favored 'General case' 0 CA--C 1.539 0.551 0 N-CA-C 112.246 0.461 . . . . 62.3 112.246 179.055 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 34.6 t70 -77.31 -24.15 50.94 Favored 'General case' 0 CA--C 1.544 0.745 0 N-CA-C 111.725 0.268 . . . . 63.11 111.725 -179.784 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 29' ' ' MET . . . . . . . . . . . . . 68.8 mtm -79.07 -178.26 6.04 Favored 'General case' 0 CA--C 1.539 0.55 0 CA-C-O 121.296 0.569 . . . . 70.43 111.95 178.484 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 28.2 mtpp -87.37 165.23 15.75 Favored 'General case' 0 CA--C 1.539 0.523 0 CA-C-O 121.225 0.536 . . . . 71.14 112.094 -177.206 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 42.3 t -62.16 -42.63 95.88 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.556 0 CA-C-N 116.215 -0.448 . . . . 71.23 111.218 179.574 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -54.98 -39.03 68.55 Favored 'General case' 0 CA--C 1.539 0.542 0 CA-C-N 116.163 -0.471 . . . . 73.0 112.193 179.004 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 22.5 mm-40 -60.34 -48.43 81.76 Favored 'General case' 0 N--CA 1.469 0.507 0 CA-C-O 120.933 0.397 . . . . 72.03 111.177 177.954 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 34' ' ' LEU . . . . . 0.434 ' O ' ' HG ' ' A' ' 38' ' ' LEU . 67.8 mt -58.89 -47.04 86.36 Favored 'General case' 0 N--CA 1.468 0.438 0 CA-C-O 121.174 0.511 . . . . 73.52 111.169 178.289 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 35' ' ' LYS . . . . . 0.531 ' HA ' HD12 ' A' ' 38' ' ' LEU . 7.4 mtpm? -58.02 -37.75 74.91 Favored 'General case' 0 CA--C 1.541 0.619 0 CA-C-N 115.969 -0.559 . . . . 65.13 111.258 177.745 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 19.6 tm0? -68.88 -42.73 76.58 Favored 'General case' 0 CA--C 1.544 0.731 0 CA-C-O 120.957 0.408 . . . . 73.24 110.209 177.053 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 37' ' ' GLU . . . . . 0.471 ' HB3' HH21 ' A' ' 41' ' ' ARG . 36.9 mm-40 -58.57 -29.88 66.73 Favored 'General case' 0 N--CA 1.474 0.738 0 CA-C-N 116.287 -0.415 . . . . 64.14 111.937 176.166 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 38' ' ' LEU . . . . . 0.547 HD11 HD22 ' A' ' 52' ' ' LEU . 78.7 mt -73.95 -54.85 7.02 Favored 'General case' 0 CA--C 1.541 0.62 0 CA-C-N 116.137 -0.483 . . . . 74.33 112.126 -179.051 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -57.04 -31.16 64.87 Favored 'General case' 0 N--CA 1.476 0.854 0 N-CA-C 112.423 0.527 . . . . 52.32 112.423 -176.57 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 98.6 mt -61.34 -36.16 79.4 Favored 'General case' 0 N--CA 1.471 0.608 0 CA-C-O 121.235 0.54 . . . . 73.55 111.427 177.366 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 41' ' ' ARG . . . . . 0.471 HH21 ' HB3' ' A' ' 37' ' ' GLU . 13.9 mtm180 -109.03 27.24 9.71 Favored 'General case' 0 CA--C 1.542 0.649 0 CA-C-N 116.002 -0.545 . . . . 73.02 112.307 -175.949 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 38.3 t 68.98 12.63 8.67 Favored 'General case' 0 N--CA 1.48 1.059 0 N-CA-C 112.578 0.585 . . . . 72.1 112.578 173.566 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 71.9 mt -87.47 148.11 43.53 Favored Pre-proline 0 CA--C 1.542 0.661 0 O-C-N 122.333 -0.23 . . . . 72.42 111.137 -179.971 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 44' ' ' PRO . . . . . 0.444 ' O ' HD13 ' A' ' 38' ' ' LEU . 67.9 Cg_endo -70.73 125.35 11.55 Favored 'Trans proline' 0 C--N 1.352 0.752 0 C-N-CA 122.284 1.989 . . . . 71.14 112.637 -177.895 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 45' ' ' VAL . . . . . 0.451 HG12 ' O ' ' A' ' 35' ' ' LYS . 30.5 m -76.72 27.42 0.04 OUTLIER 'Isoleucine or valine' 0 CA--C 1.546 0.808 0 N-CA-C 112.936 0.717 . . . . 74.41 112.936 -176.108 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 68.7 m -123.65 130.51 52.77 Favored 'General case' 0 N--CA 1.471 0.595 0 CA-C-O 121.231 0.539 . . . . 75.24 111.777 -178.428 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 152.29 164.12 12.1 Favored Glycine 0 CA--C 1.528 0.906 0 CA-C-N 115.363 -0.835 . . . . 73.54 112.045 -179.182 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 48' ' ' THR . . . . . 0.424 ' O ' ' HG ' ' A' ' 52' ' ' LEU . 44.1 p -77.09 162.16 27.7 Favored 'General case' 0 N--CA 1.475 0.806 0 CA-C-N 117.629 0.714 . . . . 73.0 111.786 -179.8 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 49' ' ' LYS . . . . . 0.499 ' O ' HG13 ' A' ' 53' ' ' ILE . 24.2 tptm -44.26 -61.57 1.46 Allowed 'General case' 0 N--CA 1.472 0.651 0 CA-C-N 116.032 -0.531 . . . . 72.12 112.154 -178.883 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 50' ' ' THR . . . . . 0.474 ' HA ' HD12 ' A' ' 53' ' ' ILE . 34.6 m -56.59 -45.48 81.37 Favored 'General case' 0 N--CA 1.472 0.643 0 N-CA-C 112.129 0.418 . . . . 73.21 112.129 -176.718 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 48.0 mt-10 -66.09 -41.0 91.24 Favored 'General case' 0 CA--C 1.536 0.433 0 N-CA-C 112.248 0.462 . . . . 75.31 112.248 -176.441 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 52' ' ' LEU . . . . . 0.547 HD22 HD11 ' A' ' 38' ' ' LEU . 62.6 mt -62.8 -42.02 99.54 Favored 'General case' 0 N--CA 1.469 0.517 0 CA-C-O 121.046 0.45 . . . . 70.24 111.24 179.024 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 53' ' ' ILE . . . . . 0.499 HG13 ' O ' ' A' ' 49' ' ' LYS . 35.1 mt -58.02 -54.64 29.38 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.435 0 CA-C-O 121.365 0.603 . . . . 62.24 110.914 176.68 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 54.1 mm-40 -67.23 -24.64 65.84 Favored 'General case' 0 CA--C 1.535 0.39 0 CA-C-N 115.935 -0.575 . . . . 70.42 111.876 179.363 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 37.1 ttm180 -67.06 -45.83 76.2 Favored 'General case' 0 N--CA 1.467 0.419 0 CA-C-O 120.991 0.424 . . . . 73.44 110.408 175.637 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 83.0 mt -60.72 -48.65 80.85 Favored 'General case' 0 CA--C 1.539 0.522 0 CA-C-O 121.125 0.488 . . . . 74.44 111.079 174.925 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 65.7 mtt180 -62.03 -38.25 87.99 Favored 'General case' 0 N--CA 1.469 0.5 0 CA-C-N 116.194 -0.457 . . . . 74.42 111.555 178.246 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -66.08 -40.56 90.94 Favored 'General case' 0 CA--C 1.534 0.328 0 CA-C-O 120.884 0.373 . . . . 73.51 111.068 177.352 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 59' ' ' TYR . . . . . 0.436 ' O ' ' HG2' ' A' ' 62' ' ' GLN . 71.1 t80 -58.91 -48.42 81.53 Favored 'General case' 0 CA--C 1.538 0.494 0 CA-C-N 116.144 -0.48 . . . . 73.24 110.987 177.457 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 60' ' ' GLN . . . . . 0.548 ' HG3' ' HG ' ' A' ' 22' ' ' LEU . 14.3 mm100 -63.35 -42.54 98.93 Favored 'General case' 0 CA--C 1.539 0.537 0 CA-C-O 120.747 0.308 . . . . 71.25 111.275 175.861 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 61' ' ' ASP . . . . . . . . . . . . . 27.0 t70 -56.81 -47.69 79.68 Favored 'General case' 0 CA--C 1.541 0.6 0 N-CA-C 112.022 0.379 . . . . 74.53 112.022 179.498 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 62' ' ' GLN . . . . . 0.436 ' HG2' ' O ' ' A' ' 59' ' ' TYR . 3.4 pt20 . . . . . 0 CA--C 1.539 0.544 0 N-CA-C 112.026 0.38 . . . . 75.22 112.026 -177.343 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 22' ' ' LEU . . . . . 0.426 ' HA ' ' HD3' ' A' ' 23' ' ' PRO . 99.4 mt . . . . . 0 CA--C 1.536 0.436 0 N-CA-C 111.943 0.349 . . . . 65.23 111.943 . . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 23' ' ' PRO . . . . . 0.54 ' O ' ' HG ' ' A' ' 26' ' ' LEU . 11.4 Cg_exo -73.69 152.34 47.69 Favored 'Trans proline' 0 CA--C 1.543 0.937 0 C-N-CA 122.985 2.456 . . . . 72.21 112.681 173.685 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -73.81 -19.44 60.75 Favored 'General case' 0 N--CA 1.471 0.619 0 CA-C-O 121.279 0.562 . . . . 72.54 111.088 175.567 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 15.3 m120 -84.41 24.12 1.02 Allowed 'General case' 0 CA--C 1.541 0.625 0 N-CA-C 112.986 0.736 . . . . 72.15 112.986 -179.486 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 26' ' ' LEU . . . . . 0.54 ' HG ' ' O ' ' A' ' 23' ' ' PRO . 67.2 mt -52.88 -37.4 60.44 Favored 'General case' 0 N--CA 1.479 1.018 0 CA-C-N 118.327 0.512 . . . . 52.41 111.615 179.221 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 4.3 m-20 -68.55 -36.31 78.62 Favored 'General case' 0 CA--C 1.544 0.722 0 CA-C-O 121.278 0.561 . . . . 74.44 111.544 177.707 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 9.1 m-20 -76.32 -37.47 57.35 Favored 'General case' 0 CA--C 1.538 0.509 0 CA-C-N 116.165 -0.471 . . . . 75.23 111.681 179.202 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 29' ' ' MET . . . . . . . . . . . . . 81.4 mtp -59.68 141.78 54.38 Favored 'General case' 0 N--CA 1.466 0.373 0 CA-C-N 115.871 -0.604 . . . . 72.41 112.546 -175.07 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 30' ' ' LYS . . . . . 0.566 ' HB2' ' HG2' ' A' ' 33' ' ' GLU . 48.3 mtmt -68.94 149.38 48.91 Favored 'General case' 0 CA--C 1.539 0.52 0 CA-C-N 115.545 -0.752 . . . . 71.0 111.992 -179.725 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 90.0 t -48.24 -44.47 12.67 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.724 0 CA-C-N 115.868 -0.606 . . . . 62.25 112.194 -179.797 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -61.25 -39.67 91.21 Favored 'General case' 0 N--CA 1.469 0.523 0 N-CA-C 112.12 0.415 . . . . 41.42 112.12 179.252 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 33' ' ' GLU . . . . . 0.566 ' HG2' ' HB2' ' A' ' 30' ' ' LYS . 16.3 mm-40 -68.23 -37.32 80.7 Favored 'General case' 0 N--CA 1.467 0.424 0 CA-C-O 120.971 0.415 . . . . 74.43 111.23 -178.779 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 83.2 mt -61.49 -45.99 91.88 Favored 'General case' 0 CA--C 1.538 0.481 0 CA-C-O 121.23 0.538 . . . . 75.43 110.5 175.56 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 35' ' ' LYS . . . . . 0.469 ' HA ' HD12 ' A' ' 38' ' ' LEU . 96.6 mttt -64.82 -29.13 70.08 Favored 'General case' 0 CA--C 1.539 0.532 0 CA-C-N 116.293 -0.412 . . . . 71.3 111.398 176.684 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 36' ' ' GLN . . . . . 0.505 ' HA ' ' HE3' ' A' ' 39' ' ' LYS . 55.9 tp60 -61.95 -37.39 84.55 Favored 'General case' 0 CA--C 1.539 0.552 0 CA-C-N 116.334 -0.394 . . . . 62.22 111.297 178.256 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 36.6 mt-10 -81.49 -30.2 33.38 Favored 'General case' 0 CA--C 1.539 0.531 0 O-C-N 122.166 -0.334 . . . . 72.13 111.698 176.06 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 38' ' ' LEU . . . . . 0.469 HD12 ' HA ' ' A' ' 35' ' ' LYS . 89.2 mt -58.71 -54.35 48.05 Favored 'General case' 0 N--CA 1.472 0.655 0 CA-C-O 120.741 0.305 . . . . 53.21 111.377 174.94 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 39' ' ' LYS . . . . . 0.505 ' HE3' ' HA ' ' A' ' 36' ' ' GLN . 17.5 ptpt -55.36 -37.13 67.12 Favored 'General case' 0 CA--C 1.543 0.687 0 CA-C-N 116.463 -0.335 . . . . 54.22 111.553 -179.781 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 40' ' ' LEU . . . . . 0.43 ' HG ' ' O ' ' A' ' 36' ' ' GLN . 94.2 mt -69.03 -29.39 67.54 Favored 'General case' 0 CA--C 1.538 0.49 0 N-CA-C 112.002 0.371 . . . . 65.51 112.002 -179.086 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 41' ' ' ARG . . . . . 0.61 HH21 HD23 ' A' ' 56' ' ' LEU . 61.5 mtm180 -105.92 22.82 14.98 Favored 'General case' 0 CA--C 1.542 0.659 0 N-CA-C 112.118 0.414 . . . . 71.44 112.118 -177.78 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 31.1 t 62.69 28.96 16.79 Favored 'General case' 0 N--CA 1.482 1.156 0 CA-C-O 121.33 0.586 . . . . 60.02 112.046 176.133 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 65.3 mt -100.6 148.63 35.24 Favored Pre-proline 0 CA--C 1.543 0.692 0 CA-C-N 116.056 -0.52 . . . . 74.4 111.182 179.125 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 44' ' ' PRO . . . . . . . . . . . . . 56.8 Cg_endo -69.36 130.27 19.53 Favored 'Trans proline' 0 CA--C 1.541 0.852 0 C-N-CA 122.364 2.043 . . . . 55.33 113.094 179.644 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 34.8 m -76.06 -21.77 15.63 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.533 0 CA-C-N 116.153 -0.476 . . . . 52.51 111.618 179.339 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 31.5 t -62.22 101.57 0.23 Allowed 'General case' 0 N--CA 1.473 0.721 0 CA-C-N 116.36 -0.382 . . . . 72.1 111.902 178.501 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 176.89 154.03 11.47 Favored Glycine 0 CA--C 1.532 1.119 0 C-N-CA 120.854 -0.689 . . . . 55.43 114.063 177.516 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 48' ' ' THR . . . . . 0.575 ' O ' ' HG ' ' A' ' 52' ' ' LEU . 44.0 p -76.82 174.06 10.96 Favored 'General case' 0 N--CA 1.476 0.871 0 O-C-N 122.633 -0.333 . . . . 72.13 110.87 174.133 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 49' ' ' LYS . . . . . 0.407 ' HE2' HD11 ' A' ' 53' ' ' ILE . 24.5 tptm -49.85 -49.59 48.64 Favored 'General case' 0 N--CA 1.474 0.745 0 CA-C-O 120.84 0.353 . . . . 75.35 111.357 -179.566 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 50' ' ' THR . . . . . . . . . . . . . 82.7 m -58.27 -50.33 73.98 Favored 'General case' 0 N--CA 1.475 0.783 0 CA-C-O 120.954 0.407 . . . . 70.41 111.317 176.832 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 15.6 mm-40 -54.1 -46.76 72.19 Favored 'General case' 0 N--CA 1.469 0.484 0 CA-C-N 115.846 -0.615 . . . . 64.3 111.803 -179.71 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 52' ' ' LEU . . . . . 0.575 ' HG ' ' O ' ' A' ' 48' ' ' THR . 50.9 mt -63.03 -48.63 77.93 Favored 'General case' 0 CA--C 1.537 0.476 0 CA-C-N 116.304 -0.407 . . . . 73.32 111.309 -178.167 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 53' ' ' ILE . . . . . 0.407 HD11 ' HE2' ' A' ' 49' ' ' LYS . 74.3 mt -59.13 -48.07 88.03 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.568 0 N-CA-C 111.998 0.37 . . . . 61.0 111.998 -179.609 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 54' ' ' GLU . . . . . 0.754 ' HG2' HH21 ' A' ' 57' ' ' ARG . 27.2 mt-10 -68.87 -38.4 79.67 Favored 'General case' 0 CA--C 1.537 0.455 0 O-C-N 122.243 -0.286 . . . . 75.44 111.341 179.49 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 39.7 ttm180 -62.41 -43.83 97.89 Favored 'General case' 0 CA--C 1.539 0.554 0 CA-C-O 120.98 0.419 . . . . 73.33 111.14 177.591 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 56' ' ' LEU . . . . . 0.61 HD23 HH21 ' A' ' 41' ' ' ARG . 48.7 mt -58.76 -51.55 69.51 Favored 'General case' 0 C--O 1.237 0.415 0 CA-C-N 116.206 -0.452 . . . . 75.41 111.057 174.029 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 57' ' ' ARG . . . . . 0.754 HH21 ' HG2' ' A' ' 54' ' ' GLU . 79.0 mtm180 -60.62 -47.59 85.56 Favored 'General case' 0 CA--C 1.538 0.513 0 N-CA-C 112.205 0.446 . . . . 75.31 112.205 -178.761 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -55.12 -51.3 66.88 Favored 'General case' 0 N--CA 1.472 0.646 0 CA-C-O 120.863 0.363 . . . . 63.33 111.936 -178.348 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 59' ' ' TYR . . . . . . . . . . . . . 76.9 t80 -57.56 -41.34 80.84 Favored 'General case' 0 CA--C 1.54 0.596 0 CA-C-O 121.183 0.516 . . . . 61.34 111.59 179.222 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 60' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -74.61 -30.57 61.72 Favored 'General case' 0 N--CA 1.472 0.635 0 CA-C-O 121.381 0.61 . . . . 64.14 110.573 178.857 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 61' ' ' ASP . . . . . . . . . . . . . 8.0 t70 -64.62 -37.16 86.61 Favored 'General case' 0 CA--C 1.541 0.625 0 CA-C-N 115.891 -0.595 . . . . 53.54 111.491 -176.338 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 62' ' ' GLN . . . . . . . . . . . . . 51.5 mt-30 . . . . . 0 CA--C 1.541 0.604 0 N-CA-C 112.129 0.418 . . . . 55.23 112.129 178.872 . . . . . . . . 0 0 . 1 . 016 nuclear nobuild core ' A' A ' 22' ' ' LEU . . . . . 0.449 HD13 ' HB3' ' A' ' 56' ' ' LEU . 94.3 mt . . . . . 0 CA--C 1.538 0.501 0 CA-C-O 120.434 0.159 . . . . 71.44 110.61 . . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 23' ' ' PRO . . . . . 0.468 ' O ' ' HG ' ' A' ' 26' ' ' LEU . 37.8 Cg_endo -64.92 139.22 60.96 Favored 'Trans proline' 0 CA--C 1.54 0.805 0 C-N-CA 122.605 2.204 . . . . 64.11 113.134 -178.386 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -72.15 -2.83 20.12 Favored 'General case' 0 CA--C 1.543 0.694 0 CA-C-O 121.04 0.448 . . . . 71.51 111.874 179.124 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 11.2 m120 -82.54 18.73 1.42 Allowed 'General case' 0 CA--C 1.542 0.658 0 N-CA-C 112.183 0.438 . . . . 73.13 112.183 -178.768 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 26' ' ' LEU . . . . . 0.468 ' HG ' ' O ' ' A' ' 23' ' ' PRO . 90.7 mt -58.18 -40.12 80.67 Favored 'General case' 0 N--CA 1.471 0.612 0 CA-C-O 120.842 0.353 . . . . 70.11 111.84 -178.632 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 7.3 m-20 -63.28 -34.81 78.49 Favored 'General case' 0 CA--C 1.539 0.534 0 CA-C-O 120.978 0.418 . . . . 71.15 111.206 175.283 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 36.6 t70 -72.45 -42.55 64.89 Favored 'General case' 0 CA--C 1.542 0.66 0 CA-C-N 116.255 -0.43 . . . . 74.52 111.533 -178.649 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 29' ' ' MET . . . . . . . . . . . . . 50.2 mtm -68.92 159.81 31.95 Favored 'General case' 0 N--CA 1.471 0.606 0 CA-C-O 121.092 0.472 . . . . 71.23 111.608 179.279 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 54.5 mtpt -88.9 171.43 9.91 Favored 'General case' 0 CA--C 1.54 0.583 0 N-CA-C 112.689 0.626 . . . . 73.25 112.689 -173.623 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 31' ' ' VAL . . . . . 0.474 HG22 ' HD3' ' A' ' 49' ' ' LYS . 86.5 t -56.66 -47.89 81.59 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.615 0 CA-C-N 115.798 -0.637 . . . . 41.11 112.372 -176.74 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -58.67 -38.52 78.37 Favored 'General case' 0 CA--C 1.536 0.426 0 CA-C-N 116.448 -0.342 . . . . 53.25 111.871 -179.353 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 37.4 mt-10 -69.73 -41.86 74.73 Favored 'General case' 0 CA--C 1.537 0.469 0 CA-C-O 121.114 0.483 . . . . 73.44 111.192 179.42 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 95.4 mt -63.34 -47.21 83.11 Favored 'General case' 0 CA--C 1.54 0.559 0 CA-C-N 116.346 -0.388 . . . . 52.43 111.305 178.171 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 35' ' ' LYS . . . . . 0.473 ' HE2' ' O ' ' A' ' 45' ' ' VAL . 98.5 mttt -61.31 -35.66 77.98 Favored 'General case' 0 CA--C 1.537 0.464 0 CA-C-N 116.577 -0.283 . . . . 72.01 111.513 177.598 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 36' ' ' GLN . . . . . 0.499 ' NE2' HD11 ' A' ' 40' ' ' LEU . 22.4 tm0? -60.59 -44.52 96.16 Favored 'General case' 0 CA--C 1.539 0.536 0 CA-C-O 120.868 0.366 . . . . 72.13 110.771 177.38 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 37' ' ' GLU . . . . . 0.594 ' HB3' ' NH2' ' A' ' 41' ' ' ARG . 24.8 mm-40 -64.31 -41.03 97.03 Favored 'General case' 0 CA--C 1.543 0.698 0 CA-C-N 116.329 -0.396 . . . . 74.23 111.884 175.04 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 38' ' ' LEU . . . . . 0.482 ' HB2' HG12 ' A' ' 45' ' ' VAL . 88.5 mt -62.24 -56.01 22.81 Favored 'General case' 0 N--CA 1.472 0.628 0 N-CA-C 112.164 0.431 . . . . 70.34 112.164 179.552 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 18.6 ptpt -57.03 -34.75 68.52 Favored 'General case' 0 N--CA 1.473 0.683 0 N-CA-C 112.582 0.586 . . . . 75.11 112.582 -174.475 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 40' ' ' LEU . . . . . 0.499 HD11 ' NE2' ' A' ' 36' ' ' GLN . 92.7 mt -63.55 -33.5 75.72 Favored 'General case' 0 N--CA 1.473 0.679 0 CA-C-O 120.904 0.383 . . . . 70.53 111.694 177.91 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 41' ' ' ARG . . . . . 0.764 HH21 HD22 ' A' ' 56' ' ' LEU . 70.0 mtm-85 -105.69 23.11 14.4 Favored 'General case' 0 CA--C 1.54 0.565 0 CA-C-N 116.44 -0.346 . . . . 71.42 111.923 -178.013 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 23.2 t 64.48 22.81 12.79 Favored 'General case' 0 N--CA 1.478 0.959 0 N-CA-C 112.317 0.488 . . . . 64.22 112.317 173.134 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 72.5 mt -92.12 134.39 28.65 Favored Pre-proline 0 CA--C 1.546 0.805 0 CA-C-N 116.626 -0.261 . . . . 62.21 111.611 -178.482 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 44' ' ' PRO . . . . . 0.513 ' HD2' ' HD3' ' A' ' 55' ' ' ARG . 77.8 Cg_exo -52.06 115.37 2.12 Favored 'Trans proline' 0 C--N 1.356 0.949 0 C-N-CA 122.994 2.463 . . . . 53.31 113.71 178.638 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 45' ' ' VAL . . . . . 0.482 HG12 ' HB2' ' A' ' 38' ' ' LEU . 33.0 m -85.5 -10.77 11.4 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.608 0 N-CA-C 112.523 0.564 . . . . 71.45 112.523 -178.955 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 33.2 t -80.9 32.3 0.32 Allowed 'General case' 0 N--CA 1.481 1.1 0 N-CA-C 113.064 0.764 . . . . 70.03 113.064 -173.424 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . -107.8 176.45 20.67 Favored Glycine 0 CA--C 1.527 0.833 0 C-N-CA 121.028 -0.606 . . . . 72.24 113.471 179.459 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 48' ' ' THR . . . . . 0.556 ' O ' ' HG ' ' A' ' 52' ' ' LEU . 72.3 p -76.31 163.14 27.3 Favored 'General case' 0 N--CA 1.475 0.812 0 O-C-N 122.668 -0.313 . . . . 72.44 111.372 176.829 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 49' ' ' LYS . . . . . 0.474 ' HD3' HG22 ' A' ' 31' ' ' VAL . 29.6 tptp -44.37 -44.24 8.14 Favored 'General case' 0 N--CA 1.473 0.721 0 CA-C-O 120.962 0.41 . . . . 63.24 111.795 178.169 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 50' ' ' THR . . . . . . . . . . . . . 30.5 m -68.2 -44.79 75.06 Favored 'General case' 0 CA--C 1.538 0.504 0 CA-C-N 116.213 -0.449 . . . . 65.32 111.675 179.037 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 44.0 mt-10 -60.7 -42.47 97.24 Favored 'General case' 0 N--CA 1.471 0.611 0 N-CA-C 111.952 0.352 . . . . 71.2 111.952 179.446 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 52' ' ' LEU . . . . . 0.556 ' HG ' ' O ' ' A' ' 48' ' ' THR . 46.7 mt -54.81 -39.2 68.26 Favored 'General case' 0 N--CA 1.469 0.523 0 CA-C-O 121.504 0.669 . . . . 75.12 110.325 178.457 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 53' ' ' ILE . . . . . . . . . . . . . 88.5 mt -70.25 -58.09 6.34 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.517 0 CA-C-N 115.184 -0.916 . . . . 70.44 111.911 179.287 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 40.6 mt-10 -61.29 -31.7 71.53 Favored 'General case' 0 N--CA 1.468 0.469 0 N-CA-C 111.897 0.332 . . . . 53.34 111.897 -178.019 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 55' ' ' ARG . . . . . 0.513 ' HD3' ' HD2' ' A' ' 44' ' ' PRO . 35.2 ttm180 -65.53 -41.22 93.3 Favored 'General case' 0 CA--C 1.538 0.486 0 CA-C-O 120.76 0.314 . . . . 65.41 111.258 177.187 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 56' ' ' LEU . . . . . 0.764 HD22 HH21 ' A' ' 41' ' ' ARG . 79.6 mt -63.72 -47.7 80.07 Favored 'General case' 0 CA--C 1.537 0.46 0 CA-C-O 121.023 0.44 . . . . 52.01 111.043 174.015 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 74.6 mtp180 -61.67 -43.12 99.45 Favored 'General case' 0 CA--C 1.54 0.583 0 CA-C-N 116.098 -0.501 . . . . 72.12 111.466 179.328 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -64.8 -39.51 93.71 Favored 'General case' 0 N--CA 1.469 0.507 0 CA-C-N 116.419 -0.355 . . . . 33.01 111.673 179.456 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 59' ' ' TYR . . . . . . . . . . . . . 84.8 t80 -64.56 -47.29 79.28 Favored 'General case' 0 CA--C 1.537 0.468 0 CA-C-O 120.977 0.418 . . . . 71.32 110.677 176.371 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 60' ' ' GLN . . . . . . . . . . . . . 8.4 tp-100 -60.15 -41.35 92.56 Favored 'General case' 0 CA--C 1.54 0.564 0 CA-C-O 121.092 0.472 . . . . 73.41 110.914 176.664 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 61' ' ' ASP . . . . . . . . . . . . . 26.9 t70 -59.86 -49.4 77.87 Favored 'General case' 0 CA--C 1.543 0.704 0 CA-C-N 115.895 -0.593 . . . . 65.44 111.959 179.863 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 62' ' ' GLN . . . . . . . . . . . . . 10.8 pt20 . . . . . 0 CA--C 1.542 0.64 0 N-CA-C 112.681 0.623 . . . . 65.2 112.681 -176.573 . . . . . . . . 0 0 . 1 . 017 nuclear nobuild core ' A' A ' 22' ' ' LEU . . . . . 0.489 ' HB3' HD11 ' A' ' 26' ' ' LEU . 59.0 mt . . . . . 0 N--CA 1.469 0.486 0 CA-C-O 120.685 0.279 . . . . 73.45 111.714 . . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 23' ' ' PRO . . . . . 0.477 ' O ' ' HG ' ' A' ' 26' ' ' LEU . 53.6 Cg_exo -54.74 143.3 70.71 Favored 'Trans proline' 0 CA--C 1.541 0.833 0 C-N-CA 122.68 2.253 . . . . 74.23 112.523 173.899 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -72.02 -23.47 61.4 Favored 'General case' 0 CA--C 1.538 0.51 0 N-CA-C 112.36 0.504 . . . . 63.11 112.36 -177.547 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 25' ' ' ASN . . . . . 0.561 ' HB3' ' HB3' ' A' ' 28' ' ' ASP . 47.8 m-80 -102.13 27.13 6.91 Favored 'General case' 0 CA--C 1.543 0.702 0 N-CA-C 113.063 0.764 . . . . 75.15 113.063 -175.964 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 26' ' ' LEU . . . . . 0.489 HD11 ' HB3' ' A' ' 22' ' ' LEU . 71.5 mt -49.83 -42.37 47.13 Favored 'General case' 0 N--CA 1.479 1.017 0 CA-C-O 120.976 0.417 . . . . 65.12 111.973 177.738 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 3.7 m-20 -66.81 -35.11 79.31 Favored 'General case' 0 CA--C 1.543 0.676 0 CA-C-O 121.13 0.49 . . . . 75.22 111.286 178.402 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 28' ' ' ASP . . . . . 0.561 ' HB3' ' HB3' ' A' ' 25' ' ' ASN . 21.5 t70 -73.07 -31.49 64.42 Favored 'General case' 0 CA--C 1.542 0.649 0 CA-C-N 116.18 -0.464 . . . . 63.43 111.239 -179.732 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 29' ' ' MET . . . . . 0.463 ' HG3' ' O ' ' A' ' 25' ' ' ASN . 86.9 mtp -63.84 156.31 27.85 Favored 'General case' 0 CA--C 1.541 0.604 0 CA-C-O 121.434 0.635 . . . . 52.55 112.288 -177.531 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 30' ' ' LYS . . . . . 0.454 ' HB2' ' HG3' ' A' ' 33' ' ' GLU . 55.3 mtpt -80.82 157.78 25.62 Favored 'General case' 0 CA--C 1.538 0.515 0 CA-C-N 116.012 -0.54 . . . . 74.14 111.836 -178.643 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 31' ' ' VAL . . . . . 0.584 HG22 ' HB2' ' A' ' 49' ' ' LYS . 16.0 t -52.14 -50.77 34.61 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.614 0 CA-C-N 115.961 -0.563 . . . . 74.14 112.188 -176.61 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -64.1 -27.69 69.26 Favored 'General case' 0 CA--C 1.539 0.546 0 N-CA-C 112.435 0.532 . . . . 75.42 112.435 -179.714 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 33' ' ' GLU . . . . . 0.454 ' HG3' ' HB2' ' A' ' 30' ' ' LYS . 40.6 mt-10 -72.92 -42.36 63.6 Favored 'General case' 0 N--CA 1.469 0.51 0 CA-C-O 120.899 0.381 . . . . 74.44 110.809 179.248 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 84.8 mt -59.94 -35.22 74.46 Favored 'General case' 0 N--CA 1.469 0.522 0 CA-C-O 121.308 0.575 . . . . 65.41 110.805 174.898 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 35' ' ' LYS . . . . . 0.499 ' HE3' HG12 ' A' ' 31' ' ' VAL . 99.3 mttt -64.89 -30.14 71.12 Favored 'General case' 0 CA--C 1.537 0.473 0 CA-C-N 115.998 -0.546 . . . . 62.32 111.668 176.262 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 57.2 tp60 -66.73 -44.15 82.32 Favored 'General case' 0 CA--C 1.539 0.545 0 CA-C-O 120.934 0.397 . . . . 72.4 110.402 173.954 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 14.1 mm-40 -54.8 -51.9 64.34 Favored 'General case' 0 N--CA 1.471 0.575 0 CA-C-O 121.425 0.631 . . . . 65.31 110.895 173.887 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 38' ' ' LEU . . . . . 0.452 ' CD1' HD22 ' A' ' 52' ' ' LEU . 90.6 mt -58.74 -53.46 58.08 Favored 'General case' 0 CA--C 1.541 0.628 0 N-CA-C 113.207 0.817 . . . . 61.11 113.207 -176.773 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 18.2 ptpt -59.09 -33.67 71.1 Favored 'General case' 0 N--CA 1.474 0.768 0 N-CA-C 112.511 0.559 . . . . 72.11 112.511 -174.462 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 97.4 mt -67.8 -10.83 56.16 Favored 'General case' 0 N--CA 1.471 0.603 0 CA-C-O 121.072 0.463 . . . . 75.22 111.532 178.264 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 41' ' ' ARG . . . . . . . . . . . . . 33.8 mtt180 -123.1 15.77 9.91 Favored 'General case' 0 CA--C 1.54 0.564 0 CA-C-N 116.182 -0.463 . . . . 75.54 111.121 -177.058 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 69.8 m 60.85 31.56 20.04 Favored 'General case' 0 N--CA 1.476 0.862 0 CA-C-N 116.192 -0.458 . . . . 45.43 111.868 -179.224 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 43' ' ' LEU . . . . . 0.404 ' HB3' HD22 ' A' ' 38' ' ' LEU . 83.7 mt -98.6 137.2 20.61 Favored Pre-proline 0 CA--C 1.543 0.676 0 CA-C-N 116.488 -0.324 . . . . 74.42 111.378 179.443 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 44' ' ' PRO . . . . . . . . . . . . . 32.0 Cg_endo -64.06 130.12 26.42 Favored 'Trans proline' 0 CA--C 1.543 0.971 0 C-N-CA 122.941 2.427 . . . . 72.41 113.122 -178.746 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 45' ' ' VAL . . . . . 0.415 HG12 ' HB2' ' A' ' 38' ' ' LEU . 23.0 m -102.34 15.04 5.69 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.725 0 CA-C-N 115.953 -0.567 . . . . 71.2 112.027 -176.154 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 29.6 t -68.47 -43.12 77.68 Favored 'General case' 0 N--CA 1.474 0.733 0 N-CA-C 113.479 0.918 . . . . 73.51 113.479 -174.053 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . -71.52 179.97 32.41 Favored Glycine 0 CA--C 1.528 0.903 0 N-CA-C 115.393 0.917 . . . . 43.14 115.393 -170.898 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 48' ' ' THR . . . . . 0.575 ' O ' ' HG ' ' A' ' 52' ' ' LEU . 69.4 p -77.05 170.6 16.24 Favored 'General case' 0 N--CA 1.471 0.582 0 C-N-CA 122.86 0.464 . . . . 74.43 111.647 178.365 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 49' ' ' LYS . . . . . 0.584 ' HB2' HG22 ' A' ' 31' ' ' VAL . 88.2 tttt -50.53 -51.82 44.25 Favored 'General case' 0 N--CA 1.47 0.563 0 N-CA-C 112.41 0.522 . . . . 75.43 112.41 -176.794 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 50' ' ' THR . . . . . . . . . . . . . 91.5 m -54.9 -44.77 74.43 Favored 'General case' 0 N--CA 1.471 0.6 0 CA-C-O 120.79 0.329 . . . . 71.13 111.141 178.157 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 49.3 mt-10 -59.38 -42.25 91.25 Favored 'General case' 0 N--CA 1.47 0.554 0 CA-C-O 120.973 0.416 . . . . 63.23 111.319 177.066 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 52' ' ' LEU . . . . . 0.575 ' HG ' ' O ' ' A' ' 48' ' ' THR . 32.9 mt -65.38 -47.04 77.73 Favored 'General case' 0 CA--C 1.539 0.545 0 CA-C-N 116.312 -0.404 . . . . 64.43 111.141 -179.655 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 53' ' ' ILE . . . . . . . . . . . . . 66.9 mt -58.14 -50.46 78.16 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.545 0 CA-C-O 120.84 0.352 . . . . 71.51 111.117 178.235 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 47.3 mt-10 -58.35 -41.81 85.52 Favored 'General case' 0 CA--C 1.536 0.413 0 CA-C-N 116.347 -0.388 . . . . 73.33 111.181 177.702 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 41.7 ttm180 -63.3 -40.19 96.67 Favored 'General case' 0 CA--C 1.543 0.703 0 CA-C-N 116.586 -0.279 . . . . 63.42 111.471 178.592 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 78.9 mt -62.13 -51.27 68.54 Favored 'General case' 0 N--CA 1.47 0.544 0 CA-C-O 121.098 0.475 . . . . 53.33 111.366 175.113 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 55.1 mtt180 -74.4 -18.42 60.66 Favored 'General case' 0 CA--C 1.542 0.639 0 CA-C-N 116.268 -0.424 . . . . 70.24 111.999 -178.267 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -76.03 -42.68 47.12 Favored 'General case' 0 N--CA 1.468 0.464 0 CA-C-O 121.162 0.505 . . . . 74.34 110.333 170.596 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 59' ' ' TYR . . . . . . . . . . . . . 48.6 t80 -62.91 -27.35 69.31 Favored 'General case' 0 CA--C 1.54 0.577 0 CA-C-N 115.932 -0.576 . . . . 70.41 110.452 175.32 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 60' ' ' GLN . . . . . 0.478 ' HB2' HD11 ' A' ' 22' ' ' LEU . 8.4 tp-100 -76.45 -40.43 50.53 Favored 'General case' 0 CA--C 1.542 0.635 0 CA-C-N 115.919 -0.582 . . . . 65.52 111.664 177.009 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 61' ' ' ASP . . . . . . . . . . . . . 26.8 t70 -56.44 -26.66 54.38 Favored 'General case' 0 CA--C 1.547 0.837 0 N-CA-C 112.211 0.448 . . . . 63.32 112.211 -176.888 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 62' ' ' GLN . . . . . . . . . . . . . 14.1 pt20 . . . . . 0 CA--C 1.546 0.797 0 N-CA-C 112.345 0.498 . . . . 74.22 112.345 -178.791 . . . . . . . . 0 0 . 1 . 018 nuclear nobuild core ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 92.1 mt . . . . . 0 CA--C 1.541 0.602 0 CA-C-O 120.498 0.19 . . . . 75.24 110.989 . . . . . . . . . 0 0 . 1 . 018 nuclear nobuild core ' A' A ' 23' ' ' PRO . . . . . . . . . . . . . 19.2 Cg_endo -59.21 142.24 98.96 Favored 'Trans proline' 0 CA--C 1.54 0.82 0 C-N-CA 122.692 2.261 . . . . 70.02 112.931 -179.818 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -75.26 -24.41 57.61 Favored 'General case' 0 N--CA 1.469 0.49 0 CA-C-O 120.861 0.363 . . . . 54.2 111.833 -179.853 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 85.5 m-20 -86.49 36.67 0.71 Allowed 'General case' 0 CA--C 1.544 0.715 0 N-CA-C 112.873 0.694 . . . . 63.13 112.873 -175.705 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 26' ' ' LEU . . . . . 0.539 HD23 ' SD ' ' A' ' 29' ' ' MET . 87.5 mt -55.74 -29.28 59.29 Favored 'General case' 0 N--CA 1.475 0.795 0 CA-C-O 121.111 0.482 . . . . 65.22 110.856 175.433 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 3.6 m-20 -64.47 -35.33 80.58 Favored 'General case' 0 CA--C 1.541 0.627 0 CA-C-N 116.073 -0.512 . . . . 65.05 111.343 176.019 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 31.3 m-20 -81.71 -22.28 37.48 Favored 'General case' 0 CA--C 1.537 0.467 0 CA-C-O 121.062 0.458 . . . . 65.31 111.306 177.452 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 29' ' ' MET . . . . . 0.539 ' SD ' HD23 ' A' ' 26' ' ' LEU . 85.1 mtp -72.47 124.42 25.15 Favored 'General case' 0 CA--C 1.536 0.436 0 CA-C-O 120.958 0.409 . . . . 75.42 110.512 175.104 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 61.1 mtpt -72.42 170.53 14.08 Favored 'General case' 0 CA--C 1.537 0.459 0 CA-C-O 120.988 0.423 . . . . 72.22 111.807 -177.04 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 45.8 t -53.19 -46.76 56.41 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.659 0 CA-C-N 116.039 -0.528 . . . . 72.04 111.8 -175.475 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -61.45 -40.55 94.89 Favored 'General case' 0 N--CA 1.469 0.507 0 N-CA-C 112.064 0.394 . . . . 64.1 112.064 179.441 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 39.7 mt-10 -64.28 -46.39 83.87 Favored 'General case' 0 CA--C 1.537 0.471 0 CA-C-O 120.991 0.424 . . . . 73.15 111.117 179.42 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 92.9 mt -63.81 -49.17 73.93 Favored 'General case' 0 N--CA 1.47 0.53 0 CA-C-N 116.159 -0.473 . . . . 63.31 111.646 178.18 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 35' ' ' LYS . . . . . 0.427 ' HG2' ' HB ' ' A' ' 45' ' ' VAL . 56.1 mtpt -52.83 -45.18 67.18 Favored 'General case' 0 N--CA 1.473 0.678 0 CA-C-O 121.203 0.525 . . . . 71.21 111.149 175.252 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 36' ' ' GLN . . . . . 0.548 ' O ' ' HG ' ' A' ' 40' ' ' LEU . 1.0 OUTLIER -57.75 -49.6 76.02 Favored 'General case' 0 CA--C 1.541 0.632 0 CA-C-N 115.761 -0.654 . . . . 65.35 110.673 177.553 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 37' ' ' GLU . . . . . 0.416 ' HB3' ' NH2' ' A' ' 41' ' ' ARG . 55.8 mm-40 -62.47 -35.14 78.39 Favored 'General case' 0 N--CA 1.471 0.578 0 N-CA-C 112.183 0.438 . . . . 73.05 112.183 178.743 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 38' ' ' LEU . . . . . 0.49 ' HB2' HG12 ' A' ' 45' ' ' VAL . 91.9 mt -66.53 -54.6 21.97 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-O 120.929 0.395 . . . . 63.41 111.591 177.88 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 17.6 ptmt -63.87 -24.2 67.65 Favored 'General case' 0 CA--C 1.541 0.616 0 N-CA-C 112.337 0.495 . . . . 60.14 112.337 -174.229 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 40' ' ' LEU . . . . . 0.548 ' HG ' ' O ' ' A' ' 36' ' ' GLN . 78.6 mt -58.03 -38.52 76.39 Favored 'General case' 0 N--CA 1.472 0.661 0 CA-C-O 121.421 0.629 . . . . 75.11 111.017 172.804 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 41' ' ' ARG . . . . . 0.416 ' NH2' ' HB3' ' A' ' 37' ' ' GLU . 41.6 mtm-85 -108.72 25.27 11.94 Favored 'General case' 0 CA--C 1.539 0.54 0 CA-C-N 115.514 -0.766 . . . . 73.13 111.724 -175.831 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 48.7 m 64.88 15.77 10.1 Favored 'General case' 0 N--CA 1.48 1.045 0 N-CA-C 112.877 0.695 . . . . 53.41 112.877 175.619 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 75.4 mt -79.57 140.52 55.55 Favored Pre-proline 0 CA--C 1.54 0.579 0 C-N-CA 122.029 0.132 . . . . 74.3 111.221 178.998 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 44' ' ' PRO . . . . . 0.458 ' HD2' ' HD3' ' A' ' 55' ' ' ARG . 41.4 Cg_endo -66.0 126.1 15.28 Favored 'Trans proline' 0 CA--C 1.538 0.717 0 C-N-CA 122.227 1.951 . . . . 73.2 112.452 -178.829 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 45' ' ' VAL . . . . . 0.49 HG12 ' HB2' ' A' ' 38' ' ' LEU . 21.5 m -94.04 -8.23 9.92 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.476 0 CA-C-O 121.103 0.478 . . . . 73.11 111.767 -177.352 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 38.6 m -76.7 74.85 3.37 Favored 'General case' 0 N--CA 1.47 0.534 0 CA-C-O 121.119 0.485 . . . . 60.52 111.938 -177.615 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . -166.89 177.2 41.71 Favored Glycine 0 CA--C 1.524 0.62 0 C-N-CA 121.298 -0.477 . . . . 71.54 112.909 176.2 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 48' ' ' THR . . . . . 0.552 ' O ' ' HG ' ' A' ' 52' ' ' LEU . 31.1 p -72.04 159.06 34.83 Favored 'General case' 0 N--CA 1.471 0.614 0 O-C-N 122.535 -0.391 . . . . 73.52 110.957 179.178 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 49' ' ' LYS . . . . . 0.424 ' HE3' ' O ' ' A' ' 29' ' ' MET . 87.4 tttt -48.84 -35.98 15.82 Favored 'General case' 0 N--CA 1.471 0.585 0 CA-C-O 121.174 0.511 . . . . 73.2 110.897 176.481 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 50' ' ' THR . . . . . 0.427 ' O ' ' HG3' ' A' ' 54' ' ' GLU . 10.1 m -58.24 -53.87 53.36 Favored 'General case' 0 N--CA 1.467 0.399 0 CA-C-N 115.726 -0.67 . . . . 64.53 110.979 176.367 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 41.1 mt-10 -58.16 -40.38 81.25 Favored 'General case' 0 N--CA 1.468 0.467 0 CA-C-N 116.076 -0.511 . . . . 64.21 111.66 178.526 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 52' ' ' LEU . . . . . 0.552 ' HG ' ' O ' ' A' ' 48' ' ' THR . 22.4 mt -60.68 -43.49 97.66 Favored 'General case' 0 CA--C 1.542 0.638 0 CA-C-O 121.155 0.502 . . . . 62.31 111.123 -179.843 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 53' ' ' ILE . . . . . . . . . . . . . 78.7 mt -65.5 -52.03 56.25 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.686 0 CA-C-N 116.162 -0.472 . . . . 65.45 111.36 177.065 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 54' ' ' GLU . . . . . 0.427 ' HG3' ' O ' ' A' ' 50' ' ' THR . 45.5 mt-10 -55.88 -42.54 76.09 Favored 'General case' 0 N--CA 1.471 0.622 0 CA-C-O 121.204 0.526 . . . . 65.31 111.068 178.966 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 55' ' ' ARG . . . . . 0.458 ' HD3' ' HD2' ' A' ' 44' ' ' PRO . 30.0 ttm180 -65.22 -43.89 90.02 Favored 'General case' 0 CA--C 1.539 0.55 0 CA-C-N 115.681 -0.69 . . . . 75.42 112.187 -177.171 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 51.1 mt -62.35 -47.28 84.91 Favored 'General case' 0 CA--C 1.54 0.561 0 O-C-N 122.249 -0.282 . . . . 74.23 111.288 175.881 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 98.3 mtt180 -57.92 -51.46 69.52 Favored 'General case' 0 N--CA 1.471 0.577 0 CA-C-O 120.971 0.415 . . . . 72.22 111.139 176.788 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -61.36 -37.87 84.92 Favored 'General case' 0 N--CA 1.47 0.563 0 CA-C-N 116.143 -0.48 . . . . 70.04 112.276 -178.854 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 59' ' ' TYR . . . . . . . . . . . . . 69.7 t80 -68.98 -44.34 73.08 Favored 'General case' 0 CA--C 1.538 0.507 0 CA-C-O 120.765 0.317 . . . . 62.23 111.523 179.069 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 60' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -65.62 -41.92 92.13 Favored 'General case' 0 CA--C 1.542 0.655 0 CA-C-O 121.596 0.712 . . . . 74.11 109.993 177.403 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 61' ' ' ASP . . . . . . . . . . . . . 21.6 t70 -60.16 -29.91 68.97 Favored 'General case' 0 CA--C 1.543 0.684 0 CA-C-N 115.486 -0.779 . . . . 75.34 112.189 -178.762 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 62' ' ' GLN . . . . . . . . . . . . . 10.9 pt20 . . . . . 0 N--CA 1.473 0.723 0 N-CA-C 112.468 0.544 . . . . 65.45 112.468 -178.33 . . . . . . . . 0 0 . 1 . 019 nuclear nobuild core ' A' A ' 22' ' ' LEU . . . . . 0.405 ' HA ' ' HD3' ' A' ' 23' ' ' PRO . 86.9 mt . . . . . 0 CA--C 1.536 0.411 0 CA-C-O 120.38 0.133 . . . . 53.31 110.957 . . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 23' ' ' PRO . . . . . 0.592 ' O ' ' HG ' ' A' ' 26' ' ' LEU . 28.0 Cg_exo -62.03 147.19 95.61 Favored 'Trans proline' 0 CA--C 1.537 0.67 0 C-N-CA 122.213 1.942 . . . . 74.24 112.109 176.448 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -67.18 -20.16 65.68 Favored 'General case' 0 CA--C 1.538 0.511 0 CA-C-O 121.166 0.507 . . . . 64.15 111.33 177.563 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 25' ' ' ASN . . . . . 0.45 ' O ' ' HG3' ' A' ' 29' ' ' MET . 8.1 m120 -89.33 23.3 2.57 Favored 'General case' 0 CA--C 1.547 0.85 0 N-CA-C 112.694 0.628 . . . . 71.34 112.694 -174.875 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 26' ' ' LEU . . . . . 0.592 ' HG ' ' O ' ' A' ' 23' ' ' PRO . 67.7 mt -48.04 -56.61 7.31 Favored 'General case' 0 N--CA 1.478 0.952 0 N-CA-C 112.851 0.686 . . . . 74.13 112.851 -177.151 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 8.2 p-10 -77.48 -7.91 56.95 Favored 'General case' 0 CA--C 1.541 0.614 0 N-CA-C 112.294 0.479 . . . . 54.25 112.294 -176.226 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 16.4 m-20 -90.85 -26.87 19.17 Favored 'General case' 0 CA--C 1.542 0.637 0 N-CA-C 111.75 0.278 . . . . 71.32 111.75 177.604 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 29' ' ' MET . . . . . 0.45 ' HG3' ' O ' ' A' ' 25' ' ' ASN . 59.1 mtm -70.65 169.26 14.73 Favored 'General case' 0 N--CA 1.472 0.659 0 CA-C-O 121.366 0.603 . . . . 75.03 112.194 -178.558 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 30' ' ' LYS . . . . . 0.455 ' HB2' ' HG2' ' A' ' 33' ' ' GLU . 52.1 mtpt -76.98 157.66 31.1 Favored 'General case' 0 CA--C 1.536 0.427 0 CA-C-N 115.99 -0.55 . . . . 74.41 111.441 177.118 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 87.9 t -57.58 -40.17 73.59 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.5 0 CA-C-O 121.024 0.44 . . . . 63.44 110.643 175.451 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -59.51 -36.19 75.61 Favored 'General case' 0 CA--C 1.539 0.542 0 CA-C-N 116.135 -0.484 . . . . 75.43 111.775 177.04 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 33' ' ' GLU . . . . . 0.455 ' HG2' ' HB2' ' A' ' 30' ' ' LYS . 16.8 mm-40 -70.72 -40.99 72.47 Favored 'General case' 0 N--CA 1.47 0.536 0 CA-C-O 120.995 0.426 . . . . 63.01 110.73 178.309 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 34' ' ' LEU . . . . . 0.442 HD13 ' HB2' ' A' ' 52' ' ' LEU . 94.9 mt -59.07 -47.19 86.15 Favored 'General case' 0 CA--C 1.538 0.499 0 CA-C-O 121.021 0.439 . . . . 74.44 110.578 174.471 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 35' ' ' LYS . . . . . 0.57 ' HA ' HD12 ' A' ' 38' ' ' LEU . 95.5 mttt -59.72 -33.76 72.04 Favored 'General case' 0 N--CA 1.47 0.545 0 CA-C-N 116.295 -0.411 . . . . 74.13 111.469 176.253 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 36' ' ' GLN . . . . . 0.416 ' O ' ' HG ' ' A' ' 40' ' ' LEU . 22.8 tm0? -60.93 -47.99 83.85 Favored 'General case' 0 CA--C 1.537 0.448 0 CA-C-N 116.385 -0.37 . . . . 73.32 110.936 178.261 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 37' ' ' GLU . . . . . 0.468 ' HB3' ' NH2' ' A' ' 41' ' ' ARG . 29.5 mt-10 -67.86 -39.39 83.78 Favored 'General case' 0 CA--C 1.54 0.576 0 CA-C-O 120.824 0.345 . . . . 71.31 111.904 176.616 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 38' ' ' LEU . . . . . 0.57 HD12 ' HA ' ' A' ' 35' ' ' LYS . 83.9 mt -57.42 -55.42 34.99 Favored 'General case' 0 N--CA 1.471 0.606 0 N-CA-C 111.921 0.341 . . . . 70.42 111.921 179.189 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 17.7 ptpt -57.35 -30.6 64.97 Favored 'General case' 0 CA--C 1.542 0.645 0 N-CA-C 112.251 0.463 . . . . 75.13 112.251 -176.72 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 40' ' ' LEU . . . . . 0.416 ' HG ' ' O ' ' A' ' 36' ' ' GLN . 89.3 mt -68.2 -38.98 82.55 Favored 'General case' 0 N--CA 1.469 0.524 0 CA-C-O 120.926 0.393 . . . . 55.3 111.389 177.29 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 41' ' ' ARG . . . . . 0.685 HH21 HD22 ' A' ' 56' ' ' LEU . 0.0 OUTLIER -100.32 22.2 11.93 Favored 'General case' 0 CA--C 1.543 0.696 0 N-CA-C 112.055 0.391 . . . . 74.34 112.055 -179.211 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 44.1 t 62.32 27.96 16.67 Favored 'General case' 0 N--CA 1.481 1.087 0 N-CA-C 112.462 0.542 . . . . 74.43 112.462 174.619 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 70.6 mt -93.37 143.41 26.64 Favored Pre-proline 0 CA--C 1.543 0.705 0 CA-C-N 116.385 -0.371 . . . . 44.05 111.915 -179.312 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 44' ' ' PRO . . . . . 0.489 ' HD2' ' HD3' ' A' ' 55' ' ' ARG . 41.4 Cg_exo -57.07 119.54 6.86 Favored 'Trans proline' 0 CA--C 1.542 0.901 0 C-N-CA 122.743 2.295 . . . . 62.11 112.954 177.51 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 45' ' ' VAL . . . . . 0.469 ' O ' ' HE2' ' A' ' 35' ' ' LYS . 35.6 m -86.17 -16.73 9.59 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.675 0 N-CA-C 112.574 0.583 . . . . 62.41 112.574 -178.802 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 52.0 m -77.24 36.01 0.18 Allowed 'General case' 0 N--CA 1.478 0.952 0 N-CA-C 113.628 0.973 . . . . 73.04 113.628 -173.498 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . -112.15 176.34 17.88 Favored Glycine 0 CA--C 1.528 0.89 0 C-N-CA 120.892 -0.67 . . . . 73.5 112.912 177.71 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 48' ' ' THR . . . . . 0.58 ' O ' ' HG ' ' A' ' 52' ' ' LEU . 59.3 p -82.6 169.74 15.95 Favored 'General case' 0 N--CA 1.473 0.719 0 O-C-N 122.462 -0.434 . . . . 74.23 111.727 178.039 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 49' ' ' LYS . . . . . 0.43 ' O ' HG13 ' A' ' 53' ' ' ILE . 24.0 tptm -44.21 -59.64 2.27 Favored 'General case' 0 N--CA 1.473 0.713 0 C-N-CA 122.994 0.518 . . . . 70.42 112.227 -179.583 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 50' ' ' THR . . . . . 0.525 ' HA ' HD12 ' A' ' 53' ' ' ILE . 86.6 m -65.73 -38.19 88.46 Favored 'General case' 0 CA--C 1.541 0.598 0 N-CA-C 112.328 0.492 . . . . 71.33 112.328 -177.42 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 42.5 mt-10 -58.0 -50.83 72.07 Favored 'General case' 0 N--CA 1.473 0.699 0 CA-C-O 120.82 0.343 . . . . 74.43 111.533 177.613 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 52' ' ' LEU . . . . . 0.58 ' HG ' ' O ' ' A' ' 48' ' ' THR . 26.1 mt -59.1 -38.08 78.7 Favored 'General case' 0 CA--C 1.538 0.504 0 CA-C-N 116.435 -0.348 . . . . 75.14 111.441 -177.73 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 53' ' ' ILE . . . . . 0.525 HD12 ' HA ' ' A' ' 50' ' ' THR . 71.8 mt -57.69 -58.08 7.7 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.515 0 CA-C-O 121.093 0.473 . . . . 73.43 111.11 175.899 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 54' ' ' GLU . . . . . 0.445 ' HG2' HH11 ' A' ' 57' ' ' ARG . 44.4 mt-10 -65.7 -24.53 67.01 Favored 'General case' 0 N--CA 1.469 0.504 0 CA-C-N 116.207 -0.451 . . . . 71.41 111.864 179.697 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 55' ' ' ARG . . . . . 0.489 ' HD3' ' HD2' ' A' ' 44' ' ' PRO . 38.6 ttm180 -71.77 -44.46 63.98 Favored 'General case' 0 CA--C 1.54 0.57 0 CA-C-O 120.92 0.39 . . . . 70.13 110.912 177.329 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 56' ' ' LEU . . . . . 0.685 HD22 HH21 ' A' ' 41' ' ' ARG . 85.9 mt -58.96 -46.33 88.32 Favored 'General case' 0 N--CA 1.47 0.557 0 CA-C-O 121.236 0.541 . . . . 74.45 110.396 171.367 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 57' ' ' ARG . . . . . 0.445 HH11 ' HG2' ' A' ' 54' ' ' GLU . 48.6 mtp180 -59.47 -41.56 90.02 Favored 'General case' 0 CA--C 1.535 0.376 0 CA-C-N 115.499 -0.773 . . . . 70.22 111.419 177.58 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -59.55 -43.82 93.42 Favored 'General case' 0 CA--C 1.537 0.461 0 CA-C-N 116.472 -0.331 . . . . 54.21 111.663 179.218 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 59' ' ' TYR . . . . . . . . . . . . . 57.4 t80 -65.42 -48.28 73.33 Favored 'General case' 0 CA--C 1.54 0.56 0 CA-C-O 120.994 0.426 . . . . 64.13 110.918 178.368 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 60' ' ' GLN . . . . . . . . . . . . . 54.8 tp60 -59.89 -39.44 85.37 Favored 'General case' 0 CA--C 1.539 0.545 0 CA-C-O 121.347 0.594 . . . . 63.12 110.845 178.395 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 61' ' ' ASP . . . . . . . . . . . . . 24.2 t70 -56.21 -27.63 55.46 Favored 'General case' 0 CA--C 1.542 0.636 0 CA-C-N 115.459 -0.791 . . . . 72.21 111.821 178.048 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 62' ' ' GLN . . . . . . . . . . . . . 74.0 mt-30 . . . . . 0 CA--C 1.542 0.639 0 N-CA-C 112.41 0.522 . . . . 75.32 112.41 -177.775 . . . . . . . . 0 0 . 1 . 020 nuclear nobuild core ' A' A ' 22' ' ' LEU . . . . . 0.524 ' HG ' ' HG3' ' A' ' 60' ' ' GLN . 82.4 mt . . . . . 0 CA--C 1.537 0.464 0 N-CA-C 111.713 0.264 . . . . 53.33 111.713 . . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 23' ' ' PRO . . . . . 0.532 ' HD2' HD21 ' A' ' 26' ' ' LEU . 52.0 Cg_exo -57.77 150.52 61.92 Favored 'Trans proline' 0 CA--C 1.543 0.968 0 C-N-CA 122.403 2.069 . . . . 73.42 112.84 171.645 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -83.4 -9.45 59.02 Favored 'General case' 0 CA--C 1.539 0.54 0 N-CA-C 112.203 0.445 . . . . 42.4 112.203 -178.285 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 25' ' ' ASN . . . . . 0.524 ' HB3' ' HB3' ' A' ' 28' ' ' ASP . 15.4 m120 -112.67 24.98 11.89 Favored 'General case' 0 CA--C 1.541 0.632 0 N-CA-C 112.477 0.547 . . . . 71.44 112.477 -176.096 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 26' ' ' LEU . . . . . 0.532 HD21 ' HD2' ' A' ' 23' ' ' PRO . 95.1 mt -45.67 -47.29 15.05 Favored 'General case' 0 N--CA 1.48 1.033 0 N-CA-C 112.242 0.46 . . . . 60.23 112.242 -178.67 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 19.7 t70 -71.58 -30.9 66.36 Favored 'General case' 0 CA--C 1.539 0.526 0 CA-C-O 121.0 0.429 . . . . 75.42 111.533 -179.648 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 28' ' ' ASP . . . . . 0.524 ' HB3' ' HB3' ' A' ' 25' ' ' ASN . 20.9 t70 -78.23 -23.69 47.31 Favored 'General case' 0 CA--C 1.542 0.655 0 CA-C-O 121.193 0.52 . . . . 75.42 110.927 -179.89 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 29' ' ' MET . . . . . . . . . . . . . 71.5 mtp -73.23 -179.52 3.39 Favored 'General case' 0 CA--C 1.539 0.526 0 CA-C-N 115.823 -0.626 . . . . 72.52 111.966 -179.805 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 49.8 mtmt -95.76 153.81 17.55 Favored 'General case' 0 CA--C 1.54 0.562 0 CA-C-N 116.242 -0.435 . . . . 72.34 111.723 -176.654 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 31' ' ' VAL . . . . . 0.401 ' O ' ' HG3' ' A' ' 35' ' ' LYS . 57.7 t -51.55 -47.85 36.43 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.751 0 CA-C-N 116.196 -0.457 . . . . 74.51 111.924 -179.463 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -54.65 -45.37 73.79 Favored 'General case' 0 N--CA 1.473 0.679 0 CA-C-O 120.807 0.337 . . . . 43.45 111.752 178.687 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 13.8 mm-40 -53.58 -50.66 65.1 Favored 'General case' 0 N--CA 1.47 0.528 0 CA-C-O 121.193 0.52 . . . . 64.23 111.294 178.417 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 62.1 mt -62.63 -46.58 87.58 Favored 'General case' 0 CA--C 1.536 0.413 0 CA-C-N 115.497 -0.774 . . . . 53.23 111.422 -179.896 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 35' ' ' LYS . . . . . 0.401 ' HG3' ' O ' ' A' ' 31' ' ' VAL . 59.2 mtpt -56.22 -38.77 71.49 Favored 'General case' 0 CA--C 1.535 0.384 0 CA-C-N 116.284 -0.416 . . . . 73.51 111.549 179.834 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 16.8 mm100 -64.55 -51.34 63.37 Favored 'General case' 0 CA--C 1.537 0.468 0 CA-C-N 116.546 -0.297 . . . . 62.24 111.581 178.197 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 45.4 mt-10 -62.64 -20.75 65.11 Favored 'General case' 0 N--CA 1.473 0.71 0 CA-C-O 120.915 0.388 . . . . 75.55 111.86 179.893 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 38' ' ' LEU . . . . . 0.442 HD11 ' HA ' ' A' ' 52' ' ' LEU . 77.0 mt -76.18 -62.27 1.67 Allowed 'General case' 0 N--CA 1.47 0.527 0 CA-C-O 120.827 0.346 . . . . 72.15 111.211 170.734 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 14.1 ptmm? -62.41 -33.33 74.56 Favored 'General case' 0 CA--C 1.542 0.641 0 N-CA-C 112.31 0.485 . . . . 64.31 112.31 -173.861 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 95.2 mt -62.54 -27.28 69.05 Favored 'General case' 0 N--CA 1.473 0.707 0 CA-C-O 120.924 0.392 . . . . 65.24 111.164 174.765 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 41' ' ' ARG . . . . . 0.706 HH21 HD23 ' A' ' 56' ' ' LEU . 55.8 mtm180 -104.7 19.04 21.16 Favored 'General case' 0 CA--C 1.543 0.698 0 CA-C-N 116.418 -0.355 . . . . 75.5 111.132 179.386 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 25.7 m 68.72 13.26 8.87 Favored 'General case' 0 N--CA 1.479 1.008 0 C-N-CA 123.309 0.643 . . . . 42.44 112.715 177.154 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 80.6 mt -83.67 136.86 41.72 Favored Pre-proline 0 CA--C 1.54 0.572 0 O-C-N 122.316 -0.24 . . . . 72.41 111.085 178.33 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 44' ' ' PRO . . . . . . . . . . . . . 72.6 Cg_endo -74.94 126.83 10.26 Favored 'Trans proline' 0 CA--C 1.54 0.811 0 C-N-CA 122.55 2.167 . . . . 73.05 113.545 -178.621 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 26.1 m -85.48 20.93 0.3 Allowed 'Isoleucine or valine' 0 CA--C 1.544 0.736 0 CA-C-N 116.069 -0.514 . . . . 73.33 112.114 179.751 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 15.1 m -78.48 62.77 3.17 Favored 'General case' 0 N--CA 1.47 0.573 0 CA-C-O 120.821 0.343 . . . . 64.03 111.724 -176.308 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . -169.75 -177.34 40.13 Favored Glycine 0 CA--C 1.528 0.855 0 C-N-CA 120.598 -0.811 . . . . 72.21 113.961 -179.819 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 48' ' ' THR . . . . . 0.537 ' O ' ' HG ' ' A' ' 52' ' ' LEU . 47.6 p -82.25 171.65 14.02 Favored 'General case' 0 N--CA 1.473 0.677 0 C-N-CA 122.491 0.317 . . . . 70.21 111.38 179.705 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 79.8 tttt -48.0 -46.74 33.18 Favored 'General case' 0 N--CA 1.476 0.826 0 CA-C-O 120.999 0.428 . . . . 61.33 111.513 177.995 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 50' ' ' THR . . . . . 0.4 ' O ' ' HG3' ' A' ' 54' ' ' GLU . 13.6 m -58.77 -46.69 86.92 Favored 'General case' 0 CA--C 1.535 0.394 0 CA-C-N 116.053 -0.522 . . . . 45.45 111.229 179.726 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 74.8 mm-40 -59.09 -41.69 88.66 Favored 'General case' 0 N--CA 1.47 0.559 0 CA-C-O 120.915 0.388 . . . . 73.22 111.401 179.559 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 52' ' ' LEU . . . . . 0.537 ' HG ' ' O ' ' A' ' 48' ' ' THR . 30.1 mt -57.71 -50.39 73.37 Favored 'General case' 0 CA--C 1.538 0.486 0 CA-C-O 121.334 0.588 . . . . 74.42 110.767 179.371 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 53' ' ' ILE . . . . . . . . . . . . . 67.9 mt -60.46 -53.72 44.94 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.44 0 CA-C-N 115.607 -0.724 . . . . 65.23 111.541 178.7 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 54' ' ' GLU . . . . . 0.4 ' HG3' ' O ' ' A' ' 50' ' ' THR . 85.6 mt-10 -60.69 -37.91 83.22 Favored 'General case' 0 CA--C 1.537 0.468 0 CA-C-N 115.795 -0.639 . . . . 74.42 112.123 -177.084 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 55' ' ' ARG . . . . . 0.426 HH11 ' HD2' ' A' ' 55' ' ' ARG . 14.9 ttt180 -73.78 -37.77 64.87 Favored 'General case' 0 CA--C 1.539 0.528 0 O-C-N 122.14 -0.35 . . . . 73.41 111.21 179.863 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 56' ' ' LEU . . . . . 0.706 HD23 HH21 ' A' ' 41' ' ' ARG . 51.1 mt -53.03 -47.64 68.2 Favored 'General case' 0 N--CA 1.47 0.539 0 CA-C-O 121.028 0.442 . . . . 71.23 109.951 170.355 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 16.3 mtp180 -64.5 -57.02 10.37 Favored 'General case' 0 CA--C 1.539 0.548 0 CA-C-N 115.452 -0.794 . . . . 72.51 112.03 179.386 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -52.5 -44.85 65.93 Favored 'General case' 0 N--CA 1.472 0.666 0 CA-C-O 121.02 0.438 . . . . 21.31 112.074 -178.713 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 59' ' ' TYR . . . . . . . . . . . . . 79.4 t80 -67.28 -41.16 85.93 Favored 'General case' 0 CA--C 1.541 0.606 0 CA-C-N 116.397 -0.365 . . . . 73.42 111.793 178.952 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 60' ' ' GLN . . . . . 0.524 ' HG3' ' HG ' ' A' ' 22' ' ' LEU . 19.3 tm0? -70.56 -33.97 71.71 Favored 'General case' 0 CA--C 1.54 0.573 0 CA-C-O 121.207 0.527 . . . . 61.01 110.692 179.958 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 61' ' ' ASP . . . . . . . . . . . . . 24.8 t70 -66.92 -48.21 69.36 Favored 'General case' 0 CA--C 1.541 0.615 0 CA-C-N 115.993 -0.549 . . . . 74.35 111.801 179.304 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 62' ' ' GLN . . . . . . . . . . . . . 10.9 pt20 . . . . . 0 N--CA 1.474 0.761 0 N-CA-C 111.829 0.307 . . . . 55.44 111.829 -179.025 . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 90.2 mmm . . . . . 0 N--CA 1.489 1.518 0 CA-C-O 120.57 0.224 . . . . 72.25 110.738 . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . -152.39 172.02 31.6 Favored Glycine 0 CA--C 1.525 0.691 0 C-N-CA 121.077 -0.582 . . . . 24.4 113.279 -177.907 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 3' ' ' HIS . . . . . . . . . . . . . 21.4 p-80 -79.41 78.17 5.94 Favored 'General case' 0 CA--C 1.543 0.702 0 CA-C-O 121.244 0.545 . . . . 75.13 111.765 -177.209 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 4' ' ' HIS . . . . . . . . . . . . . 27.8 p-80 -93.0 101.04 13.37 Favored 'General case' 0 N--CA 1.472 0.639 0 CA-C-O 121.075 0.464 . . . . 73.14 112.071 -178.366 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 5' ' ' HIS . . . . . . . . . . . . . 16.9 p80 -158.82 144.21 16.33 Favored 'General case' 0 N--CA 1.472 0.633 0 CA-C-N 116.417 -0.356 . . . . 74.02 110.993 179.821 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 52.9 p-80 -141.03 129.8 22.94 Favored 'General case' 0 N--CA 1.47 0.563 0 N-CA-C 112.521 0.563 . . . . 73.42 112.521 -176.489 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 58.4 t-80 -176.6 136.11 0.25 Allowed 'General case' 0 N--CA 1.471 0.585 0 CA-C-N 116.202 -0.453 . . . . 73.02 110.446 176.109 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 8' ' ' HIS . . . . . . . . . . . . . 19.4 t60 -154.78 145.2 22.11 Favored 'General case' 0 CA--C 1.543 0.679 0 O-C-N 122.22 -0.3 . . . . 74.22 111.338 -177.999 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 93.2 p -149.85 158.65 44.38 Favored 'General case' 0 N--CA 1.478 0.959 0 CA-C-O 120.695 0.283 . . . . 74.25 111.561 178.436 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 17.2 p80 -175.08 151.05 1.26 Allowed 'General case' 0 N--CA 1.475 0.803 0 C-N-CA 122.46 0.304 . . . . 74.14 110.631 178.365 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 11' ' ' MET . . . . . . . . . . . . . 13.1 tpt -154.03 150.42 28.22 Favored 'General case' 0 N--CA 1.471 0.623 0 CA-C-O 121.036 0.446 . . . . 71.54 111.782 177.417 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 43.7 p -160.91 113.33 1.93 Allowed 'General case' 0 N--CA 1.471 0.616 0 CA-C-N 116.268 -0.424 . . . . 72.22 111.283 -178.829 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 13' ' ' THR . . . . . . . . . . . . . 64.6 p -97.32 138.02 21.17 Favored Pre-proline 0 N--CA 1.474 0.765 0 N-CA-C 111.923 0.342 . . . . 62.12 111.923 -179.065 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 14' ' ' PRO . . . . . . . . . . . . . 35.1 Cg_exo -59.04 121.57 10.16 Favored 'Trans proline' 0 CA--C 1.543 0.964 0 C-N-CA 122.686 2.258 . . . . 72.32 112.677 175.89 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 84.4 mt -99.85 169.07 9.48 Favored 'General case' 0 N--CA 1.473 0.714 0 CA-C-O 120.949 0.404 . . . . 65.11 112.045 -176.688 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 16' ' ' THR . . . . . . . . . . . . . 12.0 t -94.4 -170.1 2.19 Favored 'General case' 0 CA--C 1.544 0.715 0 CA-C-N 116.424 -0.353 . . . . 71.22 111.195 176.717 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . 90.11 88.5 1.31 Allowed Glycine 0 CA--C 1.522 0.496 0 N-CA-C 111.12 -0.792 . . . . 52.21 111.12 -172.616 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 20.1 ptmt -137.96 144.48 44.03 Favored Pre-proline 0 CA--C 1.538 0.519 0 N-CA-C 112.769 0.655 . . . . 73.51 112.769 -165.234 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 97.6 Cg_endo -83.96 -158.49 0.09 OUTLIER 'Trans proline' 0 CA--C 1.544 0.993 0 C-N-CA 122.754 2.303 . . . . 70.24 112.092 170.838 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . 171.28 -97.73 0.12 Allowed Glycine 0 CA--C 1.529 0.918 0 C-N-CA 120.847 -0.692 . . . . 41.04 113.126 177.598 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -77.08 152.95 34.8 Favored 'General case' 0 N--CA 1.467 0.398 0 CA-C-O 121.187 0.518 . . . . 72.32 111.826 -179.161 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 83.4 mt -70.05 157.69 89.19 Favored Pre-proline 0 CA--C 1.543 0.692 0 CA-C-N 116.326 -0.397 . . . . 74.12 111.559 179.62 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 23' ' ' PRO . . . . . 0.49 ' O ' ' HG ' ' A' ' 26' ' ' LEU . 38.7 Cg_exo -61.26 125.3 16.62 Favored 'Trans proline' 0 CA--C 1.541 0.84 0 C-N-CA 122.353 2.035 . . . . 74.52 112.459 177.364 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -77.73 -2.52 36.61 Favored 'General case' 0 N--CA 1.472 0.629 0 N-CA-C 112.087 0.403 . . . . 72.51 112.087 -178.122 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 23.0 m120 -101.93 31.37 3.92 Favored 'General case' 0 CA--C 1.54 0.562 0 N-CA-C 112.108 0.411 . . . . 73.15 112.108 179.94 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 26' ' ' LEU . . . . . 0.49 ' HG ' ' O ' ' A' ' 23' ' ' PRO . 92.5 mt -56.94 -44.29 82.37 Favored 'General case' 0 N--CA 1.471 0.578 0 CA-C-O 120.98 0.419 . . . . 71.53 111.122 177.307 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 5.4 m-20 -63.14 -31.8 73.03 Favored 'General case' 0 CA--C 1.54 0.579 0 CA-C-N 116.078 -0.51 . . . . 65.21 111.728 178.046 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 22.3 m-20 -75.59 -23.15 56.46 Favored 'General case' 0 CA--C 1.536 0.431 0 CA-C-N 116.244 -0.435 . . . . 65.01 112.13 -177.966 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 29' ' ' MET . . . . . . . . . . . . . 65.8 mtm -85.86 179.36 7.04 Favored 'General case' 0 CA--C 1.538 0.482 0 CA-C-O 121.498 0.666 . . . . 62.34 112.325 -177.278 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 30' ' ' LYS . . . . . 0.567 ' HB2' ' HG2' ' A' ' 33' ' ' GLU . 45.7 mtpt -85.69 158.71 19.99 Favored 'General case' 0 CA--C 1.538 0.493 0 CA-C-N 115.647 -0.706 . . . . 54.11 111.246 -179.255 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 60.9 t -57.04 -40.98 76.52 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.506 0 CA-C-O 121.055 0.455 . . . . 63.41 110.76 177.669 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -56.94 -43.98 82.05 Favored 'General case' 0 CA--C 1.538 0.494 0 CA-C-N 115.871 -0.604 . . . . 71.05 111.875 177.759 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 33' ' ' GLU . . . . . 0.567 ' HG2' ' HB2' ' A' ' 30' ' ' LYS . 5.4 mm-40 -60.13 -41.58 92.97 Favored 'General case' 0 N--CA 1.47 0.562 0 CA-C-O 121.112 0.482 . . . . 75.33 110.649 179.928 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 70.6 mt -62.95 -45.63 91.56 Favored 'General case' 0 N--CA 1.468 0.446 0 CA-C-N 115.952 -0.567 . . . . 64.43 110.685 176.88 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 28.1 mtpp -60.52 -34.12 73.64 Favored 'General case' 0 CA--C 1.542 0.635 0 CA-C-N 115.974 -0.557 . . . . 73.54 110.979 176.449 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 36' ' ' GLN . . . . . 0.411 HE21 HD11 ' A' ' 40' ' ' LEU . 56.9 tp60 -64.76 -50.31 67.34 Favored 'General case' 0 CA--C 1.541 0.6 0 CA-C-O 121.024 0.44 . . . . 73.11 111.057 175.711 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 37' ' ' GLU . . . . . 0.402 ' O ' ' HG3' ' A' ' 41' ' ' ARG . 23.2 mm-40 -58.64 -40.0 82.15 Favored 'General case' 0 CA--C 1.539 0.546 0 CA-C-N 116.293 -0.412 . . . . 75.51 111.832 177.199 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 38' ' ' LEU . . . . . 0.5 ' HB2' HG12 ' A' ' 45' ' ' VAL . 92.3 mt -64.36 -56.04 17.07 Favored 'General case' 0 CA--C 1.538 0.49 0 N-CA-C 112.089 0.403 . . . . 74.01 112.089 178.422 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 19.8 ptpt -55.51 -40.88 72.35 Favored 'General case' 0 N--CA 1.473 0.703 0 N-CA-C 112.02 0.378 . . . . 72.03 112.02 -175.367 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 40' ' ' LEU . . . . . 0.411 HD11 HE21 ' A' ' 36' ' ' GLN . 93.4 mt -66.13 -22.72 66.39 Favored 'General case' 0 N--CA 1.471 0.596 0 CA-C-O 120.883 0.373 . . . . 63.31 111.85 -179.255 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 41' ' ' ARG . . . . . 0.402 ' HG3' ' O ' ' A' ' 37' ' ' GLU . 75.7 mtt-85 -104.22 18.24 22.49 Favored 'General case' 0 CA--C 1.541 0.61 0 CA-C-O 120.73 0.3 . . . . 75.12 111.441 -179.676 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 33.1 t 67.0 16.57 10.38 Favored 'General case' 0 N--CA 1.478 0.932 0 C-N-CA 122.949 0.5 . . . . 63.24 112.315 178.458 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 65.6 mt -90.52 143.38 29.12 Favored Pre-proline 0 CA--C 1.542 0.641 0 N-CA-C 111.947 0.351 . . . . 64.13 111.947 -178.851 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 44' ' ' PRO . . . . . . . . . . . . . 42.9 Cg_endo -67.89 132.41 26.47 Favored 'Trans proline' 0 CA--C 1.542 0.891 0 C-N-CA 122.622 2.215 . . . . 63.54 113.008 176.812 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 45' ' ' VAL . . . . . 0.5 HG12 ' HB2' ' A' ' 38' ' ' LEU . 33.6 m -96.49 36.47 0.13 Allowed 'Isoleucine or valine' 0 N--CA 1.471 0.622 0 CA-C-N 116.122 -0.49 . . . . 61.32 111.806 -177.375 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 17.4 m -80.65 -61.67 1.9 Allowed 'General case' 0 CA--C 1.542 0.657 0 N-CA-C 114.064 1.135 . . . . 61.54 114.064 -168.777 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . -66.91 -170.82 4.4 Favored Glycine 0 CA--C 1.53 0.976 0 N-CA-C 115.996 1.159 . . . . 64.33 115.996 -166.944 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 48' ' ' THR . . . . . 0.586 ' O ' ' HG ' ' A' ' 52' ' ' LEU . 62.4 p -74.38 175.5 7.62 Favored 'General case' 0 N--CA 1.471 0.584 0 CA-C-N 115.295 -0.453 . . . . 51.12 111.749 -178.337 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 49' ' ' LYS . . . . . 0.423 ' O ' HG13 ' A' ' 53' ' ' ILE . 87.8 tttt -49.96 -53.79 24.11 Favored 'General case' 0 CA--C 1.543 0.677 0 N-CA-C 111.847 0.314 . . . . 53.51 111.847 -178.868 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 50' ' ' THR . . . . . . . . . . . . . 47.8 m -59.24 -43.28 92.39 Favored 'General case' 0 N--CA 1.473 0.705 0 CA-C-O 120.799 0.333 . . . . 71.25 111.595 179.351 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 51' ' ' GLU . . . . . 0.422 ' CD ' HH21 ' A' ' 55' ' ' ARG . 0.7 OUTLIER -53.61 -54.5 36.72 Favored 'General case' 0 CA--C 1.539 0.542 0 CA-C-O 120.941 0.401 . . . . 73.43 110.512 176.632 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 52' ' ' LEU . . . . . 0.586 ' HG ' ' O ' ' A' ' 48' ' ' THR . 25.7 mt -57.2 -47.62 80.81 Favored 'General case' 0 CA--C 1.54 0.586 0 CA-C-N 116.024 -0.534 . . . . 55.34 111.199 -179.718 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 53' ' ' ILE . . . . . 0.423 HG13 ' O ' ' A' ' 49' ' ' LYS . 91.2 mt -54.52 -52.73 37.57 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.616 0 CA-C-O 121.304 0.573 . . . . 52.5 111.678 177.951 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 54' ' ' GLU . . . . . 0.415 ' HA ' ' HE ' ' A' ' 57' ' ' ARG . 35.0 mt-10 -70.95 -24.86 62.51 Favored 'General case' 0 CA--C 1.536 0.432 0 N-CA-C 112.164 0.431 . . . . 74.34 112.164 -178.253 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 55' ' ' ARG . . . . . 0.422 HH21 ' CD ' ' A' ' 51' ' ' GLU . 46.6 ttm-85 -68.52 -36.45 78.88 Favored 'General case' 0 CA--C 1.538 0.502 0 CA-C-O 121.095 0.474 . . . . 73.41 110.257 175.639 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 89.9 mt -61.4 -44.73 96.65 Favored 'General case' 0 N--CA 1.469 0.495 0 CA-C-N 116.176 -0.466 . . . . 64.11 110.81 172.556 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 57' ' ' ARG . . . . . 0.415 ' HE ' ' HA ' ' A' ' 54' ' ' GLU . 40.3 mtm180 -62.89 -42.42 99.77 Favored 'General case' 0 N--CA 1.471 0.582 0 CA-C-O 121.027 0.442 . . . . 72.44 111.061 176.751 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -61.65 -39.45 91.39 Favored 'General case' 0 N--CA 1.469 0.495 0 CA-C-O 121.113 0.483 . . . . 51.13 111.482 178.027 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 59' ' ' TYR . . . . . . . . . . . . . 63.2 t80 -62.78 -47.17 84.63 Favored 'General case' 0 CA--C 1.537 0.462 0 CA-C-O 121.094 0.474 . . . . 75.51 110.806 176.021 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 60' ' ' GLN . . . . . . . . . . . . . 7.5 tp-100 -58.44 -44.62 89.26 Favored 'General case' 0 N--CA 1.468 0.468 0 CA-C-N 116.027 -0.533 . . . . 74.24 110.941 176.163 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 61' ' ' ASP . . . . . . . . . . . . . 31.9 t70 -59.03 -23.0 61.59 Favored 'General case' 0 CA--C 1.545 0.774 0 CA-C-O 121.208 0.527 . . . . 71.14 111.699 -178.401 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 62' ' ' GLN . . . . . . . . . . . . . 48.5 mt-30 -88.87 -52.29 5.18 Favored 'General case' 0 CA--C 1.54 0.592 0 CA-C-N 116.299 -0.409 . . . . 75.13 111.683 178.675 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 63' ' ' ILE . . . . . . . . . . . . . 36.3 pt -72.58 -21.66 19.99 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.58 0 N-CA-C 112.343 0.497 . . . . 74.31 112.343 -178.04 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 40.0 t -167.81 91.82 0.67 Allowed Pre-proline 0 CA--C 1.541 0.629 0 CA-C-N 116.338 -0.392 . . . . 74.32 111.279 -178.573 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 65' ' ' PRO . . . . . . . . . . . . . 94.2 Cg_endo -76.52 32.84 0.41 Allowed 'Trans proline' 0 CA--C 1.543 0.932 0 C-N-CA 122.847 2.365 . . . . 62.21 113.926 -176.426 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 66' ' ' VAL . . . . . . . . . . . . . 34.0 m -121.2 161.6 39.96 Favored Pre-proline 0 CA--C 1.542 0.644 0 O-C-N 122.321 -0.237 . . . . 54.32 111.199 -179.035 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 67' ' ' PRO . . . . . . . . . . . . . 16.1 Cg_exo -69.32 30.33 0.17 Allowed 'Trans proline' 0 CA--C 1.547 1.13 0 C-N-CA 123.144 2.563 . . . . 74.13 114.18 -179.524 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 92.42 77.29 1.36 Allowed Glycine 0 CA--C 1.528 0.856 0 C-N-CA 121.067 -0.587 . . . . 61.31 112.766 -177.653 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 69' ' ' ALA . . . . . 0.412 ' HA ' ' HD3' ' A' ' 70' ' ' PRO . . . -157.59 146.41 14.62 Favored Pre-proline 0 CA--C 1.539 0.54 0 O-C-N 122.745 -0.268 . . . . 61.11 111.304 -178.799 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 70' ' ' PRO . . . . . 0.412 ' HD3' ' HA ' ' A' ' 69' ' ' ALA . 27.9 Cg_exo -62.2 126.49 18.75 Favored 'Trans proline' 0 CA--C 1.541 0.851 0 C-N-CA 122.449 2.099 . . . . 71.54 112.262 177.405 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 53.6 mtmt -77.35 30.22 0.15 Allowed 'General case' 0 N--CA 1.474 0.75 0 N-CA-C 112.405 0.52 . . . . 71.51 112.405 -176.627 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -163.67 145.53 7.46 Favored Pre-proline 0 CA--C 1.539 0.535 0 C-N-CA 122.689 0.395 . . . . 55.43 110.714 -179.451 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 73' ' ' PRO . . . . . . . . . . . . . 22.2 Cg_exo -64.72 80.41 0.18 Allowed 'Trans proline' 0 CA--C 1.543 0.958 0 C-N-CA 122.421 2.08 . . . . 53.03 112.61 177.838 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -164.71 -173.37 2.97 Favored 'General case' 0 CA--C 1.537 0.443 0 CA-C-N 116.281 -0.418 . . . . 45.25 111.312 -178.396 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.253 1.25 0 CA-C-O 118.887 -0.578 . . . . 65.32 111.938 179.956 . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 62.8 mtt . . . . . 0 N--CA 1.494 1.767 0 CA-C-O 120.925 0.393 . . . . 71.41 111.529 . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . -85.49 140.14 17.92 Favored Glycine 0 CA--C 1.525 0.692 0 CA-C-N 116.147 -0.479 . . . . 60.33 112.578 177.046 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 3' ' ' HIS . . . . . . . . . . . . . 58.8 t-80 -65.38 92.46 0.13 Allowed 'General case' 0 CA--C 1.543 0.695 0 CA-C-O 120.896 0.379 . . . . 71.4 111.804 -178.061 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 4' ' ' HIS . . . . . . . . . . . . . 39.7 p-80 -117.9 131.82 56.48 Favored 'General case' 0 N--CA 1.473 0.689 0 CA-C-O 120.919 0.39 . . . . 62.42 111.409 -179.884 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 5' ' ' HIS . . . . . . . . . . . . . 36.1 t-80 -107.94 144.71 34.83 Favored 'General case' 0 CA--C 1.539 0.524 0 CA-C-O 120.891 0.377 . . . . 43.3 111.711 -176.869 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 13.7 p80 -134.44 137.5 44.04 Favored 'General case' 0 CA--C 1.539 0.55 0 CA-C-O 120.883 0.373 . . . . 74.53 110.759 175.582 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 22.9 p80 -66.48 122.72 18.19 Favored 'General case' 0 CA--C 1.542 0.651 0 CA-C-O 121.027 0.441 . . . . 73.35 112.14 -176.653 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 8' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -84.04 154.3 23.33 Favored 'General case' 0 N--CA 1.47 0.553 0 CA-C-N 116.52 -0.309 . . . . 73.42 111.317 176.302 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 35.1 t -81.17 141.71 33.95 Favored 'General case' 0 N--CA 1.47 0.556 0 CA-C-O 121.109 0.481 . . . . 73.14 112.061 -178.414 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 23.4 t-80 -79.11 103.31 8.97 Favored 'General case' 0 CA--C 1.541 0.617 0 CA-C-N 116.142 -0.481 . . . . 73.14 111.075 177.835 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 11' ' ' MET . . . . . . . . . . . . . 62.8 mtt -115.57 96.27 5.55 Favored 'General case' 0 CA--C 1.54 0.585 0 CA-C-O 121.231 0.539 . . . . 71.23 112.375 -177.449 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 44.9 p -108.88 83.49 1.77 Allowed 'General case' 0 N--CA 1.469 0.488 0 CA-C-O 121.242 0.544 . . . . 51.34 110.176 174.432 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 13' ' ' THR . . . . . . . . . . . . . 69.3 p -99.26 155.01 37.02 Favored Pre-proline 0 N--CA 1.472 0.664 0 CA-C-N 116.062 -0.517 . . . . 63.25 112.328 -173.677 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 14' ' ' PRO . . . . . . . . . . . . . 28.2 Cg_endo -62.4 116.18 3.34 Favored 'Trans proline' 0 C--N 1.354 0.861 0 C-N-CA 122.52 2.147 . . . . 72.22 111.815 174.887 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 87.9 mt -85.62 134.54 33.99 Favored 'General case' 0 CA--C 1.536 0.42 0 CA-C-O 121.317 0.579 . . . . 65.1 112.375 -173.749 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 16' ' ' THR . . . . . . . . . . . . . 65.4 p -105.64 146.77 29.27 Favored 'General case' 0 N--CA 1.472 0.667 0 CA-C-N 115.721 -0.672 . . . . 55.45 111.195 178.046 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . -135.54 178.09 18.92 Favored Glycine 0 CA--C 1.53 1.005 0 C-N-CA 121.172 -0.537 . . . . 51.35 113.446 -179.257 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 75.6 mmtt -74.54 119.84 78.56 Favored Pre-proline 0 CA--C 1.546 0.822 0 N-CA-C 111.958 0.355 . . . . 75.11 111.958 179.484 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 91.1 Cg_endo -83.28 129.01 5.04 Favored 'Trans proline' 0 CA--C 1.545 1.061 0 C-N-CA 122.744 2.296 . . . . 63.11 113.127 177.946 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . -77.59 70.56 2.44 Favored Glycine 0 CA--C 1.529 0.967 0 C-N-CA 121.146 -0.55 . . . . 64.01 113.131 179.589 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -142.84 167.07 22.95 Favored 'General case' 0 CA--C 1.541 0.6 0 CA-C-O 120.933 0.397 . . . . 74.03 111.711 -178.889 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 22' ' ' LEU . . . . . 0.577 ' HG ' ' HG3' ' A' ' 60' ' ' GLN . 97.0 mt -115.4 155.64 46.82 Favored Pre-proline 0 N--CA 1.473 0.72 0 N-CA-C 112.331 0.493 . . . . 72.2 112.331 -178.229 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 23' ' ' PRO . . . . . . . . . . . . . 5.3 Cg_endo -85.97 149.14 9.51 Favored 'Trans proline' 0 CA--C 1.542 0.88 0 C-N-CA 123.133 2.555 . . . . 74.21 111.764 171.987 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -74.96 -10.33 59.38 Favored 'General case' 0 N--CA 1.471 0.59 0 N-CA-C 112.108 0.41 . . . . 54.21 112.108 -179.081 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 14.1 m120 -84.97 28.75 0.68 Allowed 'General case' 0 CA--C 1.546 0.81 0 N-CA-C 112.586 0.587 . . . . 64.32 112.586 -177.554 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 85.5 mt -57.75 -62.23 1.95 Allowed 'General case' 0 N--CA 1.473 0.711 0 N-CA-C 112.606 0.595 . . . . 74.24 112.606 -177.059 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 27' ' ' ASP . . . . . 0.518 ' HA ' ' HE2' ' A' ' 49' ' ' LYS . 29.9 t70 -71.61 -20.23 62.01 Favored 'General case' 0 N--CA 1.471 0.589 0 CA-C-O 121.012 0.434 . . . . 70.24 111.13 -179.127 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 5.6 m-20 -67.77 -29.02 68.12 Favored 'General case' 0 CA--C 1.538 0.504 0 CA-C-N 116.49 -0.323 . . . . 73.24 110.941 175.087 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 29' ' ' MET . . . . . 0.485 ' O ' ' HE3' ' A' ' 49' ' ' LYS . 59.8 mtm -83.25 164.32 20.19 Favored 'General case' 0 CA--C 1.539 0.521 0 CA-C-O 120.739 0.304 . . . . 63.32 110.57 172.04 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 59.2 mtpt -86.45 166.25 15.67 Favored 'General case' 0 CA--C 1.54 0.587 0 CA-C-O 121.441 0.639 . . . . 65.14 112.676 -177.08 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 31' ' ' VAL . . . . . 0.506 HG13 HD11 ' A' ' 52' ' ' LEU . 61.4 t -53.34 -47.94 57.02 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.798 0 CA-C-N 115.694 -0.685 . . . . 62.32 112.096 -177.812 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -61.33 -27.28 68.38 Favored 'General case' 0 CA--C 1.539 0.526 0 N-CA-C 112.221 0.452 . . . . 60.1 112.221 -179.598 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 33' ' ' GLU . . . . . 0.43 ' O ' ' HB3' ' A' ' 36' ' ' GLN . 40.9 mt-10 -78.79 -39.58 35.41 Favored 'General case' 0 N--CA 1.47 0.574 0 CA-C-O 121.035 0.445 . . . . 72.04 111.334 -179.925 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 92.9 mt -66.74 -40.87 88.5 Favored 'General case' 0 CA--C 1.538 0.513 0 CA-C-O 120.703 0.287 . . . . 71.13 111.385 177.478 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 35' ' ' LYS . . . . . 0.518 ' HA ' HD12 ' A' ' 38' ' ' LEU . 96.3 mttt -61.23 -30.28 70.35 Favored 'General case' 0 CA--C 1.538 0.518 0 CA-C-O 120.872 0.368 . . . . 63.12 111.218 176.194 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 36' ' ' GLN . . . . . 0.437 HE21 HD11 ' A' ' 40' ' ' LEU . 2.5 tt0 -61.82 -54.15 46.2 Favored 'General case' 0 CA--C 1.538 0.514 0 CA-C-O 121.125 0.488 . . . . 75.11 110.115 171.694 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 36.6 mm-40 -57.57 -26.22 61.14 Favored 'General case' 0 CA--C 1.54 0.594 0 CA-C-N 115.916 -0.583 . . . . 62.33 112.133 177.575 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 38' ' ' LEU . . . . . 0.518 HD12 ' HA ' ' A' ' 35' ' ' LYS . 93.7 mt -72.5 -56.91 4.64 Favored 'General case' 0 CA--C 1.535 0.381 0 CA-C-O 120.931 0.396 . . . . 52.43 111.571 175.182 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 39' ' ' LYS . . . . . 0.414 ' HE2' ' HB3' ' A' ' 39' ' ' LYS . 16.9 ptpt -61.86 -30.13 70.65 Favored 'General case' 0 CA--C 1.539 0.557 0 N-CA-C 112.197 0.443 . . . . 61.52 112.197 -175.734 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 40' ' ' LEU . . . . . 0.437 HD11 HE21 ' A' ' 36' ' ' GLN . 75.8 mt -58.05 -25.6 61.41 Favored 'General case' 0 N--CA 1.473 0.676 0 CA-C-O 120.891 0.377 . . . . 73.23 111.754 174.867 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 41' ' ' ARG . . . . . . . . . . . . . 13.7 mtm180 -121.71 24.55 9.69 Favored 'General case' 0 CA--C 1.539 0.539 0 CA-C-O 120.778 0.323 . . . . 70.24 111.761 -178.567 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 23.2 t 62.46 33.51 16.08 Favored 'General case' 0 N--CA 1.475 0.807 0 N-CA-C 112.336 0.495 . . . . 73.32 112.336 174.935 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 43' ' ' LEU . . . . . 0.408 ' HB3' HD22 ' A' ' 38' ' ' LEU . 76.3 mt -97.01 147.56 33.09 Favored Pre-proline 0 CA--C 1.542 0.661 0 CA-C-O 120.72 0.295 . . . . 64.22 111.596 178.546 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 44' ' ' PRO . . . . . . . . . . . . . 35.6 Cg_endo -64.16 122.81 10.92 Favored 'Trans proline' 0 CA--C 1.541 0.844 0 C-N-CA 122.859 2.373 . . . . 71.4 113.445 -178.04 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 33.7 m -98.93 31.19 0.41 Allowed 'Isoleucine or valine' 0 CA--C 1.545 0.767 0 CA-C-N 116.184 -0.462 . . . . 74.33 112.027 -177.498 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 78.5 p -93.94 -41.08 9.79 Favored 'General case' 0 N--CA 1.473 0.716 0 N-CA-C 112.754 0.65 . . . . 75.43 112.754 -175.514 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . -66.69 -179.33 10.68 Favored Glycine 0 CA--C 1.534 1.254 0 N-CA-C 115.078 0.791 . . . . 73.41 115.078 -174.021 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 48' ' ' THR . . . . . 0.618 ' O ' ' HG ' ' A' ' 52' ' ' LEU . 50.8 p -85.39 179.56 7.14 Favored 'General case' 0 N--CA 1.475 0.791 0 C-N-CA 122.811 0.444 . . . . 72.2 112.164 -178.254 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 49' ' ' LYS . . . . . 0.518 ' HE2' ' HA ' ' A' ' 27' ' ' ASP . 24.1 tptm -41.82 -58.7 1.93 Allowed 'General case' 0 N--CA 1.476 0.831 0 C-N-CA 123.418 0.687 . . . . 73.42 112.561 179.506 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 50' ' ' THR . . . . . . . . . . . . . 24.1 m -60.96 -38.32 85.5 Favored 'General case' 0 CA--C 1.537 0.467 0 CA-C-O 120.866 0.365 . . . . 73.21 111.583 -178.315 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 51' ' ' GLU . . . . . 0.461 ' O ' ' HB2' ' A' ' 55' ' ' ARG . 57.4 mm-40 -60.95 -42.44 98.23 Favored 'General case' 0 N--CA 1.469 0.524 0 CA-C-N 116.445 -0.343 . . . . 71.03 111.08 178.542 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 52' ' ' LEU . . . . . 0.618 ' HG ' ' O ' ' A' ' 48' ' ' THR . 14.3 mt -61.68 -45.48 93.8 Favored 'General case' 0 N--CA 1.467 0.406 0 CA-C-O 121.085 0.469 . . . . 74.32 110.628 179.15 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 53' ' ' ILE . . . . . . . . . . . . . 68.3 mt -58.5 -53.85 41.06 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.49 0 CA-C-N 115.746 -0.661 . . . . 72.41 111.332 178.341 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 40.5 mt-10 -65.07 -32.64 74.45 Favored 'General case' 0 CA--C 1.536 0.419 0 CA-C-N 116.394 -0.367 . . . . 71.34 111.38 -179.76 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 55' ' ' ARG . . . . . 0.473 ' HB3' HD21 ' A' ' 38' ' ' LEU . 0.0 OUTLIER -60.1 -53.23 60.25 Favored 'General case' 0 CA--C 1.537 0.45 0 CA-C-O 121.19 0.519 . . . . 74.14 110.588 177.573 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 98.3 mt -57.29 -50.93 71.36 Favored 'General case' 0 CA--C 1.537 0.444 0 CA-C-N 115.834 -0.621 . . . . 73.12 111.363 176.269 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 19.9 mtp180 -63.81 -30.49 71.58 Favored 'General case' 0 CA--C 1.541 0.602 0 N-CA-C 112.187 0.44 . . . . 75.53 112.187 -178.487 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -71.46 -48.08 51.6 Favored 'General case' 0 N--CA 1.469 0.516 0 CA-C-O 121.216 0.531 . . . . 72.31 110.921 175.896 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 59' ' ' TYR . . . . . . . . . . . . . 74.1 t80 -61.21 -42.66 98.98 Favored 'General case' 0 CA--C 1.539 0.527 0 CA-C-O 121.074 0.464 . . . . 73.33 111.234 177.841 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 60' ' ' GLN . . . . . 0.577 ' HG3' ' HG ' ' A' ' 22' ' ' LEU . 21.7 tm0? -71.82 -36.83 70.34 Favored 'General case' 0 CA--C 1.538 0.516 0 CA-C-N 116.255 -0.43 . . . . 75.04 111.145 -178.528 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 61' ' ' ASP . . . . . . . . . . . . . 20.7 t70 -56.33 -40.77 74.98 Favored 'General case' 0 N--CA 1.47 0.556 0 CA-C-O 121.306 0.574 . . . . 71.24 111.064 178.984 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 62' ' ' GLN . . . . . . . . . . . . . 48.1 mt-30 -65.3 -32.32 73.92 Favored 'General case' 0 CA--C 1.542 0.644 0 CA-C-N 115.377 -0.829 . . . . 70.14 112.148 -179.331 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 63' ' ' ILE . . . . . . . . . . . . . 30.7 pt -104.36 8.97 9.47 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.66 0 CA-C-O 120.753 0.311 . . . . 72.24 111.72 179.697 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 35.4 t -98.39 139.47 21.19 Favored Pre-proline 0 N--CA 1.473 0.681 0 CA-C-N 116.504 -0.317 . . . . 52.32 111.343 -179.386 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 65' ' ' PRO . . . . . . . . . . . . . 12.8 Cg_endo -54.5 133.26 55.62 Favored 'Trans proline' 0 CA--C 1.542 0.878 0 C-N-CA 122.882 2.388 . . . . 75.35 112.951 -179.357 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 66' ' ' VAL . . . . . . . . . . . . . 35.7 m -104.83 143.3 26.42 Favored Pre-proline 0 CA--C 1.539 0.537 0 CA-C-N 116.375 -0.375 . . . . 73.22 111.155 178.835 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 67' ' ' PRO . . . . . . . . . . . . . 98.8 Cg_endo -76.3 37.37 0.54 Allowed 'Trans proline' 0 CA--C 1.543 0.952 0 C-N-CA 122.844 2.363 . . . . 63.04 113.248 -178.605 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 96.56 11.95 52.3 Favored Glycine 0 CA--C 1.528 0.886 0 C-N-CA 121.228 -0.511 . . . . 74.02 113.091 -177.076 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 69' ' ' ALA . . . . . 0.405 ' HA ' ' HD3' ' A' ' 70' ' ' PRO . . . -83.48 124.67 75.37 Favored Pre-proline 0 CA--C 1.54 0.58 0 C-N-CA 122.351 0.261 . . . . 71.43 111.457 178.559 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 70' ' ' PRO . . . . . 0.405 ' HD3' ' HA ' ' A' ' 69' ' ' ALA . 40.3 Cg_exo -57.86 105.19 0.19 Allowed 'Trans proline' 0 CA--C 1.545 1.033 0 C-N-CA 122.883 2.389 . . . . 63.45 113.625 -179.266 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 32.0 mmtp -125.68 178.99 5.36 Favored 'General case' 0 N--CA 1.47 0.561 0 CA-C-N 116.165 -0.47 . . . . 71.31 111.26 177.172 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -71.53 138.65 83.55 Favored Pre-proline 0 CA--C 1.541 0.635 0 CA-C-N 116.253 -0.43 . . . . 51.23 110.873 174.783 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 73' ' ' PRO . . . . . . . . . . . . . 44.6 Cg_exo -56.94 97.12 0.07 OUTLIER 'Trans proline' 0 CA--C 1.541 0.839 0 C-N-CA 122.392 2.062 . . . . 73.41 112.939 -179.498 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -60.68 94.96 0.03 OUTLIER 'General case' 0 CA--C 1.537 0.465 0 CA-C-O 121.085 0.469 . . . . 64.12 111.718 179.222 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.251 1.153 0 CA-C-O 118.689 -0.672 . . . . 64.22 111.165 -179.395 . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 61.7 mtt . . . . . 0 N--CA 1.489 1.497 0 CA-C-O 120.788 0.328 . . . . 75.22 111.17 . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . 81.53 -57.21 4.91 Favored Glycine 0 CA--C 1.527 0.823 0 C-N-CA 121.062 -0.59 . . . . 74.01 112.808 -179.763 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 3' ' ' HIS . . . . . . . . . . . . . 20.9 t-160 64.01 41.05 6.75 Favored 'General case' 0 CA--C 1.544 0.744 0 CA-C-O 121.192 0.52 . . . . 73.2 112.022 174.959 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 4' ' ' HIS . . . . . . . . . . . . . 20.6 t-80 -70.37 85.91 0.6 Allowed 'General case' 0 CA--C 1.539 0.521 0 CA-C-O 121.215 0.531 . . . . 65.33 110.878 178.302 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 5' ' ' HIS . . . . . . . . . . . . . 13.3 p-80 -64.53 135.3 55.87 Favored 'General case' 0 CA--C 1.539 0.531 0 CA-C-N 115.974 -0.557 . . . . 70.33 111.477 179.22 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 6.7 p-80 -128.74 93.55 3.65 Favored 'General case' 0 CA--C 1.538 0.51 0 CA-C-O 121.431 0.634 . . . . 74.13 111.436 -178.736 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 38.7 t-80 -99.62 123.8 44.23 Favored 'General case' 0 CA--C 1.538 0.486 0 CA-C-N 115.779 -0.646 . . . . 60.51 110.617 179.638 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 8' ' ' HIS . . . . . . . . . . . . . 23.3 p-80 -144.56 137.83 27.06 Favored 'General case' 0 N--CA 1.472 0.653 0 CA-C-O 121.203 0.525 . . . . 74.4 111.998 -178.279 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 36.0 p -142.63 134.09 26.4 Favored 'General case' 0 N--CA 1.47 0.527 0 CA-C-N 115.775 -0.648 . . . . 52.43 110.664 177.228 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 72.5 t60 -164.02 134.4 4.25 Favored 'General case' 0 CA--C 1.54 0.563 0 CA-C-O 120.866 0.365 . . . . 71.13 111.818 -178.553 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 11' ' ' MET . . . . . . . . . . . . . 25.7 ptm -131.91 177.66 7.37 Favored 'General case' 0 N--CA 1.473 0.699 0 CA-C-N 116.443 -0.344 . . . . 74.31 110.688 174.222 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 87.1 p -115.46 147.37 40.69 Favored 'General case' 0 N--CA 1.473 0.691 0 CA-C-O 120.89 0.376 . . . . 74.31 111.097 177.872 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 13' ' ' THR . . . . . . . . . . . . . 68.8 p -130.77 109.19 15.68 Favored Pre-proline 0 N--CA 1.471 0.621 0 CA-C-N 116.583 -0.281 . . . . 51.44 111.574 179.597 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 14' ' ' PRO . . . . . . . . . . . . . 75.0 Cg_endo -75.93 -177.99 4.03 Favored 'Trans proline' 0 CA--C 1.54 0.802 0 C-N-CA 122.624 2.216 . . . . 73.22 112.54 175.331 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 70.7 mt -73.26 104.93 4.46 Favored 'General case' 0 CA--C 1.537 0.446 0 CA-C-O 121.157 0.504 . . . . 72.31 111.394 179.132 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 16' ' ' THR . . . . . . . . . . . . . 70.3 p -77.02 108.39 10.05 Favored 'General case' 0 N--CA 1.467 0.401 0 CA-C-O 121.282 0.563 . . . . 74.51 111.212 179.724 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . -164.21 -144.26 3.98 Favored Glycine 0 CA--C 1.523 0.532 0 CA-C-N 115.975 -0.557 . . . . 73.14 112.756 -179.624 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 45.6 mmtm 69.06 141.8 0.08 OUTLIER Pre-proline 0 CA--C 1.545 0.767 0 C-N-CA 123.218 0.607 . . . . 74.11 112.163 179.61 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 89.7 Cg_endo -84.11 103.03 0.96 Allowed 'Trans proline' 0 CA--C 1.543 0.944 0 C-N-CA 122.634 2.223 . . . . 60.44 113.257 179.825 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . -72.92 67.57 1.37 Allowed Glycine 0 CA--C 1.525 0.718 0 C-N-CA 121.287 -0.482 . . . . 71.03 112.253 173.995 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -124.2 -158.32 0.81 Allowed 'General case' 0 CA--C 1.539 0.524 0 C-N-CA 122.679 0.392 . . . . 72.23 111.693 -175.793 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 22' ' ' LEU . . . . . 0.622 ' HG ' ' HG3' ' A' ' 60' ' ' GLN . 91.6 mt -95.58 158.86 33.78 Favored Pre-proline 0 N--CA 1.472 0.655 0 N-CA-C 111.916 0.339 . . . . 75.44 111.916 179.741 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 23' ' ' PRO . . . . . . . . . . . . . 32.9 Cg_exo -62.19 166.61 12.42 Favored 'Trans proline' 0 CA--C 1.541 0.844 0 C-N-CA 122.656 2.237 . . . . 73.52 111.845 169.233 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -76.36 -65.07 0.97 Allowed 'General case' 0 CA--C 1.54 0.577 0 CA-C-O 120.963 0.411 . . . . 62.45 112.053 -177.532 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 25' ' ' ASN . . . . . 0.594 ' HB3' ' HB2' ' A' ' 28' ' ' ASP . 1.8 m-20 -81.27 67.54 7.25 Favored 'General case' 0 CA--C 1.541 0.613 0 CA-C-O 121.086 0.47 . . . . 70.44 111.85 -175.578 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 26' ' ' LEU . . . . . 0.445 HD21 ' HB3' ' A' ' 22' ' ' LEU . 95.4 mt -58.87 -51.75 68.66 Favored 'General case' 0 CA--C 1.542 0.635 0 N-CA-C 112.834 0.679 . . . . 72.12 112.834 -176.284 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 35.4 t70 -71.81 -17.01 62.19 Favored 'General case' 0 CA--C 1.54 0.578 0 CA-C-O 121.03 0.443 . . . . 71.41 111.622 -177.975 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 28' ' ' ASP . . . . . 0.594 ' HB2' ' HB3' ' A' ' 25' ' ' ASN . 6.0 m-20 -80.5 -25.26 38.85 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-O 120.775 0.322 . . . . 73.15 110.986 174.802 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 29' ' ' MET . . . . . 0.434 ' HG3' ' O ' ' A' ' 25' ' ' ASN . 87.4 mtp -67.74 139.95 56.69 Favored 'General case' 0 CA--C 1.537 0.448 0 CA-C-O 121.129 0.49 . . . . 73.11 110.575 173.835 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 49.9 mtmt -66.41 151.96 46.07 Favored 'General case' 0 CA--C 1.538 0.484 0 CA-C-O 121.023 0.439 . . . . 73.5 111.769 -176.514 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 31' ' ' VAL . . . . . 0.48 HG12 ' HE3' ' A' ' 35' ' ' LYS . 39.8 t -49.67 -42.74 17.87 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.684 0 CA-C-N 116.085 -0.507 . . . . 74.54 112.288 -176.842 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -63.04 -37.54 87.6 Favored 'General case' 0 CA--C 1.539 0.556 0 N-CA-C 111.854 0.316 . . . . 53.15 111.854 178.041 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 38.2 mt-10 -64.29 -40.55 96.17 Favored 'General case' 0 N--CA 1.469 0.518 0 CA-C-O 120.987 0.423 . . . . 75.31 111.114 179.114 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 88.1 mt -61.96 -46.17 90.47 Favored 'General case' 0 N--CA 1.468 0.47 0 CA-C-N 116.111 -0.495 . . . . 72.12 110.911 176.487 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 35' ' ' LYS . . . . . 0.48 ' HE3' HG12 ' A' ' 31' ' ' VAL . 98.0 mttt -63.8 -32.74 74.34 Favored 'General case' 0 CA--C 1.539 0.538 0 CA-C-N 116.199 -0.455 . . . . 71.12 111.602 177.311 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 36' ' ' GLN . . . . . 0.474 ' O ' ' HG ' ' A' ' 40' ' ' LEU . 25.6 tm0? -62.92 -41.75 99.57 Favored 'General case' 0 CA--C 1.538 0.502 0 CA-C-O 120.844 0.354 . . . . 74.14 110.704 176.744 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 52.9 mm-40 -67.18 -46.69 73.2 Favored 'General case' 0 CA--C 1.542 0.641 0 CA-C-O 120.907 0.384 . . . . 61.13 111.513 174.219 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 38' ' ' LEU . . . . . 0.405 ' CD1' HD22 ' A' ' 52' ' ' LEU . 81.1 mt -53.57 -52.51 59.52 Favored 'General case' 0 N--CA 1.47 0.574 0 N-CA-C 112.472 0.545 . . . . 64.11 112.472 179.942 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 18.4 ptpt -58.59 -40.37 82.98 Favored 'General case' 0 N--CA 1.473 0.678 0 N-CA-C 111.751 0.278 . . . . 72.42 111.751 -177.7 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 40' ' ' LEU . . . . . 0.474 ' HG ' ' O ' ' A' ' 36' ' ' GLN . 94.9 mt -59.69 -30.09 68.54 Favored 'General case' 0 N--CA 1.472 0.642 0 CA-C-O 121.341 0.591 . . . . 54.55 110.993 176.963 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 41' ' ' ARG . . . . . 0.43 ' NH1' ' OE1' ' A' ' 60' ' ' GLN . 60.2 mtt-85 -99.67 14.07 31.37 Favored 'General case' 0 CA--C 1.537 0.466 0 CA-C-N 115.695 -0.684 . . . . 74.31 111.778 -175.804 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 47.7 m 64.16 19.51 11.8 Favored 'General case' 0 N--CA 1.479 0.986 0 CA-C-O 121.066 0.46 . . . . 72.43 111.985 179.045 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 74.3 mt -91.03 146.52 33.83 Favored Pre-proline 0 CA--C 1.541 0.599 0 CA-C-N 116.085 -0.507 . . . . 62.05 111.639 -178.88 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 44' ' ' PRO . . . . . 0.528 ' HD2' ' HD3' ' A' ' 55' ' ' ARG . 33.6 Cg_exo -57.99 134.06 59.83 Favored 'Trans proline' 0 CA--C 1.545 1.03 0 C-N-CA 122.305 2.003 . . . . 75.42 112.546 174.737 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 34.0 m -105.64 -12.91 9.54 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.772 0 N-CA-C 112.57 0.581 . . . . 72.12 112.57 -175.197 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 57.4 p -85.0 37.13 0.65 Allowed 'General case' 0 N--CA 1.478 0.948 0 N-CA-C 112.802 0.667 . . . . 65.43 112.802 -174.933 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . -108.54 174.11 18.41 Favored Glycine 0 CA--C 1.529 0.92 0 C-N-CA 121.277 -0.487 . . . . 61.31 112.946 177.638 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 48' ' ' THR . . . . . 0.496 ' O ' ' HG ' ' A' ' 52' ' ' LEU . 70.6 p -80.96 162.1 24.01 Favored 'General case' 0 N--CA 1.474 0.76 0 O-C-N 122.437 -0.449 . . . . 74.31 111.476 177.811 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 49' ' ' LYS . . . . . 0.406 ' HD3' HG22 ' A' ' 31' ' ' VAL . 22.8 tptm -37.99 -60.44 0.75 Allowed 'General case' 0 N--CA 1.478 0.946 0 N-CA-C 113.106 0.78 . . . . 70.33 113.106 -177.561 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 50' ' ' THR . . . . . . . . . . . . . 60.3 m -58.99 -41.01 86.59 Favored 'General case' 0 N--CA 1.472 0.629 0 N-CA-C 112.146 0.424 . . . . 73.21 112.146 -178.072 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 47.3 mt-10 -62.54 -41.99 99.24 Favored 'General case' 0 N--CA 1.469 0.489 0 CA-C-O 120.803 0.335 . . . . 63.14 111.274 179.784 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 52' ' ' LEU . . . . . 0.496 ' HG ' ' O ' ' A' ' 48' ' ' THR . 42.4 mt -57.63 -46.94 83.49 Favored 'General case' 0 N--CA 1.47 0.527 0 CA-C-O 121.254 0.549 . . . . 70.02 110.803 179.783 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 53' ' ' ILE . . . . . . . . . . . . . 66.3 mt -63.81 -57.5 11.42 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.55 0 CA-C-N 115.578 -0.737 . . . . 71.02 111.934 -179.685 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 21.0 mm-40 -60.03 -33.14 71.61 Favored 'General case' 0 CA--C 1.538 0.485 0 CA-C-N 116.277 -0.419 . . . . 72.02 111.86 -177.918 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 55' ' ' ARG . . . . . 0.528 ' HD3' ' HD2' ' A' ' 44' ' ' PRO . 40.5 ttm180 -64.19 -44.93 90.5 Favored 'General case' 0 CA--C 1.542 0.666 0 CA-C-O 120.814 0.34 . . . . 72.25 111.161 175.576 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 81.1 mt -57.73 -45.87 85.23 Favored 'General case' 0 N--CA 1.471 0.619 0 CA-C-O 121.232 0.539 . . . . 64.53 111.184 174.561 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 81.2 mtp180 -65.26 -43.11 92.34 Favored 'General case' 0 CA--C 1.536 0.439 0 CA-C-N 115.88 -0.6 . . . . 61.34 111.442 -179.041 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 58' ' ' ALA . . . . . 0.404 ' O ' ' HG3' ' A' ' 62' ' ' GLN . . . -60.93 -40.43 93.17 Favored 'General case' 0 CA--C 1.535 0.392 0 CA-C-O 120.916 0.389 . . . . 53.4 111.269 178.775 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 59' ' ' TYR . . . . . . . . . . . . . 81.5 t80 -59.55 -49.92 75.91 Favored 'General case' 0 CA--C 1.54 0.571 0 CA-C-N 115.848 -0.615 . . . . 63.31 111.395 176.396 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 60' ' ' GLN . . . . . 0.622 ' HG3' ' HG ' ' A' ' 22' ' ' LEU . 14.3 mm100 -66.75 -30.19 70.35 Favored 'General case' 0 N--CA 1.471 0.614 0 N-CA-C 111.885 0.328 . . . . 73.42 111.885 178.969 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 61' ' ' ASP . . . . . . . . . . . . . 17.2 t70 -63.37 -40.87 98.43 Favored 'General case' 0 CA--C 1.539 0.545 0 CA-C-O 120.942 0.401 . . . . 65.44 111.437 177.799 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 62' ' ' GLN . . . . . 0.404 ' HG3' ' O ' ' A' ' 58' ' ' ALA . 51.1 mt-30 -62.65 -49.26 75.86 Favored 'General case' 0 CA--C 1.537 0.469 0 CA-C-N 116.319 -0.4 . . . . 72.21 111.768 179.389 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 63' ' ' ILE . . . . . . . . . . . . . 32.9 pt -79.51 -19.79 12.52 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.655 0 N-CA-C 111.898 0.333 . . . . 72.32 111.898 179.258 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 28.6 t 67.81 147.13 0.11 Allowed Pre-proline 0 N--CA 1.48 1.039 0 C-N-CA 123.305 0.642 . . . . 51.3 111.695 179.706 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 65' ' ' PRO . . . . . . . . . . . . . 6.8 Cg_endo -48.7 108.79 0.2 Allowed 'Trans proline' 0 CA--C 1.541 0.869 0 C-N-CA 122.576 2.184 . . . . 61.43 112.484 177.611 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 66' ' ' VAL . . . . . . . . . . . . . 33.7 m -62.7 133.65 95.07 Favored Pre-proline 0 CA--C 1.542 0.673 0 N-CA-C 112.31 0.485 . . . . 74.1 112.31 -176.099 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 67' ' ' PRO . . . . . . . . . . . . . 71.6 Cg_endo -75.56 55.45 4.24 Favored 'Trans proline' 0 CA--C 1.54 0.815 0 C-N-CA 122.793 2.328 . . . . 65.0 112.41 178.051 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 77.69 74.51 1.0 Allowed Glycine 0 CA--C 1.527 0.782 0 C-N-CA 121.277 -0.487 . . . . 53.41 113.091 -176.959 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . -164.73 128.51 1.74 Allowed Pre-proline 0 CA--C 1.539 0.526 0 O-C-N 122.752 -0.263 . . . . 73.33 111.353 -178.587 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 70' ' ' PRO . . . . . . . . . . . . . 76.0 Cg_endo -76.61 145.11 25.83 Favored 'Trans proline' 0 CA--C 1.541 0.872 0 C-N-CA 122.36 2.04 . . . . 74.05 112.884 177.863 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 41.9 mtmt -74.12 -40.76 62.44 Favored 'General case' 0 N--CA 1.469 0.509 0 CA-C-O 121.43 0.633 . . . . 74.35 110.724 179.352 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -109.15 155.48 40.91 Favored Pre-proline 0 CA--C 1.539 0.556 0 CA-C-N 115.617 -0.72 . . . . 73.11 110.575 177.393 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 73' ' ' PRO . . . . . . . . . . . . . 71.9 Cg_endo -75.45 41.33 0.77 Allowed 'Trans proline' 0 CA--C 1.545 1.07 0 C-N-CA 122.563 2.176 . . . . 72.54 113.379 179.716 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -152.98 179.57 8.56 Favored 'General case' 0 CA--C 1.538 0.499 0 CA-C-N 116.431 -0.349 . . . . 75.4 111.245 -178.585 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.252 1.219 0 CA-C-O 118.755 -0.64 . . . . 64.34 112.023 -179.145 . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 25.6 ptt? . . . . . 0 N--CA 1.489 1.478 0 CA-C-O 120.637 0.256 . . . . 75.25 111.437 . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . -79.03 138.31 20.5 Favored Glycine 0 CA--C 1.529 0.963 0 C-N-CA 121.394 -0.431 . . . . 65.54 113.311 -178.329 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 3' ' ' HIS . . . . . . . . . . . . . 13.0 p80 -109.23 111.95 23.84 Favored 'General case' 0 N--CA 1.474 0.749 0 CA-C-O 121.111 0.481 . . . . 73.24 111.374 -178.922 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 4' ' ' HIS . . . . . . . . . . . . . 49.1 m-70 -131.18 168.32 17.66 Favored 'General case' 0 N--CA 1.471 0.577 0 CA-C-O 120.994 0.426 . . . . 63.04 111.55 -179.44 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 5' ' ' HIS . . . . . . . . . . . . . 99.0 m-70 -116.96 151.96 35.6 Favored 'General case' 0 N--CA 1.471 0.575 0 CA-C-N 116.263 -0.426 . . . . 72.23 111.692 -179.948 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 42.1 t-80 -140.68 134.44 30.38 Favored 'General case' 0 N--CA 1.469 0.511 0 CA-C-N 116.391 -0.368 . . . . 74.33 111.58 -175.985 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 61.1 t60 -62.78 139.04 58.67 Favored 'General case' 0 CA--C 1.544 0.73 0 N-CA-C 112.957 0.725 . . . . 62.42 112.957 -177.662 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 8' ' ' HIS . . . . . . . . . . . . . 84.7 m-70 -113.94 113.63 25.09 Favored 'General case' 0 CA--C 1.541 0.608 0 CA-C-N 115.894 -0.594 . . . . 74.1 110.623 173.334 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 67.8 m -73.49 153.97 40.11 Favored 'General case' 0 N--CA 1.47 0.536 0 CA-C-O 120.98 0.419 . . . . 60.24 111.887 -178.618 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 23.0 p-80 -160.13 129.62 5.17 Favored 'General case' 0 CA--C 1.539 0.529 0 CA-C-N 116.234 -0.439 . . . . 71.53 111.577 -178.01 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 11' ' ' MET . . . . . . . . . . . . . 83.9 mtp -128.74 177.01 7.36 Favored 'General case' 0 CA--C 1.541 0.608 0 CA-C-O 121.139 0.495 . . . . 44.34 111.682 -179.295 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 75.4 m -153.45 127.66 9.12 Favored 'General case' 0 N--CA 1.479 0.978 0 CA-C-N 116.327 -0.397 . . . . 71.11 111.456 178.253 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 13' ' ' THR . . . . . . . . . . . . . 81.8 p -110.39 146.63 34.67 Favored Pre-proline 0 N--CA 1.473 0.696 0 C-N-CA 122.293 0.237 . . . . 75.14 111.236 179.79 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 14' ' ' PRO . . . . . . . . . . . . . 71.7 Cg_endo -74.87 174.3 12.98 Favored 'Trans proline' 0 CA--C 1.54 0.782 0 C-N-CA 122.41 2.073 . . . . 74.32 112.642 179.106 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 89.9 mt -87.34 158.09 19.12 Favored 'General case' 0 N--CA 1.471 0.59 0 CA-C-O 121.151 0.5 . . . . 74.53 111.659 -179.378 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 16' ' ' THR . . . . . . . . . . . . . 81.4 p -82.69 118.14 23.13 Favored 'General case' 0 N--CA 1.471 0.601 0 CA-C-N 116.194 -0.457 . . . . 74.5 111.851 -178.274 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . 142.11 172.1 13.4 Favored Glycine 0 CA--C 1.526 0.76 0 C-N-CA 120.692 -0.766 . . . . 74.12 113.991 177.235 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 18' ' ' LYS . . . . . 0.408 ' HA ' ' HD3' ' A' ' 19' ' ' PRO . 59.0 pttt -166.43 151.25 7.3 Favored Pre-proline 0 CA--C 1.543 0.688 0 C-N-CA 122.758 0.423 . . . . 53.13 111.176 178.883 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 19' ' ' PRO . . . . . 0.408 ' HD3' ' HA ' ' A' ' 18' ' ' LYS . 24.9 Cg_exo -63.78 133.9 41.28 Favored 'Trans proline' 0 CA--C 1.542 0.92 0 C-N-CA 122.868 2.379 . . . . 74.54 114.127 -176.656 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . -94.96 -45.71 3.04 Favored Glycine 0 CA--C 1.526 0.77 0 CA-C-N 116.145 -0.48 . . . . 50.41 112.426 174.416 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -79.73 -178.65 6.5 Favored 'General case' 0 CA--C 1.54 0.595 0 CA-C-O 120.967 0.413 . . . . 52.21 111.711 178.301 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 76.2 mt -131.59 149.31 73.12 Favored Pre-proline 0 N--CA 1.472 0.644 0 CA-C-O 120.843 0.354 . . . . 51.44 111.783 178.807 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 23' ' ' PRO . . . . . . . . . . . . . 87.4 Cg_endo -83.54 171.14 11.2 Favored 'Trans proline' 0 CA--C 1.538 0.704 0 C-N-CA 122.797 2.331 . . . . 64.52 112.37 171.643 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -92.97 -2.7 55.53 Favored 'General case' 0 CA--C 1.541 0.631 0 CA-C-O 120.816 0.341 . . . . 73.12 111.481 176.31 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 1.5 m-20 -88.35 19.86 3.59 Favored 'General case' 0 N--CA 1.473 0.687 0 N-CA-C 112.203 0.446 . . . . 65.55 112.203 -177.138 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 99.1 mt -54.14 -51.83 63.0 Favored 'General case' 0 CA--C 1.545 0.767 0 N-CA-C 112.877 0.695 . . . . 64.42 112.877 -174.544 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 17.6 t70 -76.86 -16.47 59.4 Favored 'General case' 0 CA--C 1.543 0.709 0 CA-C-O 121.001 0.429 . . . . 61.55 111.571 -179.15 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 24.7 t70 -81.12 -29.14 34.87 Favored 'General case' 0 CA--C 1.543 0.694 0 CA-C-O 120.89 0.376 . . . . 74.13 111.474 179.985 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 29' ' ' MET . . . . . . . . . . . . . 58.2 mtm -81.55 172.66 13.21 Favored 'General case' 0 CA--C 1.541 0.623 0 CA-C-O 121.368 0.604 . . . . 51.0 111.989 -179.491 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 48.8 mtmt -77.95 156.04 30.47 Favored 'General case' 0 CA--C 1.539 0.544 0 CA-C-N 115.672 -0.694 . . . . 41.11 111.563 -179.402 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 59.7 t -57.79 -35.22 50.35 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.584 0 CA-C-O 120.934 0.397 . . . . 72.24 111.31 179.183 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -59.87 -37.17 78.56 Favored 'General case' 0 CA--C 1.54 0.559 0 CA-C-N 116.523 -0.308 . . . . 53.44 111.659 176.659 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 23.5 mm-40 -64.63 -45.86 85.03 Favored 'General case' 0 N--CA 1.469 0.476 0 CA-C-O 121.224 0.535 . . . . 61.1 110.824 178.046 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 63.1 mt -58.43 -51.29 70.47 Favored 'General case' 0 CA--C 1.537 0.444 0 CA-C-N 115.8 -0.636 . . . . 62.45 110.887 176.907 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 56.7 mtmt -60.82 -31.19 70.61 Favored 'General case' 0 CA--C 1.54 0.592 0 CA-C-N 116.085 -0.507 . . . . 71.23 111.374 177.183 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER -64.57 -45.62 86.29 Favored 'General case' 0 CA--C 1.54 0.571 0 CA-C-N 116.206 -0.452 . . . . 72.45 110.621 177.387 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 42.1 mm-40 -66.11 -40.91 91.08 Favored 'General case' 0 CA--C 1.538 0.488 0 CA-C-O 120.995 0.426 . . . . 54.43 111.505 176.446 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 38' ' ' LEU . . . . . 0.436 HD11 ' HB3' ' A' ' 52' ' ' LEU . 94.5 mt -58.28 -53.67 55.61 Favored 'General case' 0 CA--C 1.538 0.483 0 N-CA-C 112.07 0.396 . . . . 61.35 112.07 178.547 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 39' ' ' LYS . . . . . 0.446 ' NZ ' ' HB3' ' A' ' 39' ' ' LYS . 0.5 OUTLIER -59.59 -31.97 69.96 Favored 'General case' 0 N--CA 1.472 0.649 0 N-CA-C 112.11 0.411 . . . . 64.1 112.11 -176.224 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 78.2 mt -68.26 -28.1 66.91 Favored 'General case' 0 N--CA 1.469 0.503 0 CA-C-O 121.038 0.447 . . . . 72.44 111.364 176.584 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 41' ' ' ARG . . . . . . . . . . . . . 53.1 mtt-85 -103.23 16.18 27.26 Favored 'General case' 0 CA--C 1.539 0.537 0 CA-C-N 116.368 -0.378 . . . . 71.01 111.663 -175.91 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 51.1 m 62.45 24.69 14.71 Favored 'General case' 0 N--CA 1.48 1.028 0 CA-C-O 121.144 0.497 . . . . 75.43 111.888 -179.475 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 78.1 mt -95.2 135.8 23.12 Favored Pre-proline 0 CA--C 1.542 0.65 0 CA-C-N 116.135 -0.484 . . . . 71.43 111.592 -179.039 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 44' ' ' PRO . . . . . 0.408 ' HG2' ' NH1' ' A' ' 55' ' ' ARG . 58.6 Cg_endo -70.98 143.56 45.3 Favored 'Trans proline' 0 CA--C 1.545 1.027 0 C-N-CA 122.752 2.301 . . . . 54.2 113.57 179.392 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 27.5 m -100.26 34.92 0.26 Allowed 'Isoleucine or valine' 0 N--CA 1.475 0.776 0 CA-C-O 121.389 0.614 . . . . 61.04 111.254 -179.718 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 37.3 m -74.94 -26.33 59.53 Favored 'General case' 0 N--CA 1.473 0.712 0 N-CA-C 114.009 1.115 . . . . 74.41 114.009 -169.371 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . -94.95 -171.95 37.24 Favored Glycine 0 CA--C 1.529 0.919 0 C-N-CA 120.655 -0.783 . . . . 73.35 114.522 -175.281 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 48' ' ' THR . . . . . 0.523 ' O ' ' HG ' ' A' ' 52' ' ' LEU . 81.3 p -84.77 179.67 7.29 Favored 'General case' 0 N--CA 1.471 0.584 0 C-N-CA 122.581 0.353 . . . . 64.42 111.273 178.097 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 49' ' ' LYS . . . . . 0.429 ' O ' HG13 ' A' ' 53' ' ' ILE . 87.4 tttt -46.23 -59.92 2.62 Favored 'General case' 0 N--CA 1.475 0.812 0 N-CA-C 112.32 0.489 . . . . 74.21 112.32 -178.384 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 50' ' ' THR . . . . . . . . . . . . . 94.9 m -58.62 -39.86 81.66 Favored 'General case' 0 N--CA 1.472 0.627 0 N-CA-C 111.869 0.322 . . . . 61.02 111.869 -178.845 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -57.44 -54.08 50.91 Favored 'General case' 0 CA--C 1.536 0.433 0 CA-C-O 120.924 0.392 . . . . 71.35 110.819 176.989 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 52' ' ' LEU . . . . . 0.523 ' HG ' ' O ' ' A' ' 48' ' ' THR . 42.6 mt -54.64 -41.42 70.04 Favored 'General case' 0 CA--C 1.538 0.495 0 CA-C-O 121.229 0.538 . . . . 53.32 111.088 178.969 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 53' ' ' ILE . . . . . 0.477 HG22 ' HD3' ' A' ' 57' ' ' ARG . 77.6 mt -62.16 -47.78 91.53 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.636 0 CA-C-N 115.946 -0.57 . . . . 72.24 111.258 176.711 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 36.6 mm-40 -62.5 -35.56 79.77 Favored 'General case' 0 N--CA 1.468 0.472 0 CA-C-N 116.471 -0.332 . . . . 72.33 111.506 177.387 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 55' ' ' ARG . . . . . 0.408 ' NH1' ' HG2' ' A' ' 44' ' ' PRO . 47.9 ttm-85 -65.08 -45.09 86.71 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-O 120.953 0.406 . . . . 72.33 110.995 178.009 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 81.9 mt -59.17 -48.49 81.4 Favored 'General case' 0 CA--C 1.537 0.479 0 CA-C-O 120.99 0.424 . . . . 73.23 110.918 174.76 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 57' ' ' ARG . . . . . 0.477 ' HD3' HG22 ' A' ' 53' ' ' ILE . 7.8 mtp85 -64.37 -41.16 96.87 Favored 'General case' 0 N--CA 1.471 0.597 0 CA-C-N 116.268 -0.424 . . . . 64.34 112.139 179.859 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -67.63 -30.64 70.26 Favored 'General case' 0 N--CA 1.469 0.479 0 CA-C-O 121.147 0.499 . . . . 64.24 111.514 177.92 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 59' ' ' TYR . . . . . . . . . . . . . 77.0 t80 -74.93 -44.47 48.43 Favored 'General case' 0 CA--C 1.539 0.527 0 CA-C-O 121.069 0.462 . . . . 74.34 110.986 175.956 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 60' ' ' GLN . . . . . 0.653 ' HG3' ' HB2' ' A' ' 64' ' ' SER . 8.9 tp-100 -65.52 -36.39 83.7 Favored 'General case' 0 CA--C 1.537 0.449 0 CA-C-N 116.367 -0.379 . . . . 75.11 110.912 178.409 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 61' ' ' ASP . . . . . . . . . . . . . 14.9 t70 -49.27 -32.44 10.84 Favored 'General case' 0 CA--C 1.543 0.69 0 CA-C-O 121.35 0.595 . . . . 50.11 111.404 175.771 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 62' ' ' GLN . . . . . . . . . . . . . 60.8 mt-30 -84.62 -17.17 39.52 Favored 'General case' 0 CA--C 1.543 0.696 0 CA-C-N 115.99 -0.55 . . . . 74.0 112.457 -176.923 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 63' ' ' ILE . . . . . . . . . . . . . 34.0 pt -129.2 6.63 2.61 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.881 0 N-CA-C 113.1 0.778 . . . . 73.43 113.1 -175.521 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 64' ' ' SER . . . . . 0.653 ' HB2' ' HG3' ' A' ' 60' ' ' GLN . 40.0 t -94.25 141.85 24.13 Favored Pre-proline 0 N--CA 1.475 0.818 0 O-C-N 122.092 -0.38 . . . . 45.2 111.542 -178.864 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 65' ' ' PRO . . . . . . . . . . . . . 17.7 Cg_exo -68.09 73.73 0.75 Allowed 'Trans proline' 0 CA--C 1.543 0.927 0 C-N-CA 122.801 2.334 . . . . 75.13 112.689 176.583 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 66' ' ' VAL . . . . . . . . . . . . . 29.1 m -122.4 155.15 62.55 Favored Pre-proline 0 CA--C 1.539 0.555 0 CA-C-N 116.371 -0.377 . . . . 74.32 111.284 -178.979 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 67' ' ' PRO . . . . . . . . . . . . . 18.3 Cg_endo -59.87 -42.97 40.64 Favored 'Trans proline' 0 CA--C 1.541 0.839 0 C-N-CA 122.596 2.197 . . . . 73.02 112.686 177.973 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 161.28 29.51 0.02 OUTLIER Glycine 0 CA--C 1.527 0.816 0 C-N-CA 120.615 -0.802 . . . . 72.23 114.213 176.831 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 69' ' ' ALA . . . . . 0.61 ' HB3' ' HE2' ' A' ' 71' ' ' LYS . . . 64.95 156.38 0.12 Allowed Pre-proline 0 N--CA 1.477 0.883 0 N-CA-C 112.521 0.563 . . . . 70.02 112.521 178.686 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 70' ' ' PRO . . . . . . . . . . . . . 33.7 Cg_endo -63.86 104.15 0.45 Allowed 'Trans proline' 0 CA--C 1.539 0.741 0 C-N-CA 122.231 1.954 . . . . 73.44 112.171 177.361 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 71' ' ' LYS . . . . . 0.61 ' HE2' ' HB3' ' A' ' 69' ' ' ALA . 74.8 mmtt -110.28 113.95 27.03 Favored 'General case' 0 N--CA 1.467 0.381 0 CA-C-O 120.801 0.334 . . . . 74.14 111.252 -178.232 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -141.52 78.82 17.88 Favored Pre-proline 0 CA--C 1.538 0.481 0 CA-C-O 120.955 0.407 . . . . 55.13 111.169 176.673 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 73' ' ' PRO . . . . . . . . . . . . . 62.7 Cg_endo -90.0 10.07 3.15 Favored 'Trans proline' 0 CA--C 1.54 0.824 0 C-N-CA 122.875 2.384 . . . . 62.32 113.648 -178.601 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . 67.91 -65.69 0.24 Allowed 'General case' 0 N--CA 1.475 0.805 0 C-N-CA 122.879 0.472 . . . . 73.54 111.81 -176.733 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.252 1.234 0 CA-C-O 118.34 -0.838 . . . . 62.32 112.819 176.772 . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 58.1 mtt . . . . . 0 N--CA 1.49 1.574 0 CA-C-O 120.37 0.129 . . . . 53.14 110.863 . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . 146.1 153.47 5.89 Favored Glycine 0 CA--C 1.526 0.762 0 C-N-CA 120.479 -0.867 . . . . 73.23 113.989 176.171 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 3' ' ' HIS . . . . . . . . . . . . . 66.5 m80 -134.38 114.7 13.21 Favored 'General case' 0 CA--C 1.539 0.537 0 CA-C-O 121.17 0.509 . . . . 71.3 110.953 177.371 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 4' ' ' HIS . . . . . . . . . . . . . 15.8 p80 -85.55 128.02 34.62 Favored 'General case' 0 CA--C 1.542 0.653 0 N-CA-C 113.087 0.773 . . . . 70.33 113.087 -172.09 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 5' ' ' HIS . . . . . . . . . . . . . 58.8 t-80 -94.63 136.15 35.27 Favored 'General case' 0 CA--C 1.541 0.612 0 CA-C-N 116.091 -0.504 . . . . 74.54 109.997 172.26 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 12.2 p80 -121.31 -176.75 3.36 Favored 'General case' 0 N--CA 1.471 0.599 0 CA-C-O 120.879 0.371 . . . . 74.54 111.245 -178.566 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 52.1 m80 -121.9 168.61 11.68 Favored 'General case' 0 CA--C 1.537 0.478 0 CA-C-O 121.034 0.445 . . . . 74.4 111.764 177.977 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 8' ' ' HIS . . . . . . . . . . . . . 64.9 t60 -145.17 96.68 2.88 Favored 'General case' 0 CA--C 1.538 0.515 0 CA-C-N 116.051 -0.522 . . . . 72.44 110.664 173.6 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 47.0 m -79.36 171.35 15.29 Favored 'General case' 0 N--CA 1.472 0.647 0 CA-C-O 121.368 0.604 . . . . 74.22 112.594 -175.205 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 57.0 p-80 -152.95 152.05 31.01 Favored 'General case' 0 CA--C 1.539 0.545 0 CA-C-N 115.785 -0.643 . . . . 71.31 110.668 176.581 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 11' ' ' MET . . . . . . . . . . . . . 86.2 mtp -120.89 134.24 55.29 Favored 'General case' 0 N--CA 1.472 0.644 0 CA-C-O 120.789 0.328 . . . . 64.12 111.37 179.154 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 45.5 m -73.15 119.09 16.91 Favored 'General case' 0 N--CA 1.469 0.5 0 CA-C-N 116.446 -0.343 . . . . 61.11 111.076 177.491 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 13' ' ' THR . . . . . . . . . . . . . 45.1 p -82.65 131.92 53.48 Favored Pre-proline 0 CA--C 1.542 0.65 0 CA-C-O 120.679 0.275 . . . . 72.31 111.713 -179.542 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 14' ' ' PRO . . . . . . . . . . . . . 64.0 Cg_endo -70.82 154.49 63.52 Favored 'Trans proline' 0 CA--C 1.542 0.878 0 C-N-CA 122.969 2.446 . . . . 73.14 113.81 -176.673 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 2.0 pp -119.2 -178.38 3.56 Favored 'General case' 0 N--CA 1.474 0.728 0 CA-C-N 116.027 -0.533 . . . . 71.0 112.137 -178.435 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 16' ' ' THR . . . . . . . . . . . . . 13.9 t -151.85 173.75 14.41 Favored 'General case' 0 N--CA 1.471 0.61 0 CA-C-N 116.425 -0.352 . . . . 75.22 111.081 178.373 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . -63.75 137.66 41.89 Favored Glycine 0 CA--C 1.528 0.882 0 N-CA-C 114.253 0.461 . . . . 53.3 114.253 -177.183 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 18' ' ' LYS . . . . . 0.511 ' HA ' ' HE2' ' A' ' 18' ' ' LYS . 8.9 mmpt? -127.3 128.42 24.06 Favored Pre-proline 0 CA--C 1.544 0.747 0 O-C-N 122.68 -0.306 . . . . 73.41 111.019 -179.315 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 98.5 Cg_endo -77.9 -175.23 2.59 Favored 'Trans proline' 0 CA--C 1.543 0.951 0 C-N-CA 122.727 2.285 . . . . 74.22 113.31 179.734 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . -84.35 -2.05 89.22 Favored Glycine 0 CA--C 1.528 0.889 0 C-N-CA 121.283 -0.484 . . . . 63.55 113.315 178.777 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -123.91 -177.48 3.77 Favored 'General case' 0 N--CA 1.467 0.415 0 CA-C-O 120.709 0.29 . . . . 61.51 110.896 176.632 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 95.1 mt -113.0 133.92 21.91 Favored Pre-proline 0 N--CA 1.468 0.431 0 CA-C-O 120.624 0.25 . . . . 71.12 111.503 179.311 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 23' ' ' PRO . . . . . 0.488 ' O ' ' HG ' ' A' ' 26' ' ' LEU . 72.3 Cg_endo -75.61 135.58 18.15 Favored 'Trans proline' 0 CA--C 1.539 0.763 0 C-N-CA 122.333 2.022 . . . . 51.45 112.478 177.31 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -59.41 -16.42 23.19 Favored 'General case' 0 CA--C 1.542 0.647 0 CA-C-O 121.151 0.5 . . . . 75.33 111.707 178.657 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 25' ' ' ASN . . . . . 0.405 ' O ' ' HG3' ' A' ' 29' ' ' MET . 17.5 m120 -71.94 -2.64 18.82 Favored 'General case' 0 CA--C 1.541 0.609 0 N-CA-C 113.171 0.804 . . . . 71.34 113.171 -179.565 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 26' ' ' LEU . . . . . 0.488 ' HG ' ' O ' ' A' ' 23' ' ' PRO . 89.4 mt -54.8 -31.64 59.25 Favored 'General case' 0 N--CA 1.474 0.744 0 CA-C-O 121.415 0.626 . . . . 74.12 110.531 174.392 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 13.3 t70 -62.09 -48.81 78.51 Favored 'General case' 0 CA--C 1.542 0.654 0 CA-C-N 115.697 -0.683 . . . . 74.43 110.901 173.09 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 20.7 m-20 -66.61 -35.37 80.03 Favored 'General case' 0 CA--C 1.543 0.698 0 CA-C-N 115.983 -0.553 . . . . 75.14 111.609 -179.877 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 29' ' ' MET . . . . . 0.445 ' SD ' HD23 ' A' ' 26' ' ' LEU . 83.6 mtp -62.01 146.87 48.9 Favored 'General case' 0 CA--C 1.537 0.463 0 CA-C-O 121.249 0.547 . . . . 62.31 111.935 -178.43 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 30' ' ' LYS . . . . . 0.585 ' HB2' ' HG2' ' A' ' 33' ' ' GLU . 22.1 mtpp -75.24 170.08 16.77 Favored 'General case' 0 CA--C 1.538 0.501 0 CA-C-N 115.76 -0.655 . . . . 62.01 111.682 -176.298 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 31' ' ' VAL . . . . . 0.499 HG12 ' HE3' ' A' ' 35' ' ' LYS . 45.7 t -60.48 -46.4 95.43 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.669 0 CA-C-N 116.017 -0.538 . . . . 71.42 111.796 -177.354 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -63.99 -36.66 84.71 Favored 'General case' 0 N--CA 1.47 0.532 0 N-CA-C 112.069 0.396 . . . . 51.35 112.069 -179.785 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 33' ' ' GLU . . . . . 0.585 ' HG2' ' HB2' ' A' ' 30' ' ' LYS . 3.3 mm-40 -64.21 -45.65 87.32 Favored 'General case' 0 N--CA 1.471 0.578 0 CA-C-O 121.076 0.465 . . . . 64.23 110.806 -179.032 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 87.6 mt -59.4 -44.57 92.79 Favored 'General case' 0 CA--C 1.539 0.543 0 CA-C-N 116.032 -0.531 . . . . 62.32 110.903 177.607 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 35' ' ' LYS . . . . . 0.499 ' HE3' HG12 ' A' ' 31' ' ' VAL . 99.2 mttt -59.35 -35.87 74.68 Favored 'General case' 0 N--CA 1.469 0.488 0 CA-C-N 116.267 -0.424 . . . . 75.01 111.36 176.101 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 36' ' ' GLN . . . . . 0.513 ' O ' ' HG ' ' A' ' 40' ' ' LEU . 54.4 tp60 -59.69 -43.93 93.85 Favored 'General case' 0 CA--C 1.535 0.392 0 CA-C-N 116.371 -0.377 . . . . 71.23 111.217 178.916 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 37' ' ' GLU . . . . . 0.479 ' O ' ' HG3' ' A' ' 41' ' ' ARG . 35.1 mt-10 -67.63 -42.76 81.8 Favored 'General case' 0 CA--C 1.537 0.464 0 C-N-CA 121.082 -0.247 . . . . 75.15 111.224 176.33 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 38' ' ' LEU . . . . . . . . . . . . . 78.7 mt -52.07 -58.84 5.35 Favored 'General case' 0 N--CA 1.472 0.673 0 N-CA-C 111.863 0.32 . . . . 73.34 111.863 177.295 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 39' ' ' LYS . . . . . 0.409 ' HG2' ' O ' ' A' ' 36' ' ' GLN . 16.1 ptpt -55.98 -36.63 68.07 Favored 'General case' 0 N--CA 1.473 0.692 0 N-CA-C 111.891 0.33 . . . . 75.43 111.891 -177.999 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 40' ' ' LEU . . . . . 0.513 ' HG ' ' O ' ' A' ' 36' ' ' GLN . 92.3 mt -68.72 -29.76 68.26 Favored 'General case' 0 CA--C 1.538 0.501 0 CA-C-O 121.015 0.436 . . . . 73.13 111.33 178.083 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 41' ' ' ARG . . . . . 0.479 ' HG3' ' O ' ' A' ' 37' ' ' GLU . 53.9 mtt-85 -96.01 16.04 18.98 Favored 'General case' 0 CA--C 1.541 0.617 0 CA-C-N 116.327 -0.397 . . . . 75.41 111.454 -179.921 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 50.5 m 65.66 27.52 11.35 Favored 'General case' 0 N--CA 1.48 1.067 0 CA-C-O 121.356 0.598 . . . . 61.42 112.154 178.268 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 49.1 mt -102.28 144.75 29.22 Favored Pre-proline 0 CA--C 1.544 0.734 0 CA-C-N 116.192 -0.458 . . . . 75.12 111.385 -179.916 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 44' ' ' PRO . . . . . . . . . . . . . 57.6 Cg_endo -70.13 123.84 10.36 Favored 'Trans proline' 0 CA--C 1.542 0.888 0 C-N-CA 122.479 2.12 . . . . 70.33 112.944 178.802 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 28.3 m -82.27 -15.04 12.11 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.596 0 N-CA-C 112.853 0.686 . . . . 71.15 112.853 -174.598 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 65.9 m -71.18 79.56 0.7 Allowed 'General case' 0 N--CA 1.472 0.658 0 N-CA-C 112.358 0.503 . . . . 61.22 112.358 -178.272 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . -158.05 173.41 35.27 Favored Glycine 0 CA--C 1.526 0.764 0 C-N-CA 121.239 -0.505 . . . . 74.5 113.193 177.404 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 48' ' ' THR . . . . . 0.539 ' O ' ' HG ' ' A' ' 52' ' ' LEU . 72.3 p -77.58 158.53 29.78 Favored 'General case' 0 N--CA 1.474 0.739 0 O-C-N 122.779 -0.248 . . . . 51.33 110.715 176.808 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 60.0 tttm -49.04 -40.95 33.31 Favored 'General case' 0 N--CA 1.476 0.846 0 CA-C-O 120.729 0.299 . . . . 64.32 111.596 -177.228 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 50' ' ' THR . . . . . 0.464 ' O ' ' HG2' ' A' ' 54' ' ' GLU . 89.2 m -60.63 -54.77 41.32 Favored 'General case' 0 N--CA 1.469 0.481 0 CA-C-O 120.818 0.342 . . . . 71.35 110.96 174.714 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 10.0 mm-40 -54.5 -35.15 62.81 Favored 'General case' 0 N--CA 1.47 0.541 0 CA-C-N 116.22 -0.445 . . . . 72.41 111.971 -179.564 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 52' ' ' LEU . . . . . 0.539 ' HG ' ' O ' ' A' ' 48' ' ' THR . 46.5 mt -62.36 -49.77 74.24 Favored 'General case' 0 CA--C 1.537 0.466 0 CA-C-O 120.977 0.418 . . . . 72.5 110.912 177.962 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 53' ' ' ILE . . . . . 0.512 ' O ' ' HG3' ' A' ' 57' ' ' ARG . 66.6 mt -60.71 -51.61 71.13 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.481 0 CA-C-N 116.149 -0.478 . . . . 74.12 110.847 177.757 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 54' ' ' GLU . . . . . 0.464 ' HG2' ' O ' ' A' ' 50' ' ' THR . 7.5 mm-40 -55.54 -40.75 72.26 Favored 'General case' 0 N--CA 1.47 0.548 0 CA-C-O 121.155 0.503 . . . . 74.51 111.205 178.778 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 23.7 ttm180 -67.37 -38.6 85.0 Favored 'General case' 0 CA--C 1.536 0.428 0 CA-C-N 116.048 -0.524 . . . . 71.44 111.333 -178.685 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 89.7 mt -60.63 -41.45 94.92 Favored 'General case' 0 CA--C 1.535 0.401 0 CA-C-O 120.916 0.388 . . . . 65.22 110.555 172.292 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 57' ' ' ARG . . . . . 0.512 ' HG3' ' O ' ' A' ' 53' ' ' ILE . 44.2 mtm180 -60.98 -53.99 50.42 Favored 'General case' 0 C--O 1.221 -0.41 0 CA-C-N 116.29 -0.413 . . . . 72.45 111.018 177.902 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 58' ' ' ALA . . . . . 0.437 ' O ' ' HG3' ' A' ' 62' ' ' GLN . . . -49.74 -48.82 49.85 Favored 'General case' 0 N--CA 1.471 0.582 0 N-CA-C 112.302 0.482 . . . . 71.24 112.302 -178.518 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 59' ' ' TYR . . . . . 0.455 ' HA ' HE21 ' A' ' 62' ' ' GLN . 70.1 t80 -57.63 -56.83 16.79 Favored 'General case' 0 CA--C 1.54 0.587 0 CA-C-O 120.94 0.4 . . . . 64.42 111.714 178.022 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 60' ' ' GLN . . . . . 0.511 ' NE2' ' HB2' ' A' ' 64' ' ' SER . 25.7 tm0? -66.47 -31.99 73.08 Favored 'General case' 0 CA--C 1.545 0.774 0 CA-C-N 116.131 -0.486 . . . . 62.23 111.485 -176.825 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 61' ' ' ASP . . . . . . . . . . . . . 32.6 t70 -64.34 -30.29 71.34 Favored 'General case' 0 CA--C 1.541 0.616 0 C-N-CA 123.267 0.627 . . . . 75.33 112.032 -177.622 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 62' ' ' GLN . . . . . 0.455 HE21 ' HA ' ' A' ' 59' ' ' TYR . 47.2 mt-30 -58.22 -39.29 78.68 Favored 'General case' 0 N--CA 1.472 0.652 0 CA-C-O 120.93 0.395 . . . . 74.13 111.61 179.712 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 63' ' ' ILE . . . . . . . . . . . . . 29.7 pt -102.47 -17.3 7.05 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.607 0 N-CA-C 112.258 0.466 . . . . 71.43 112.258 -178.778 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 64' ' ' SER . . . . . 0.511 ' HB2' ' NE2' ' A' ' 60' ' ' GLN . 32.0 t -71.69 140.75 84.3 Favored Pre-proline 0 N--CA 1.472 0.664 0 N-CA-C 111.926 0.343 . . . . 43.31 111.926 -178.549 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 65' ' ' PRO . . . . . . . . . . . . . 53.0 Cg_exo -56.36 97.77 0.07 OUTLIER 'Trans proline' 0 CA--C 1.54 0.804 0 C-N-CA 122.512 2.141 . . . . 63.12 112.273 173.7 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 66' ' ' VAL . . . . . . . . . . . . . 26.7 m -81.82 148.63 61.72 Favored Pre-proline 0 CA--C 1.54 0.589 0 CA-C-N 116.437 -0.347 . . . . 52.01 111.595 -178.9 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 67' ' ' PRO . . . . . . . . . . . . . 73.8 Cg_endo -73.9 64.92 5.02 Favored 'Trans proline' 0 CA--C 1.545 1.044 0 C-N-CA 122.707 2.271 . . . . 73.24 113.182 -179.151 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 73.29 56.03 5.87 Favored Glycine 0 CA--C 1.529 0.918 0 C-N-CA 120.995 -0.621 . . . . 51.1 112.925 -178.56 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . 68.17 137.52 0.05 OUTLIER Pre-proline 0 N--CA 1.474 0.773 0 C-N-CA 123.355 0.662 . . . . 54.13 112.346 -176.459 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 70' ' ' PRO . . . . . . . . . . . . . 32.8 Cg_endo -63.3 128.77 23.49 Favored 'Trans proline' 0 CA--C 1.54 0.805 0 C-N-CA 122.364 2.043 . . . . 72.14 112.501 177.236 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 56.1 tptt -63.92 -40.96 97.67 Favored 'General case' 0 CA--C 1.539 0.535 0 CA-C-N 116.463 -0.335 . . . . 73.2 111.873 -177.668 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -83.81 121.56 76.08 Favored Pre-proline 0 CA--C 1.54 0.593 0 CA-C-O 120.609 0.242 . . . . 72.35 111.648 179.971 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 73' ' ' PRO . . . . . . . . . . . . . 37.7 Cg_endo -65.46 113.86 2.65 Favored 'Trans proline' 0 CA--C 1.542 0.877 0 C-N-CA 122.34 2.027 . . . . 63.12 112.67 179.557 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -57.43 117.52 4.22 Favored 'General case' 0 CA--C 1.538 0.511 0 N-CA-C 112.425 0.528 . . . . 72.34 112.425 -178.176 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.25 1.117 0 CA-C-O 119.08 -0.486 . . . . 65.41 111.743 178.879 . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 62.5 mtm . . . . . 0 N--CA 1.492 1.642 0 CA-C-O 120.604 0.24 . . . . 64.44 110.962 . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . 147.11 157.78 7.53 Favored Glycine 0 CA--C 1.525 0.686 0 C-N-CA 120.998 -0.62 . . . . 65.24 113.388 178.103 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 3' ' ' HIS . . . . . . . . . . . . . 52.4 p-80 -163.53 117.17 1.55 Allowed 'General case' 0 CA--C 1.537 0.453 0 CA-C-O 120.744 0.307 . . . . 73.21 111.226 179.456 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 4' ' ' HIS . . . . . . . . . . . . . 9.8 p80 -64.87 127.55 32.03 Favored 'General case' 0 CA--C 1.539 0.526 0 O-C-N 122.25 -0.281 . . . . 64.21 110.383 176.868 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 5' ' ' HIS . . . . . . . . . . . . . 29.0 t-80 -62.12 112.89 2.55 Favored 'General case' 0 CA--C 1.54 0.585 0 CA-C-O 120.638 0.256 . . . . 72.13 111.639 -177.672 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 9.4 p-80 -107.65 173.08 6.48 Favored 'General case' 0 CA--C 1.54 0.579 0 CA-C-O 121.083 0.468 . . . . 75.41 111.693 178.52 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 31.6 p-80 -149.5 175.4 11.53 Favored 'General case' 0 N--CA 1.469 0.514 0 CA-C-O 120.961 0.41 . . . . 72.31 111.609 -177.916 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 8' ' ' HIS . . . . . . . . . . . . . 71.9 m80 -94.36 131.99 39.44 Favored 'General case' 0 CA--C 1.538 0.504 0 CA-C-N 116.405 -0.361 . . . . 72.2 110.894 176.127 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 70.0 m -103.16 137.33 41.45 Favored 'General case' 0 N--CA 1.473 0.685 0 CA-C-O 120.765 0.317 . . . . 62.33 111.09 178.557 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 42.7 p-80 -103.32 132.52 49.51 Favored 'General case' 0 N--CA 1.472 0.67 0 CA-C-O 120.62 0.247 . . . . 71.21 111.288 -178.457 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 11' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -125.84 179.27 5.27 Favored 'General case' 0 N--CA 1.471 0.618 0 CA-C-O 120.814 0.34 . . . . 62.13 111.581 179.682 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 65.1 p -131.02 150.49 52.12 Favored 'General case' 0 N--CA 1.475 0.821 0 CA-C-O 120.931 0.396 . . . . 64.32 111.608 -178.8 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 13' ' ' THR . . . . . . . . . . . . . 76.8 p -86.11 127.23 62.58 Favored Pre-proline 0 N--CA 1.472 0.663 0 N-CA-C 112.117 0.414 . . . . 74.53 112.117 -178.924 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 14' ' ' PRO . . . . . . . . . . . . . 30.5 Cg_endo -63.11 105.73 0.49 Allowed 'Trans proline' 0 CA--C 1.54 0.822 0 C-N-CA 122.778 2.319 . . . . 74.13 113.001 178.333 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 15' ' ' LEU . . . . . 0.408 ' HG ' ' H ' ' A' ' 15' ' ' LEU . 2.7 pp -79.11 156.22 28.39 Favored 'General case' 0 N--CA 1.472 0.657 0 CA-C-O 120.907 0.384 . . . . 65.42 111.994 179.82 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 16' ' ' THR . . . . . . . . . . . . . 63.5 p -95.37 -48.67 5.78 Favored 'General case' 0 N--CA 1.475 0.809 0 CA-C-O 121.084 0.468 . . . . 73.34 112.028 -177.844 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . 88.81 -58.32 4.04 Favored Glycine 0 CA--C 1.529 0.928 0 C-N-CA 121.313 -0.47 . . . . 54.22 113.171 179.764 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 18' ' ' LYS . . . . . 0.483 ' NZ ' ' HB3' ' A' ' 18' ' ' LYS . 0.3 OUTLIER -115.38 137.52 23.13 Favored Pre-proline 0 N--CA 1.471 0.617 0 O-C-N 122.536 -0.39 . . . . 50.53 111.62 -179.54 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 19' ' ' PRO . . . . . 0.423 ' HD3' ' HA ' ' A' ' 18' ' ' LYS . 35.7 Cg_exo -62.79 134.23 45.91 Favored 'Trans proline' 0 CA--C 1.543 0.933 0 C-N-CA 123.173 2.582 . . . . 72.42 113.558 -179.359 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . -83.94 88.26 1.53 Allowed Glycine 0 CA--C 1.531 1.051 0 C-N-CA 121.515 -0.374 . . . . 61.24 113.186 178.797 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -126.1 -170.39 2.18 Favored 'General case' 0 N--CA 1.47 0.565 0 CA-C-O 120.86 0.362 . . . . 71.13 111.572 -179.123 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 22' ' ' LEU . . . . . 0.446 ' HG ' ' HG3' ' A' ' 60' ' ' GLN . 95.9 mt -105.24 156.5 36.12 Favored Pre-proline 0 N--CA 1.471 0.615 0 CA-C-N 116.417 -0.356 . . . . 75.33 111.378 176.29 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 23' ' ' PRO . . . . . 0.412 ' HD2' HD21 ' A' ' 26' ' ' LEU . 39.3 Cg_exo -62.44 140.41 81.97 Favored 'Trans proline' 0 CA--C 1.543 0.97 0 C-N-CA 122.195 1.93 . . . . 73.43 112.249 171.562 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -60.66 -55.35 34.32 Favored 'General case' 0 CA--C 1.541 0.6 0 N-CA-C 112.235 0.458 . . . . 75.14 112.235 -178.907 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 61.7 m-20 -91.84 84.84 5.44 Favored 'General case' 0 CA--C 1.536 0.43 0 CA-C-O 120.914 0.388 . . . . 71.15 111.813 -177.021 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 26' ' ' LEU . . . . . 0.412 HD21 ' HD2' ' A' ' 23' ' ' PRO . 98.6 mt -84.12 -32.98 24.42 Favored 'General case' 0 CA--C 1.538 0.496 0 CA-C-O 120.881 0.372 . . . . 62.21 111.062 176.886 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 4.7 m-20 -66.29 -40.81 90.29 Favored 'General case' 0 CA--C 1.538 0.517 0 CA-C-N 116.308 -0.406 . . . . 64.51 111.562 -179.898 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 1.9 m-20 -60.39 -44.65 95.46 Favored 'General case' 0 CA--C 1.538 0.494 0 CA-C-N 116.21 -0.45 . . . . 65.33 112.05 179.506 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 29' ' ' MET . . . . . . . . . . . . . 59.0 mtm -66.46 157.48 31.94 Favored 'General case' 0 CA--C 1.54 0.573 0 CA-C-O 120.995 0.426 . . . . 63.24 111.429 179.874 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 30' ' ' LYS . . . . . 0.477 ' HB2' ' HG2' ' A' ' 33' ' ' GLU . 46.5 mtmt -78.71 160.88 27.25 Favored 'General case' 0 N--CA 1.47 0.551 0 CA-C-O 120.978 0.418 . . . . 74.51 111.902 -174.659 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 31' ' ' VAL . . . . . 0.411 HG12 ' HE3' ' A' ' 35' ' ' LYS . 47.9 t -54.8 -40.34 51.76 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.547 0 CA-C-O 121.19 0.519 . . . . 72.11 110.941 177.011 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -59.59 -39.44 84.18 Favored 'General case' 0 CA--C 1.54 0.565 0 CA-C-N 116.043 -0.526 . . . . 41.2 111.656 176.834 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 33' ' ' GLU . . . . . 0.477 ' HG2' ' HB2' ' A' ' 30' ' ' LYS . 45.8 mm-40 -64.27 -45.89 86.11 Favored 'General case' 0 CA--C 1.537 0.444 0 CA-C-O 121.195 0.522 . . . . 62.01 110.559 178.134 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 94.3 mt -59.5 -40.78 88.16 Favored 'General case' 0 N--CA 1.468 0.442 0 CA-C-N 115.963 -0.562 . . . . 72.12 111.484 178.597 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 35' ' ' LYS . . . . . 0.436 ' HA ' HD12 ' A' ' 38' ' ' LEU . 99.6 mttt -61.6 -36.93 82.11 Favored 'General case' 0 CA--C 1.538 0.517 0 CA-C-O 121.022 0.439 . . . . 60.42 111.428 177.082 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 36' ' ' GLN . . . . . 0.428 ' O ' ' HG2' ' A' ' 39' ' ' LYS . 8.4 tm0? -63.58 -42.38 98.3 Favored 'General case' 0 CA--C 1.539 0.555 0 CA-C-O 121.105 0.479 . . . . 74.43 110.748 174.357 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 37' ' ' GLU . . . . . 0.447 ' HA ' HH21 ' A' ' 41' ' ' ARG . 18.0 mm-40 -65.16 -40.52 94.44 Favored 'General case' 0 CA--C 1.541 0.6 0 CA-C-N 116.437 -0.347 . . . . 73.24 111.775 175.433 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 38' ' ' LEU . . . . . 0.516 HD11 HD22 ' A' ' 52' ' ' LEU . 86.0 mt -57.0 -52.74 64.06 Favored 'General case' 0 N--CA 1.468 0.464 0 N-CA-C 112.142 0.423 . . . . 73.1 112.142 179.377 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 39' ' ' LYS . . . . . 0.428 ' HG2' ' O ' ' A' ' 36' ' ' GLN . 17.6 ptpt -58.3 -33.92 69.98 Favored 'General case' 0 CA--C 1.542 0.64 0 CA-C-O 120.757 0.313 . . . . 75.54 111.737 -178.135 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 65.4 mt -69.06 -22.5 64.02 Favored 'General case' 0 N--CA 1.471 0.615 0 CA-C-O 121.016 0.436 . . . . 62.14 111.373 176.119 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 41' ' ' ARG . . . . . 0.447 HH21 ' HA ' ' A' ' 37' ' ' GLU . 0.6 OUTLIER -101.8 14.16 32.77 Favored 'General case' 0 CA--C 1.543 0.687 0 CA-C-N 116.12 -0.491 . . . . 72.1 111.415 178.354 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 62.5 m 63.01 18.84 11.24 Favored 'General case' 0 N--CA 1.48 1.058 0 CA-C-O 121.107 0.48 . . . . 72.23 112.237 -179.178 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 43' ' ' LEU . . . . . 0.402 HD22 ' HG2' ' A' ' 55' ' ' ARG . 76.3 mt -93.14 146.64 32.32 Favored Pre-proline 0 CA--C 1.542 0.64 0 C-N-CA 122.714 0.406 . . . . 72.03 111.526 -179.131 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 44' ' ' PRO . . . . . . . . . . . . . 73.8 Cg_endo -73.26 145.51 38.88 Favored 'Trans proline' 0 CA--C 1.541 0.841 0 C-N-CA 122.58 2.187 . . . . 61.43 112.799 178.092 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 34.1 m -88.93 19.08 0.59 Allowed 'Isoleucine or valine' 0 CA--C 1.544 0.733 0 N-CA-C 112.583 0.586 . . . . 74.41 112.583 -175.439 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 46.7 t -100.49 104.15 15.52 Favored 'General case' 0 N--CA 1.475 0.787 0 CA-C-O 120.814 0.34 . . . . 51.34 111.724 -177.929 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 171.24 -175.22 44.9 Favored Glycine 0 CA--C 1.527 0.817 0 C-N-CA 121.052 -0.594 . . . . 54.31 113.417 178.844 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 48' ' ' THR . . . . . 0.548 ' O ' ' HG ' ' A' ' 52' ' ' LEU . 43.8 p -96.98 169.2 9.99 Favored 'General case' 0 N--CA 1.472 0.666 0 O-C-N 122.661 -0.317 . . . . 63.44 111.537 -179.957 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 49' ' ' LYS . . . . . 0.404 ' HD3' HG22 ' A' ' 31' ' ' VAL . 21.4 tptm -50.16 -55.22 15.97 Favored 'General case' 0 N--CA 1.473 0.683 0 N-CA-C 111.924 0.342 . . . . 63.45 111.924 -179.686 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 50' ' ' THR . . . . . 0.44 ' O ' ' HG2' ' A' ' 54' ' ' GLU . 91.5 m -63.64 -43.77 95.82 Favored 'General case' 0 N--CA 1.471 0.583 0 CA-C-O 120.791 0.329 . . . . 75.2 111.536 178.049 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 51' ' ' GLU . . . . . 0.424 ' HB2' ' OG1' ' A' ' 48' ' ' THR . 2.6 tm-20 -55.19 -54.74 39.53 Favored 'General case' 0 CA--C 1.539 0.557 0 C-N-CA 122.896 0.478 . . . . 64.01 111.838 -177.656 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 52' ' ' LEU . . . . . 0.548 ' HG ' ' O ' ' A' ' 48' ' ' THR . 40.8 mt -55.12 -39.39 69.34 Favored 'General case' 0 N--CA 1.471 0.583 0 CA-C-O 120.902 0.382 . . . . 75.43 111.851 -177.15 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 53' ' ' ILE . . . . . . . . . . . . . 77.9 mt -61.41 -45.01 99.5 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.442 0 CA-C-O 121.31 0.576 . . . . 73.21 110.821 175.364 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 54' ' ' GLU . . . . . 0.477 ' CD ' HH21 ' A' ' 57' ' ' ARG . 8.9 mm-40 -64.93 -35.45 81.2 Favored 'General case' 0 N--CA 1.468 0.426 0 CA-C-N 115.772 -0.649 . . . . 63.35 111.207 179.064 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 55' ' ' ARG . . . . . 0.447 HH11 ' HD3' ' A' ' 55' ' ' ARG . 13.2 ttm180 -68.61 -39.76 80.69 Favored 'General case' 0 CA--C 1.541 0.599 0 CA-C-N 116.16 -0.473 . . . . 72.03 110.647 178.165 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 59.1 mt -59.75 -53.23 60.34 Favored 'General case' 0 N--CA 1.47 0.559 0 CA-C-N 116.293 -0.412 . . . . 72.14 111.228 174.138 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 57' ' ' ARG . . . . . 0.477 HH21 ' CD ' ' A' ' 54' ' ' GLU . 40.5 mtm105 -57.38 -45.89 83.97 Favored 'General case' 0 CA--C 1.537 0.47 0 CA-C-O 120.687 0.279 . . . . 75.04 111.442 179.594 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 58' ' ' ALA . . . . . 0.427 ' O ' ' HG3' ' A' ' 62' ' ' GLN . . . -60.33 -34.39 73.75 Favored 'General case' 0 N--CA 1.47 0.531 0 N-CA-C 112.115 0.413 . . . . 51.03 112.115 -179.624 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 59' ' ' TYR . . . . . . . . . . . . . 71.2 t80 -75.27 -54.17 7.53 Favored 'General case' 0 CA--C 1.539 0.549 0 CA-C-O 120.962 0.411 . . . . 74.22 111.555 179.176 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 60' ' ' GLN . . . . . 0.446 ' HG3' ' HG ' ' A' ' 22' ' ' LEU . 24.4 tm0? -60.26 -32.57 71.29 Favored 'General case' 0 CA--C 1.542 0.66 0 CA-C-O 120.923 0.392 . . . . 73.31 111.072 -177.865 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 61' ' ' ASP . . . . . . . . . . . . . 15.8 t70 -57.53 -29.96 64.79 Favored 'General case' 0 CA--C 1.545 0.756 0 C-N-CA 122.977 0.511 . . . . 70.53 111.909 175.169 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 62' ' ' GLN . . . . . 0.427 ' HG3' ' O ' ' A' ' 58' ' ' ALA . 68.9 mt-30 -80.3 -35.37 35.84 Favored 'General case' 0 N--CA 1.473 0.68 0 CA-C-O 120.889 0.376 . . . . 64.33 112.002 -177.487 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 63' ' ' ILE . . . . . . . . . . . . . 34.1 pt -86.59 -21.45 7.4 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.576 0 CA-C-O 120.876 0.37 . . . . 61.34 111.818 -179.356 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 41.2 t -94.04 134.12 26.48 Favored Pre-proline 0 N--CA 1.471 0.604 0 CA-C-N 116.553 -0.294 . . . . 70.04 111.36 179.703 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 65' ' ' PRO . . . . . . . . . . . . . 38.1 Cg_exo -58.09 104.57 0.18 Allowed 'Trans proline' 0 C--N 1.353 0.765 0 C-N-CA 122.582 2.188 . . . . 72.42 112.857 177.868 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 66' ' ' VAL . . . . . 0.531 ' HB ' ' HD2' ' A' ' 67' ' ' PRO . 35.1 m -68.03 160.78 72.6 Favored Pre-proline 0 CA--C 1.542 0.672 0 CA-C-N 116.259 -0.428 . . . . 73.33 111.182 178.994 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 67' ' ' PRO . . . . . 0.531 ' HD2' ' HB ' ' A' ' 66' ' ' VAL . 10.9 Cg_endo -53.21 -25.31 29.45 Favored 'Trans proline' 0 CA--C 1.544 0.997 0 C-N-CA 122.488 2.125 . . . . 54.12 113.809 -178.081 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . -83.53 -20.14 60.7 Favored Glycine 0 CA--C 1.528 0.887 0 C-N-CA 121.133 -0.556 . . . . 53.45 113.358 178.237 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . -92.94 154.37 41.87 Favored Pre-proline 0 CA--C 1.542 0.639 0 O-C-N 122.49 -0.418 . . . . 72.44 111.598 -178.137 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 70' ' ' PRO . . . . . . . . . . . . . 89.8 Cg_endo -79.36 153.14 23.97 Favored 'Trans proline' 0 CA--C 1.542 0.899 0 C-N-CA 122.579 2.186 . . . . 65.25 112.785 175.921 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 4.0 mppt? -86.37 136.59 33.07 Favored 'General case' 0 N--CA 1.47 0.566 0 O-C-N 122.341 -0.224 . . . . 71.31 110.97 178.403 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . 69.79 85.74 0.13 Allowed Pre-proline 0 N--CA 1.472 0.653 0 C-N-CA 123.133 0.573 . . . . 73.42 111.747 -174.978 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 73' ' ' PRO . . . . . . . . . . . . . 94.4 Cg_endo -77.37 -154.95 0.05 OUTLIER 'Trans proline' 0 CA--C 1.541 0.864 0 C-N-CA 122.841 2.361 . . . . 64.51 112.672 178.764 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -60.83 90.78 0.02 OUTLIER 'General case' 0 CA--C 1.541 0.606 0 CA-C-O 120.977 0.418 . . . . 72.3 111.995 178.752 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.254 1.32 0 CA-C-O 118.826 -0.607 . . . . 43.23 111.685 177.765 . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . 0.497 ' SD ' ' N ' ' A' ' 1' ' ' MET . 1.2 mpt? . . . . . 0 N--CA 1.491 1.587 0 CA-C-O 120.752 0.31 . . . . 60.55 111.248 . . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . -92.45 96.41 2.14 Favored Glycine 0 CA--C 1.528 0.853 0 C-N-CA 121.2 -0.524 . . . . 61.0 112.7 177.817 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 3' ' ' HIS . . . . . . . . . . . . . 0.8 OUTLIER -60.95 -21.52 63.54 Favored 'General case' 0 N--CA 1.473 0.678 0 N-CA-C 112.558 0.577 . . . . 61.25 112.558 -178.514 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 4' ' ' HIS . . . . . . . . . . . . . 86.1 m-70 -141.34 102.49 4.23 Favored 'General case' 0 N--CA 1.47 0.53 0 CA-C-O 120.967 0.413 . . . . 62.54 110.614 175.761 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 5' ' ' HIS . . . . . . . . . . . . . 58.1 m80 -74.88 113.23 11.93 Favored 'General case' 0 CA--C 1.538 0.487 0 CA-C-O 121.122 0.486 . . . . 75.32 111.726 -177.52 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 73.6 m80 -85.81 125.53 33.34 Favored 'General case' 0 CA--C 1.535 0.396 0 CA-C-N 116.185 -0.462 . . . . 72.53 111.105 -179.334 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 80.0 m80 -75.37 120.16 20.45 Favored 'General case' 0 CA--C 1.537 0.473 0 CA-C-O 121.046 0.451 . . . . 55.11 111.155 179.092 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 8' ' ' HIS . . . . . . . . . . . . . 49.6 m80 -79.87 116.1 19.83 Favored 'General case' 0 CA--C 1.538 0.509 0 CA-C-N 116.224 -0.444 . . . . 71.22 112.073 -176.489 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 32.5 t -160.68 148.5 16.02 Favored 'General case' 0 N--CA 1.469 0.495 0 CA-C-N 116.318 -0.401 . . . . 71.34 110.759 176.162 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 33.2 m80 -82.92 166.68 18.68 Favored 'General case' 0 CA--C 1.538 0.496 0 CA-C-O 121.263 0.554 . . . . 64.31 111.945 -176.048 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 11' ' ' MET . . . . . . . . . . . . . 76.7 mmm -104.53 6.3 34.59 Favored 'General case' 0 CA--C 1.54 0.572 0 CA-C-N 115.671 -0.695 . . . . 74.02 110.77 174.965 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 51.0 m -76.73 -162.01 0.24 Allowed 'General case' 0 CA--C 1.542 0.66 0 CA-C-N 116.027 -0.533 . . . . 74.2 111.921 -178.312 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 13' ' ' THR . . . . . 0.4 ' HA ' ' HD3' ' A' ' 14' ' ' PRO . 70.9 p -57.75 136.39 82.99 Favored Pre-proline 0 N--CA 1.471 0.594 0 N-CA-C 111.946 0.35 . . . . 63.15 111.946 178.984 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 14' ' ' PRO . . . . . 0.4 ' HD3' ' HA ' ' A' ' 13' ' ' THR . 32.0 Cg_exo -59.27 157.1 31.87 Favored 'Trans proline' 0 CA--C 1.54 0.785 0 C-N-CA 122.631 2.221 . . . . 72.31 112.963 177.888 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 72.4 mt -79.69 166.14 22.12 Favored 'General case' 0 CA--C 1.536 0.413 0 CA-C-O 121.02 0.438 . . . . 42.53 111.596 -179.733 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 16' ' ' THR . . . . . . . . . . . . . 9.0 t -121.4 140.6 51.92 Favored 'General case' 0 N--CA 1.471 0.589 0 CA-C-O 121.094 0.473 . . . . 73.54 111.559 179.904 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . -90.18 -179.75 44.04 Favored Glycine 0 CA--C 1.527 0.844 0 C-N-CA 120.992 -0.623 . . . . 34.45 113.53 -179.881 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 57.0 mtmt -113.31 146.28 34.98 Favored Pre-proline 0 CA--C 1.543 0.678 0 O-C-N 122.581 -0.364 . . . . 72.53 111.317 178.995 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 63.7 Cg_endo -72.4 155.13 55.81 Favored 'Trans proline' 0 CA--C 1.543 0.928 0 C-N-CA 122.652 2.235 . . . . 71.3 113.136 179.861 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . -77.03 65.46 2.97 Favored Glycine 0 CA--C 1.527 0.839 0 CA-C-N 116.217 -0.447 . . . . 23.22 113.097 179.759 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -166.02 -172.31 2.27 Favored 'General case' 0 N--CA 1.468 0.429 0 C-N-CA 122.785 0.434 . . . . 72.23 110.513 -178.747 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 22' ' ' LEU . . . . . 0.542 ' HG ' ' HG3' ' A' ' 60' ' ' GLN . 97.2 mt -60.47 135.74 91.82 Favored Pre-proline 0 CA--C 1.539 0.527 0 N-CA-C 111.83 0.308 . . . . 73.33 111.83 178.25 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 23' ' ' PRO . . . . . 0.449 ' O ' ' HG ' ' A' ' 26' ' ' LEU . 39.8 Cg_endo -67.82 120.7 7.71 Favored 'Trans proline' 0 CA--C 1.539 0.735 0 C-N-CA 122.186 1.924 . . . . 71.42 111.715 174.409 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -57.06 -11.95 1.84 Allowed 'General case' 0 N--CA 1.475 0.798 0 N-CA-C 112.861 0.689 . . . . 52.3 112.861 -177.201 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 25' ' ' ASN . . . . . 0.544 ' HB3' ' HB2' ' A' ' 28' ' ' ASP . 18.8 m120 -92.38 33.76 1.08 Allowed 'General case' 0 CA--C 1.542 0.651 0 N-CA-C 112.265 0.468 . . . . 72.43 112.265 179.408 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 26' ' ' LEU . . . . . 0.449 ' HG ' ' O ' ' A' ' 23' ' ' PRO . 95.6 mt -54.23 -33.16 57.73 Favored 'General case' 0 N--CA 1.474 0.762 0 CA-C-O 120.785 0.326 . . . . 72.34 111.859 -179.671 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 11.3 m-20 -69.15 -38.94 79.04 Favored 'General case' 0 N--CA 1.47 0.548 0 CA-C-O 120.826 0.346 . . . . 73.53 111.554 175.159 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 28' ' ' ASP . . . . . 0.544 ' HB2' ' HB3' ' A' ' 25' ' ' ASN . 6.3 m-20 -69.64 -32.61 71.38 Favored 'General case' 0 CA--C 1.539 0.549 0 CA-C-N 116.285 -0.416 . . . . 55.01 111.319 179.057 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 29' ' ' MET . . . . . . . . . . . . . 84.2 mtp -66.32 140.33 58.1 Favored 'General case' 0 N--CA 1.468 0.426 0 CA-C-O 121.001 0.429 . . . . 74.53 111.307 178.82 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 55.1 mtmt -79.1 158.94 27.7 Favored 'General case' 0 CA--C 1.541 0.605 0 CA-C-O 120.945 0.403 . . . . 72.33 111.899 -177.892 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 94.9 t -49.58 -49.26 19.45 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.7 0 N-CA-C 112.842 0.682 . . . . 51.34 112.842 -176.097 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -57.92 -37.69 74.53 Favored 'General case' 0 N--CA 1.469 0.524 0 CA-C-O 120.855 0.359 . . . . 70.24 111.591 179.657 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 40.6 mt-10 -65.84 -48.55 71.26 Favored 'General case' 0 N--CA 1.466 0.338 0 CA-C-N 116.214 -0.448 . . . . 73.54 111.172 178.347 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 91.5 mt -58.55 -45.37 89.07 Favored 'General case' 0 N--CA 1.469 0.477 0 CA-C-O 120.965 0.412 . . . . 74.24 111.293 178.25 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 35' ' ' LYS . . . . . 0.499 ' HA ' HD12 ' A' ' 38' ' ' LEU . 98.0 mttt -62.83 -31.28 72.25 Favored 'General case' 0 CA--C 1.54 0.592 0 CA-C-O 121.003 0.43 . . . . 74.34 111.565 177.159 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 36' ' ' GLN . . . . . 0.407 ' O ' ' HG ' ' A' ' 40' ' ' LEU . 23.7 tm0? -70.05 -43.91 70.24 Favored 'General case' 0 CA--C 1.542 0.656 0 CA-C-O 121.06 0.457 . . . . 54.45 109.85 175.192 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 37' ' ' GLU . . . . . 0.474 ' HB3' ' NH2' ' A' ' 41' ' ' ARG . 52.8 mm-40 -58.15 -32.66 68.39 Favored 'General case' 0 N--CA 1.473 0.682 0 CA-C-N 115.945 -0.571 . . . . 63.42 111.86 174.436 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 38' ' ' LEU . . . . . 0.499 HD12 ' HA ' ' A' ' 35' ' ' LYS . 99.1 mt -69.45 -58.23 4.25 Favored 'General case' 0 CA--C 1.539 0.547 0 CA-C-N 116.289 -0.414 . . . . 53.1 111.913 178.116 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 39' ' ' LYS . . . . . 0.4 ' HB3' ' NZ ' ' A' ' 39' ' ' LYS . 0.3 OUTLIER -57.83 -31.62 66.82 Favored 'General case' 0 N--CA 1.474 0.741 0 N-CA-C 112.373 0.508 . . . . 75.41 112.373 -174.059 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 40' ' ' LEU . . . . . 0.407 ' HG ' ' O ' ' A' ' 36' ' ' GLN . 95.9 mt -58.96 -35.2 72.76 Favored 'General case' 0 N--CA 1.474 0.74 0 CA-C-O 121.18 0.514 . . . . 74.04 111.764 176.908 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 41' ' ' ARG . . . . . 0.508 ' HB3' ' CE2' ' A' ' 59' ' ' TYR . 16.5 mtm180 -114.21 34.25 4.79 Favored 'General case' 0 CA--C 1.54 0.573 0 CA-C-N 116.034 -0.53 . . . . 74.32 112.366 -173.505 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 32.4 t 69.05 10.17 7.77 Favored 'General case' 0 N--CA 1.479 0.99 0 N-CA-C 113.048 0.759 . . . . 72.24 113.048 172.482 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 43' ' ' LEU . . . . . 0.428 HD22 ' HG2' ' A' ' 55' ' ' ARG . 83.4 mt -88.8 142.0 30.28 Favored Pre-proline 0 CA--C 1.543 0.676 0 N-CA-C 112.126 0.417 . . . . 32.54 112.126 -177.562 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 44' ' ' PRO . . . . . 0.49 ' HG2' HH11 ' A' ' 55' ' ' ARG . 75.6 Cg_endo -76.05 143.38 25.81 Favored 'Trans proline' 0 CA--C 1.544 0.988 0 C-N-CA 123.036 2.491 . . . . 53.2 113.362 178.754 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 25.8 m -97.57 -0.05 10.47 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.711 0 N-CA-C 112.716 0.636 . . . . 53.53 112.716 -176.006 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 19.7 p -79.83 45.89 0.74 Allowed 'General case' 0 N--CA 1.475 0.806 0 N-CA-C 112.866 0.691 . . . . 64.41 112.866 -176.258 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . -131.54 173.77 20.35 Favored Glycine 0 CA--C 1.531 1.032 0 C-N-CA 121.079 -0.582 . . . . 63.42 113.6 179.607 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 48' ' ' THR . . . . . 0.59 ' O ' ' HG ' ' A' ' 52' ' ' LEU . 68.7 p -81.43 173.45 12.42 Favored 'General case' 0 N--CA 1.473 0.7 0 C-N-CA 122.487 0.315 . . . . 74.03 111.287 177.548 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 24.3 tptm -50.17 -50.38 49.35 Favored 'General case' 0 N--CA 1.473 0.709 0 CA-C-O 120.829 0.347 . . . . 75.5 111.599 -179.871 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 50' ' ' THR . . . . . . . . . . . . . 86.5 m -62.84 -39.93 95.88 Favored 'General case' 0 N--CA 1.47 0.542 0 CA-C-N 116.351 -0.386 . . . . 34.35 111.368 177.365 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 61.4 mm-40 -61.06 -42.2 98.05 Favored 'General case' 0 N--CA 1.469 0.501 0 N-CA-C 111.892 0.33 . . . . 71.34 111.892 178.423 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 52' ' ' LEU . . . . . 0.59 ' HG ' ' O ' ' A' ' 48' ' ' THR . 31.4 mt -58.16 -49.84 75.62 Favored 'General case' 0 CA--C 1.538 0.519 0 CA-C-O 121.323 0.582 . . . . 51.15 110.294 177.999 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 53' ' ' ILE . . . . . 0.466 ' O ' ' HG3' ' A' ' 57' ' ' ARG . 72.5 mt -63.4 -55.71 21.42 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.666 0 CA-C-N 115.623 -0.717 . . . . 64.34 111.944 179.704 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 15.3 mm-40 -59.39 -42.36 91.55 Favored 'General case' 0 N--CA 1.472 0.663 0 N-CA-C 112.233 0.457 . . . . 72.22 112.233 -177.96 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 55' ' ' ARG . . . . . 0.49 HH11 ' HG2' ' A' ' 44' ' ' PRO . 10.5 ttm180 -66.11 -35.23 79.95 Favored 'General case' 0 CA--C 1.539 0.553 0 CA-C-O 120.892 0.377 . . . . 65.12 110.792 -178.743 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 45.8 mt -63.04 -51.48 66.57 Favored 'General case' 0 N--CA 1.469 0.507 0 CA-C-N 116.355 -0.384 . . . . 75.42 111.254 172.696 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 57' ' ' ARG . . . . . 0.466 ' HG3' ' O ' ' A' ' 53' ' ' ILE . 29.3 mtp-105 -58.53 -51.66 68.96 Favored 'General case' 0 N--CA 1.47 0.549 0 CA-C-N 116.424 -0.353 . . . . 74.24 111.647 -177.041 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -57.8 -53.21 60.78 Favored 'General case' 0 CA--C 1.539 0.553 0 CA-C-N 116.297 -0.411 . . . . 71.34 111.893 -179.702 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 59' ' ' TYR . . . . . 0.508 ' CE2' ' HB3' ' A' ' 41' ' ' ARG . 72.1 t80 -57.59 -58.68 7.26 Favored 'General case' 0 N--CA 1.471 0.58 0 CA-C-O 121.041 0.448 . . . . 73.22 111.778 179.772 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 60' ' ' GLN . . . . . 0.542 ' HG3' ' HG ' ' A' ' 22' ' ' LEU . 0.6 OUTLIER -56.69 -31.38 64.41 Favored 'General case' 0 CA--C 1.546 0.819 0 CA-C-N 116.147 -0.478 . . . . 74.34 111.349 -175.278 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 61' ' ' ASP . . . . . . . . . . . . . 17.8 t70 -79.35 -45.77 18.95 Favored 'General case' 0 CA--C 1.542 0.657 0 CA-C-O 120.862 0.363 . . . . 45.22 111.884 -179.865 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 62' ' ' GLN . . . . . . . . . . . . . 3.4 pt20 -70.53 -32.03 69.32 Favored 'General case' 0 CA--C 1.542 0.655 0 N-CA-C 112.455 0.539 . . . . 70.41 112.455 -174.654 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 63' ' ' ILE . . . . . 0.461 ' O ' ' HB1' ' A' ' 74' ' ' ALA . 34.8 pt -65.37 -17.98 23.02 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.725 0 N-CA-C 111.942 0.349 . . . . 75.14 111.942 -179.691 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 34.4 t 73.3 85.43 0.11 Allowed Pre-proline 0 N--CA 1.474 0.749 0 C-N-CA 123.119 0.568 . . . . 74.5 111.374 -178.26 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 65' ' ' PRO . . . . . . . . . . . . . 93.7 Cg_endo -80.35 -175.83 2.89 Favored 'Trans proline' 0 CA--C 1.539 0.758 0 C-N-CA 122.948 2.432 . . . . 72.13 113.824 -177.042 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 66' ' ' VAL . . . . . 0.401 HG12 ' H ' ' A' ' 71' ' ' LYS . 19.5 m -90.68 122.04 67.49 Favored Pre-proline 0 CA--C 1.542 0.656 0 CA-C-N 115.988 -0.551 . . . . 64.21 111.639 177.815 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 67' ' ' PRO . . . . . . . . . . . . . 8.6 Cg_exo -72.49 65.0 3.74 Favored 'Trans proline' 0 CA--C 1.541 0.837 0 C-N-CA 122.547 2.165 . . . . 64.12 111.864 177.174 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 80.25 -57.19 4.66 Favored Glycine 0 CA--C 1.527 0.799 0 C-N-CA 121.368 -0.444 . . . . 50.4 112.604 -176.215 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . -87.43 149.3 46.43 Favored Pre-proline 0 CA--C 1.541 0.608 0 C-N-CA 122.264 0.226 . . . . 62.11 111.344 177.742 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 70' ' ' PRO . . . . . . . . . . . . . 35.4 Cg_endo -63.85 87.42 0.14 Allowed 'Trans proline' 0 CA--C 1.543 0.932 0 C-N-CA 122.382 2.054 . . . . 65.14 112.843 -179.5 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 71' ' ' LYS . . . . . 0.401 ' H ' HG12 ' A' ' 66' ' ' VAL . 39.5 ttpt -63.55 -59.57 4.46 Favored 'General case' 0 CA--C 1.539 0.553 0 CA-C-N 116.139 -0.482 . . . . 54.43 111.921 -179.443 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -179.66 146.16 0.44 Allowed Pre-proline 0 N--CA 1.471 0.602 0 CA-C-N 116.267 -0.424 . . . . 71.24 110.891 -178.352 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 73' ' ' PRO . . . . . . . . . . . . . 26.2 Cg_endo -61.8 106.81 0.47 Allowed 'Trans proline' 0 CA--C 1.54 0.81 0 C-N-CA 122.376 2.051 . . . . 72.12 111.964 176.335 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 74' ' ' ALA . . . . . 0.461 ' HB1' ' O ' ' A' ' 63' ' ' ILE . . . -94.38 -179.68 5.0 Favored 'General case' 0 N--CA 1.469 0.514 0 N-CA-C 112.796 0.665 . . . . 52.01 112.796 -173.939 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.254 1.303 0 CA-C-O 118.004 -0.998 . . . . 64.11 111.816 -177.416 . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 65.3 mtm . . . . . 0 N--CA 1.49 1.575 0 CA-C-O 120.531 0.205 . . . . 64.3 111.264 . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . -50.18 112.69 1.6 Allowed Glycine 0 CA--C 1.534 1.229 0 N-CA-C 115.286 0.875 . . . . 21.0 115.286 -176.268 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 3' ' ' HIS . . . . . . . . . . . . . 41.3 p-80 -137.42 37.06 2.48 Favored 'General case' 0 N--CA 1.471 0.575 0 CA-C-O 121.732 0.777 . . . . 63.11 109.278 172.252 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 4' ' ' HIS . . . . . . . . . . . . . 49.0 t-80 -84.31 29.53 0.58 Allowed 'General case' 0 CA--C 1.55 0.965 0 CA-C-N 114.817 -1.083 . . . . 62.24 112.538 -167.982 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 5' ' ' HIS . . . . . . . . . . . . . 41.4 p-80 -65.96 140.63 58.33 Favored 'General case' 0 CA--C 1.545 0.767 0 CA-C-O 120.917 0.389 . . . . 75.2 112.047 -176.615 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 71.9 m80 -132.92 167.65 19.86 Favored 'General case' 0 N--CA 1.471 0.603 0 CA-C-O 121.293 0.568 . . . . 74.23 112.067 177.95 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 55.7 t-80 -165.35 131.15 2.64 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 115.468 -0.787 . . . . 74.44 109.973 174.388 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 8' ' ' HIS . . . . . . . . . . . . . 41.0 p-80 -154.57 179.17 9.3 Favored 'General case' 0 CA--C 1.537 0.452 0 CA-C-O 120.582 0.229 . . . . 74.41 111.313 -178.853 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 86.8 p -71.5 -175.97 1.43 Allowed 'General case' 0 N--CA 1.472 0.663 0 CA-C-O 120.884 0.373 . . . . 75.03 111.203 179.038 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 51.1 m80 -114.46 -67.17 1.02 Allowed 'General case' 0 N--CA 1.469 0.503 0 N-CA-C 112.497 0.555 . . . . 71.11 112.497 -178.29 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 11' ' ' MET . . . . . . . . . . . . . 48.4 ttm -151.09 132.9 15.01 Favored 'General case' 0 CA--C 1.535 0.386 0 CA-C-O 121.05 0.452 . . . . 54.43 112.123 -172.75 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 48.7 m -87.39 97.1 10.62 Favored 'General case' 0 CA--C 1.535 0.369 0 N-CA-C 109.982 -0.377 . . . . 72.01 109.982 174.386 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 13' ' ' THR . . . . . . . . . . . . . 81.5 p -60.36 125.62 82.32 Favored Pre-proline 0 N--CA 1.472 0.659 0 N-CA-C 112.859 0.688 . . . . 71.21 112.859 -173.447 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 14' ' ' PRO . . . . . . . . . . . . . 22.6 Cg_exo -64.64 85.53 0.17 Allowed 'Trans proline' 0 CA--C 1.541 0.826 0 C-N-CA 122.548 2.165 . . . . 75.35 111.461 172.615 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 15' ' ' LEU . . . . . 0.463 ' O ' HD12 ' A' ' 15' ' ' LEU . 3.7 pp -61.29 147.65 43.86 Favored 'General case' 0 N--CA 1.47 0.556 0 N-CA-C 113.069 0.766 . . . . 74.3 113.069 -174.22 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 16' ' ' THR . . . . . . . . . . . . . 8.8 t -134.39 164.38 27.56 Favored 'General case' 0 N--CA 1.47 0.568 0 CA-C-N 115.91 -0.587 . . . . 75.23 111.2 175.728 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . 138.69 -164.32 25.74 Favored Glycine 0 CA--C 1.529 0.917 0 C-N-CA 121.199 -0.524 . . . . 75.14 113.072 -178.143 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 13.7 ptmm? -145.2 146.41 30.37 Favored Pre-proline 0 CA--C 1.541 0.607 0 O-C-N 122.507 -0.408 . . . . 64.31 111.687 -179.808 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 90.5 Cg_endo -82.7 -157.54 0.08 OUTLIER 'Trans proline' 0 CA--C 1.541 0.827 0 C-N-CA 122.463 2.109 . . . . 43.51 112.525 172.944 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . 157.4 -104.45 0.25 Allowed Glycine 0 CA--C 1.523 0.539 0 C-N-CA 121.119 -0.563 . . . . 71.44 112.562 177.745 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . 179.85 -170.67 0.15 Allowed 'General case' 0 N--CA 1.472 0.669 0 CA-C-O 121.031 0.443 . . . . 71.55 111.636 -176.324 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 92.9 mt -105.4 160.21 26.83 Favored Pre-proline 0 CA--C 1.544 0.75 0 C-N-CA 122.793 0.437 . . . . 72.33 110.441 175.833 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 23' ' ' PRO . . . . . . . . . . . . . 35.9 Cg_endo -65.99 131.87 28.42 Favored 'Trans proline' 0 CA--C 1.544 0.978 0 C-N-CA 122.042 1.828 . . . . 71.1 112.283 174.859 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -68.08 -27.94 66.93 Favored 'General case' 0 N--CA 1.472 0.643 0 N-CA-C 112.266 0.469 . . . . 73.3 112.266 -177.02 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 19.6 m120 -87.18 52.41 2.5 Favored 'General case' 0 CA--C 1.539 0.543 0 CA-C-O 121.058 0.456 . . . . 63.42 112.056 -179.799 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 26' ' ' LEU . . . . . 0.456 ' HB2' HG23 ' A' ' 53' ' ' ILE . 87.5 mt -60.75 -27.71 68.15 Favored 'General case' 0 N--CA 1.469 0.518 0 CA-C-O 121.251 0.548 . . . . 62.24 110.662 173.835 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 7.6 p-10 -67.82 -28.91 67.98 Favored 'General case' 0 CA--C 1.54 0.579 0 CA-C-N 115.836 -0.62 . . . . 74.21 111.63 176.69 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 26.0 t70 -76.7 -39.71 51.12 Favored 'General case' 0 CA--C 1.54 0.578 0 CA-C-N 116.463 -0.335 . . . . 74.43 111.776 -178.963 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 29' ' ' MET . . . . . . . . . . . . . 58.6 mtm -68.56 157.62 35.65 Favored 'General case' 0 N--CA 1.471 0.614 0 CA-C-O 121.549 0.69 . . . . 65.55 112.366 -177.398 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 30' ' ' LYS . . . . . 0.44 ' HB2' ' HG2' ' A' ' 33' ' ' GLU . 50.5 mtmt -69.92 156.58 38.88 Favored 'General case' 0 CA--C 1.539 0.524 0 CA-C-N 115.535 -0.757 . . . . 75.51 112.138 -179.289 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 42.2 t -54.51 -42.71 60.79 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.561 0 CA-C-N 116.12 -0.491 . . . . 70.04 111.273 178.039 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -60.87 -33.74 73.54 Favored 'General case' 0 CA--C 1.54 0.57 0 CA-C-N 116.061 -0.518 . . . . 62.45 111.778 177.913 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 33' ' ' GLU . . . . . 0.44 ' HG2' ' HB2' ' A' ' 30' ' ' LYS . 36.9 mm-40 -67.37 -45.01 77.54 Favored 'General case' 0 N--CA 1.468 0.441 0 CA-C-O 121.122 0.487 . . . . 73.34 110.662 177.185 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 63.4 mt -58.75 -48.3 81.66 Favored 'General case' 0 CA--C 1.537 0.459 0 CA-C-N 115.954 -0.566 . . . . 75.33 110.973 177.481 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 35' ' ' LYS . . . . . 0.418 ' HA ' HD12 ' A' ' 38' ' ' LEU . 98.7 mttt -63.1 -29.6 70.94 Favored 'General case' 0 CA--C 1.54 0.564 0 CA-C-N 116.182 -0.463 . . . . 65.21 111.603 176.964 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 36' ' ' GLN . . . . . 0.553 ' HA ' ' HE3' ' A' ' 39' ' ' LYS . 56.8 tp60 -65.5 -49.72 67.95 Favored 'General case' 0 CA--C 1.537 0.474 0 CA-C-O 121.011 0.434 . . . . 73.34 110.654 174.701 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 7.8 mm-40 -63.45 -21.84 66.53 Favored 'General case' 0 CA--C 1.545 0.759 0 CA-C-O 121.128 0.49 . . . . 75.43 111.621 178.794 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 38' ' ' LEU . . . . . 0.46 ' CD1' HD22 ' A' ' 52' ' ' LEU . 94.8 mt -75.65 -56.24 4.88 Favored 'General case' 0 CA--C 1.539 0.531 0 CA-C-N 116.445 -0.343 . . . . 75.34 111.583 174.736 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 39' ' ' LYS . . . . . 0.553 ' HE3' ' HA ' ' A' ' 36' ' ' GLN . 17.0 ptpt -57.64 -35.96 71.21 Favored 'General case' 0 CA--C 1.543 0.682 0 CA-C-O 120.7 0.286 . . . . 74.32 111.682 -176.727 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 40' ' ' LEU . . . . . 0.469 ' HG ' ' O ' ' A' ' 36' ' ' GLN . 88.3 mt -66.32 -23.56 66.39 Favored 'General case' 0 N--CA 1.472 0.673 0 N-CA-C 111.855 0.317 . . . . 75.4 111.855 -179.793 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 41' ' ' ARG . . . . . 0.784 HH22 ' HA ' ' A' ' 56' ' ' LEU . 52.5 mtm180 -114.07 15.41 18.35 Favored 'General case' 0 CA--C 1.541 0.629 0 N-CA-C 111.987 0.366 . . . . 72.33 111.987 -176.612 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 33.3 t 63.23 73.68 0.45 Allowed 'General case' 0 N--CA 1.477 0.892 0 CA-C-O 121.146 0.498 . . . . 74.12 111.896 -179.056 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 43' ' ' LEU . . . . . 0.425 HD21 ' CD2' ' A' ' 59' ' ' TYR . 68.3 mt -144.3 143.74 23.21 Favored Pre-proline 0 N--CA 1.47 0.557 0 CA-C-N 116.183 -0.462 . . . . 63.14 111.616 -177.773 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 44' ' ' PRO . . . . . . . . . . . . . 56.7 Cg_endo -69.54 127.62 15.03 Favored 'Trans proline' 0 CA--C 1.543 0.933 0 C-N-CA 122.704 2.269 . . . . 74.03 113.09 178.868 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 33.6 m -96.91 23.05 0.94 Allowed 'Isoleucine or valine' 0 CA--C 1.544 0.736 0 CA-C-O 120.978 0.418 . . . . 64.11 112.068 -177.226 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 54.0 m -84.73 -8.33 58.88 Favored 'General case' 0 N--CA 1.477 0.917 0 N-CA-C 113.206 0.817 . . . . 53.21 113.206 -175.023 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . -87.3 170.74 41.3 Favored Glycine 0 CA--C 1.531 1.046 0 C-N-CA 120.928 -0.653 . . . . 73.34 113.824 -176.485 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 48' ' ' THR . . . . . 0.606 ' O ' ' HG ' ' A' ' 52' ' ' LEU . 63.1 p -77.31 167.69 21.29 Favored 'General case' 0 N--CA 1.477 0.91 0 O-C-N 122.637 -0.331 . . . . 64.12 111.359 177.511 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 65.0 tttm -48.37 -48.34 36.75 Favored 'General case' 0 N--CA 1.476 0.825 0 N-CA-C 112.357 0.503 . . . . 72.53 112.357 -176.364 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 50' ' ' THR . . . . . . . . . . . . . 87.3 m -64.55 -39.75 94.32 Favored 'General case' 0 N--CA 1.474 0.743 0 CA-C-O 120.949 0.404 . . . . 64.24 111.904 178.748 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 43.5 mt-10 -64.88 -40.71 95.54 Favored 'General case' 0 N--CA 1.472 0.634 0 CA-C-O 120.86 0.362 . . . . 71.12 111.331 177.933 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 52' ' ' LEU . . . . . 0.606 ' HG ' ' O ' ' A' ' 48' ' ' THR . 47.7 mt -58.34 -50.99 71.67 Favored 'General case' 0 CA--C 1.535 0.398 0 CA-C-O 121.082 0.468 . . . . 73.04 110.024 176.754 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 53' ' ' ILE . . . . . 0.456 HG23 ' HB2' ' A' ' 26' ' ' LEU . 85.2 mt -53.26 -54.73 16.19 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.577 0 CA-C-N 115.742 -0.663 . . . . 63.42 111.732 177.036 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -58.57 -38.43 77.87 Favored 'General case' 0 CA--C 1.537 0.443 0 CA-C-N 116.386 -0.37 . . . . 64.44 111.859 -178.974 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 55' ' ' ARG . . . . . 0.425 HH11 ' HD2' ' A' ' 55' ' ' ARG . 15.9 ttt180 -76.89 -25.1 52.64 Favored 'General case' 0 CA--C 1.541 0.613 0 O-C-N 122.112 -0.367 . . . . 52.44 111.257 -179.792 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 56' ' ' LEU . . . . . 0.784 ' HA ' HH22 ' A' ' 41' ' ' ARG . 85.2 mt -62.82 -49.34 75.31 Favored 'General case' 0 C--O 1.236 0.362 0 CA-C-O 121.126 0.489 . . . . 72.32 109.843 170.48 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 58.6 mtp180 -62.91 -47.83 81.59 Favored 'General case' 0 CA--C 1.538 0.518 0 CA-C-N 115.316 -0.856 . . . . 75.21 110.828 177.078 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 58' ' ' ALA . . . . . 0.513 ' O ' ' HG3' ' A' ' 62' ' ' GLN . . . -55.67 -57.43 12.0 Favored 'General case' 0 N--CA 1.469 0.495 0 CA-C-N 116.032 -0.531 . . . . 74.4 112.17 179.821 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 59' ' ' TYR . . . . . 0.425 ' CD2' HD21 ' A' ' 43' ' ' LEU . 54.1 t80 -54.46 -38.87 66.86 Favored 'General case' 0 N--CA 1.473 0.692 0 CA-C-O 120.993 0.425 . . . . 74.01 111.363 179.635 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 60' ' ' GLN . . . . . . . . . . . . . 23.9 tm0? -69.68 -34.75 74.38 Favored 'General case' 0 CA--C 1.538 0.492 0 CA-C-O 121.094 0.473 . . . . 73.3 110.461 177.614 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 61' ' ' ASP . . . . . . . . . . . . . 34.3 t70 -70.5 -33.63 71.44 Favored 'General case' 0 CA--C 1.543 0.692 0 CA-C-N 116.175 -0.466 . . . . 74.02 111.408 178.338 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 62' ' ' GLN . . . . . 0.513 ' HG3' ' O ' ' A' ' 58' ' ' ALA . 84.7 mt-30 -59.79 -41.89 92.15 Favored 'General case' 0 N--CA 1.473 0.724 0 CA-C-O 121.147 0.498 . . . . 72.24 111.345 178.43 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 63' ' ' ILE . . . . . . . . . . . . . 27.0 pt -82.65 -27.08 8.44 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.634 0 CA-C-N 116.306 -0.407 . . . . 31.21 110.665 175.089 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 10.2 t 73.87 142.62 0.09 OUTLIER Pre-proline 0 N--CA 1.477 0.894 0 C-N-CA 123.688 0.795 . . . . 63.43 111.908 178.382 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 65' ' ' PRO . . . . . . . . . . . . . 54.6 Cg_endo -68.7 81.79 0.57 Allowed 'Trans proline' 0 C--N 1.353 0.782 0 C-N-CA 122.348 2.032 . . . . 72.4 112.97 179.518 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 66' ' ' VAL . . . . . . . . . . . . . 29.7 m -132.22 143.62 49.69 Favored Pre-proline 0 CA--C 1.543 0.708 0 CA-C-N 116.063 -0.517 . . . . 71.34 111.597 178.602 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 67' ' ' PRO . . . . . . . . . . . . . 51.7 Cg_exo -55.93 -45.31 39.61 Favored 'Trans proline' 0 CA--C 1.541 0.847 0 C-N-CA 122.589 2.192 . . . . 64.42 112.453 175.413 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . -83.78 58.09 5.03 Favored Glycine 0 CA--C 1.526 0.767 0 C-N-CA 121.196 -0.526 . . . . 62.44 112.398 175.313 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . -59.82 121.84 61.06 Favored Pre-proline 0 CA--C 1.541 0.611 0 CA-C-O 120.687 0.279 . . . . 63.24 111.582 -179.633 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 70' ' ' PRO . . . . . . . . . . . . . 61.0 Cg_endo -71.43 -14.46 30.92 Favored 'Trans proline' 0 CA--C 1.54 0.801 0 C-N-CA 122.7 2.267 . . . . 42.14 113.847 -175.879 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 71' ' ' LYS . . . . . 0.591 ' HD2' ' O ' ' A' ' 72' ' ' ALA . 0.1 OUTLIER -67.64 158.54 31.94 Favored 'General case' 0 CA--C 1.544 0.741 0 CA-C-O 121.012 0.434 . . . . 51.13 111.793 -176.655 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 72' ' ' ALA . . . . . 0.591 ' O ' ' HD2' ' A' ' 71' ' ' LYS . . . -59.65 153.76 49.81 Favored Pre-proline 0 CA--C 1.547 0.851 0 N-CA-C 112.945 0.72 . . . . 65.31 112.945 -176.684 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 73' ' ' PRO . . . . . . . . . . . . . 81.8 Cg_exo -50.17 -15.33 1.29 Allowed 'Trans proline' 0 CA--C 1.543 0.967 0 C-N-CA 123.208 2.605 . . . . 61.31 114.176 179.037 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -51.79 120.5 5.32 Favored 'General case' 0 CA--C 1.539 0.551 0 CA-C-O 121.171 0.51 . . . . 41.21 112.368 178.279 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.252 1.195 0 CA-C-O 118.532 -0.747 . . . . 72.13 110.829 177.785 . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 64.9 mtt . . . . . 0 N--CA 1.49 1.566 0 CA-C-O 121.016 0.436 . . . . 54.02 111.316 . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . 173.65 106.44 0.19 Allowed Glycine 0 CA--C 1.527 0.811 0 C-N-CA 120.974 -0.632 . . . . 70.21 113.06 179.376 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 3' ' ' HIS . . . . . . . . . . . . . 38.1 m80 -87.99 99.35 12.08 Favored 'General case' 0 CA--C 1.538 0.493 0 CA-C-O 120.766 0.317 . . . . 74.13 110.54 178.071 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 4' ' ' HIS . . . . . . . . . . . . . 13.2 t-80 -147.22 124.81 11.74 Favored 'General case' 0 CA--C 1.543 0.694 0 CA-C-O 120.738 0.304 . . . . 74.24 111.598 -173.574 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 5' ' ' HIS . . . . . . . . . . . . . 23.1 t60 -148.08 150.75 34.45 Favored 'General case' 0 CA--C 1.544 0.724 0 C-N-CA 122.744 0.418 . . . . 60.21 110.147 -179.3 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 8.3 p-80 -128.0 157.32 40.95 Favored 'General case' 0 N--CA 1.474 0.752 0 CA-C-O 120.863 0.364 . . . . 72.33 111.81 179.406 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 7.9 p80 -160.52 110.39 1.76 Allowed 'General case' 0 CA--C 1.541 0.631 0 CA-C-O 121.124 0.488 . . . . 75.44 111.701 176.219 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 8' ' ' HIS . . . . . . . . . . . . . 65.4 t60 -126.74 118.29 24.41 Favored 'General case' 0 CA--C 1.538 0.508 0 CA-C-N 116.197 -0.456 . . . . 72.41 111.172 178.814 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 47.5 t -145.72 145.23 30.78 Favored 'General case' 0 N--CA 1.471 0.581 0 CA-C-O 120.78 0.324 . . . . 73.54 111.339 179.181 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 32.8 t-80 -163.36 87.29 0.54 Allowed 'General case' 0 CA--C 1.541 0.602 0 CA-C-O 121.157 0.503 . . . . 55.12 110.757 178.335 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 11' ' ' MET . . . . . . . . . . . . . 26.3 ttt -91.4 139.45 30.71 Favored 'General case' 0 CA--C 1.543 0.675 0 CA-C-N 116.1 -0.5 . . . . 71.41 111.664 -176.702 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 67.0 m -115.72 137.58 51.95 Favored 'General case' 0 N--CA 1.475 0.823 0 CA-C-O 121.026 0.441 . . . . 75.21 111.818 179.736 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 13' ' ' THR . . . . . . . . . . . . . 74.6 p -89.77 157.53 46.25 Favored Pre-proline 0 N--CA 1.473 0.71 0 CA-C-N 116.185 -0.461 . . . . 72.4 111.401 -179.3 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 14' ' ' PRO . . . . . . . . . . . . . 63.3 Cg_exo -53.78 143.98 56.58 Favored 'Trans proline' 0 CA--C 1.543 0.937 0 C-N-CA 122.701 2.267 . . . . 65.21 113.389 177.007 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 86.5 mt -97.0 112.01 23.97 Favored 'General case' 0 CA--C 1.537 0.467 0 CA-C-O 120.912 0.386 . . . . 74.3 111.675 -178.327 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 16' ' ' THR . . . . . . . . . . . . . 9.8 t -90.15 170.83 9.98 Favored 'General case' 0 N--CA 1.472 0.654 0 CA-C-N 116.21 -0.45 . . . . 73.32 111.754 -179.316 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . -89.43 152.8 22.88 Favored Glycine 0 CA--C 1.53 0.976 0 CA-C-N 116.301 -0.409 . . . . 63.53 113.693 -177.256 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -155.31 155.26 29.73 Favored Pre-proline 0 N--CA 1.472 0.627 0 O-C-N 122.559 -0.377 . . . . 71.24 110.969 179.143 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 19' ' ' PRO . . . . . 0.403 ' HD3' ' HB2' ' A' ' 75' ' ' ALA . 26.0 Cg_exo -63.78 179.68 0.96 Allowed 'Trans proline' 0 CA--C 1.54 0.818 0 C-N-CA 122.38 2.053 . . . . 65.13 112.785 175.648 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . -87.31 -79.43 1.24 Allowed Glycine 0 CA--C 1.526 0.741 0 C-N-CA 121.003 -0.618 . . . . 42.13 112.455 178.087 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -174.72 147.53 1.04 Allowed 'General case' 0 N--CA 1.468 0.464 0 C-N-CA 122.649 0.38 . . . . 43.41 111.054 178.261 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 22' ' ' LEU . . . . . 0.452 HD12 ' HB2' ' A' ' 60' ' ' GLN . 79.4 mt -60.02 146.26 82.95 Favored Pre-proline 0 CA--C 1.54 0.576 0 CA-C-O 120.437 0.161 . . . . 62.04 111.086 176.052 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 23' ' ' PRO . . . . . 0.523 ' O ' ' HG ' ' A' ' 26' ' ' LEU . 74.5 Cg_exo -50.92 136.84 44.04 Favored 'Trans proline' 0 CA--C 1.539 0.764 0 C-N-CA 122.925 2.416 . . . . 71.14 113.644 -177.243 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -80.15 -15.12 57.76 Favored 'General case' 0 N--CA 1.467 0.421 0 CA-C-O 120.965 0.412 . . . . 72.14 111.309 177.167 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 25' ' ' ASN . . . . . 0.432 ' HB3' ' HB3' ' A' ' 28' ' ' ASP . 14.9 m120 -92.77 27.07 2.47 Favored 'General case' 0 CA--C 1.542 0.67 0 N-CA-C 112.161 0.43 . . . . 64.02 112.161 -177.807 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 26' ' ' LEU . . . . . 0.523 ' HG ' ' O ' ' A' ' 23' ' ' PRO . 82.8 mt -51.07 -38.26 50.59 Favored 'General case' 0 N--CA 1.476 0.839 0 N-CA-C 112.949 0.722 . . . . 75.45 112.949 -176.873 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 35.2 t70 -75.53 -31.25 60.04 Favored 'General case' 0 CA--C 1.541 0.62 0 O-C-N 122.091 -0.38 . . . . 72.45 111.332 179.077 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 28' ' ' ASP . . . . . 0.432 ' HB3' ' HB3' ' A' ' 25' ' ' ASN . 22.1 t70 -73.14 -23.3 60.45 Favored 'General case' 0 CA--C 1.541 0.627 0 CA-C-O 121.124 0.488 . . . . 61.42 110.254 175.791 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 29' ' ' MET . . . . . 0.401 ' SD ' HD23 ' A' ' 26' ' ' LEU . 76.3 mtp -70.83 160.67 32.33 Favored 'General case' 0 CA--C 1.537 0.479 0 CA-C-O 121.295 0.569 . . . . 73.44 111.559 176.038 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 46.3 mtpt -92.9 157.68 16.23 Favored 'General case' 0 CA--C 1.539 0.531 0 CA-C-N 115.898 -0.592 . . . . 72.22 112.003 -177.926 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 57.3 t -52.13 -47.86 43.17 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.693 0 CA-C-N 115.909 -0.587 . . . . 51.21 112.27 -176.418 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -61.73 -35.96 79.6 Favored 'General case' 0 N--CA 1.471 0.575 0 CA-C-O 120.919 0.39 . . . . 73.41 111.874 179.853 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 41.7 mt-10 -72.01 -35.47 69.43 Favored 'General case' 0 N--CA 1.47 0.546 0 CA-C-N 116.297 -0.41 . . . . 65.14 111.126 -178.895 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 90.6 mt -65.79 -50.45 64.66 Favored 'General case' 0 CA--C 1.537 0.473 0 CA-C-N 116.145 -0.48 . . . . 65.14 110.887 174.501 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 35' ' ' LYS . . . . . 0.401 ' HG2' ' HB ' ' A' ' 45' ' ' VAL . 60.3 mttm -54.99 -41.82 71.7 Favored 'General case' 0 N--CA 1.47 0.544 0 CA-C-O 121.043 0.449 . . . . 74.43 111.299 175.667 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 36' ' ' GLN . . . . . 0.485 ' O ' ' HG ' ' A' ' 40' ' ' LEU . 26.0 tm0? -56.15 -47.81 77.5 Favored 'General case' 0 CA--C 1.539 0.539 0 CA-C-N 115.8 -0.636 . . . . 70.22 111.32 -179.489 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 37' ' ' GLU . . . . . 0.726 ' HB3' ' NH2' ' A' ' 41' ' ' ARG . 42.5 mt-10 -70.79 -39.18 73.29 Favored 'General case' 0 CA--C 1.538 0.518 0 N-CA-C 112.095 0.405 . . . . 63.04 112.095 178.151 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 38' ' ' LEU . . . . . 0.416 ' CD1' HD22 ' A' ' 52' ' ' LEU . 77.5 mt -55.84 -54.3 46.21 Favored 'General case' 0 N--CA 1.467 0.424 0 CA-C-O 120.822 0.344 . . . . 73.03 111.573 176.913 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 18.7 ptmt -63.48 -25.68 68.37 Favored 'General case' 0 CA--C 1.541 0.628 0 N-CA-C 112.225 0.454 . . . . 72.04 112.225 -175.006 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 40' ' ' LEU . . . . . 0.485 ' HG ' ' O ' ' A' ' 36' ' ' GLN . 66.1 mt -72.08 -30.03 64.7 Favored 'General case' 0 N--CA 1.471 0.576 0 CA-C-O 120.805 0.336 . . . . 74.3 111.174 175.388 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 41' ' ' ARG . . . . . 0.726 ' NH2' ' HB3' ' A' ' 37' ' ' GLU . 0.0 OUTLIER -97.52 17.07 18.49 Favored 'General case' 0 N--CA 1.472 0.64 0 CA-C-N 116.412 -0.358 . . . . 62.23 111.258 173.951 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 30.0 t 63.32 16.48 9.52 Favored 'General case' 0 N--CA 1.48 1.057 0 N-CA-C 112.706 0.632 . . . . 73.2 112.706 176.989 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 43' ' ' LEU . . . . . 0.426 ' HA ' ' HD3' ' A' ' 44' ' ' PRO . 58.4 mt -79.65 136.2 55.69 Favored Pre-proline 0 CA--C 1.543 0.674 0 N-CA-C 111.914 0.339 . . . . 74.43 111.914 -178.652 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 44' ' ' PRO . . . . . 0.426 ' HD3' ' HA ' ' A' ' 43' ' ' LEU . 51.6 Cg_exo -56.24 120.81 8.9 Favored 'Trans proline' 0 CA--C 1.542 0.905 0 C-N-CA 122.93 2.42 . . . . 61.53 113.227 178.588 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 45' ' ' VAL . . . . . 0.401 ' HB ' ' HG2' ' A' ' 35' ' ' LYS . 34.0 m -94.87 10.17 4.89 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.733 0 N-CA-C 112.719 0.637 . . . . 55.33 112.719 -176.419 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 37.1 t -73.99 -22.17 59.71 Favored 'General case' 0 N--CA 1.478 0.931 0 N-CA-C 113.063 0.764 . . . . 74.33 113.063 -176.226 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . -68.31 169.04 40.91 Favored Glycine 0 CA--C 1.534 1.25 0 C-N-CA 120.968 -0.634 . . . . 53.15 114.055 -176.944 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 48' ' ' THR . . . . . 0.589 ' O ' ' HG ' ' A' ' 52' ' ' LEU . 64.1 p -74.26 170.32 15.81 Favored 'General case' 0 N--CA 1.475 0.799 0 O-C-N 122.558 -0.378 . . . . 74.12 111.115 177.097 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 49' ' ' LYS . . . . . 0.406 ' O ' HG13 ' A' ' 53' ' ' ILE . 64.0 tttm -48.1 -44.98 32.32 Favored 'General case' 0 N--CA 1.471 0.611 0 N-CA-C 112.056 0.391 . . . . 72.33 112.056 -178.875 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 50' ' ' THR . . . . . . . . . . . . . 94.4 m -64.51 -43.86 92.75 Favored 'General case' 0 N--CA 1.472 0.634 0 CA-C-O 120.877 0.37 . . . . 64.23 111.313 177.565 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 44.8 mt-10 -64.6 -34.72 78.92 Favored 'General case' 0 N--CA 1.469 0.518 0 CA-C-N 116.45 -0.341 . . . . 74.43 111.533 -179.878 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 52' ' ' LEU . . . . . 0.589 ' HG ' ' O ' ' A' ' 48' ' ' THR . 44.5 mt -62.03 -44.51 96.55 Favored 'General case' 0 N--CA 1.471 0.6 0 CA-C-O 121.409 0.624 . . . . 72.25 110.318 176.381 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 53' ' ' ILE . . . . . 0.536 HG22 ' HD3' ' A' ' 57' ' ' ARG . 79.7 mt -60.91 -52.38 62.36 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.576 0 CA-C-N 115.525 -0.762 . . . . 73.2 111.301 176.172 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 11.8 mm-40 -61.45 -30.15 70.41 Favored 'General case' 0 N--CA 1.47 0.54 0 CA-C-N 116.204 -0.453 . . . . 54.41 111.757 178.68 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 55' ' ' ARG . . . . . 0.507 ' HA ' ' HE ' ' A' ' 55' ' ' ARG . 0.8 OUTLIER -67.33 -50.03 61.68 Favored 'General case' 0 CA--C 1.54 0.562 0 CA-C-O 120.865 0.364 . . . . 71.14 110.93 179.5 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 56' ' ' LEU . . . . . 0.62 HD22 HH21 ' A' ' 41' ' ' ARG . 60.7 mt -59.77 -51.34 70.16 Favored 'General case' 0 N--CA 1.472 0.667 0 CA-C-O 121.193 0.52 . . . . 64.34 111.126 175.376 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 57' ' ' ARG . . . . . 0.536 ' HD3' HG22 ' A' ' 53' ' ' ILE . 16.7 mtp85 -56.97 -39.11 74.0 Favored 'General case' 0 CA--C 1.539 0.538 0 CA-C-N 116.022 -0.536 . . . . 74.03 112.132 179.806 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -66.75 -40.03 88.14 Favored 'General case' 0 CA--C 1.54 0.575 0 CA-C-O 120.984 0.421 . . . . 74.33 111.5 176.797 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 59' ' ' TYR . . . . . . . . . . . . . 73.5 t80 -63.43 -38.09 89.8 Favored 'General case' 0 CA--C 1.542 0.657 0 CA-C-N 116.237 -0.438 . . . . 53.12 111.348 178.907 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 60' ' ' GLN . . . . . 0.452 ' HB2' HD12 ' A' ' 22' ' ' LEU . 0.0 OUTLIER -76.61 -45.7 29.12 Favored 'General case' 0 CA--C 1.542 0.669 0 CA-C-O 121.282 0.563 . . . . 54.32 110.536 178.618 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 61' ' ' ASP . . . . . . . . . . . . . 27.3 t70 -53.08 -28.77 26.68 Favored 'General case' 0 CA--C 1.545 0.787 0 N-CA-C 112.833 0.679 . . . . 74.12 112.833 -176.988 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 62' ' ' GLN . . . . . . . . . . . . . 10.1 pt20 -85.89 -23.92 26.84 Favored 'General case' 0 N--CA 1.473 0.699 0 N-CA-C 112.735 0.642 . . . . 50.02 112.735 -178.956 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 63' ' ' ILE . . . . . . . . . . . . . 32.0 pt -100.42 -16.09 7.29 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.777 0 N-CA-C 112.13 0.418 . . . . 75.41 112.13 -178.878 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 64' ' ' SER . . . . . 0.427 ' HA ' ' HD3' ' A' ' 65' ' ' PRO . 32.8 t -66.9 134.63 94.04 Favored Pre-proline 0 CA--C 1.541 0.612 0 N-CA-C 112.229 0.455 . . . . 72.1 112.229 -177.544 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 65' ' ' PRO . . . . . 0.427 ' HD3' ' HA ' ' A' ' 64' ' ' SER . 6.6 Cg_exo -74.13 91.1 0.95 Allowed 'Trans proline' 0 CA--C 1.539 0.748 0 C-N-CA 122.694 2.263 . . . . 72.01 112.529 177.216 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 66' ' ' VAL . . . . . 0.478 ' HB ' ' HD2' ' A' ' 67' ' ' PRO . 33.4 m -73.99 157.19 87.35 Favored Pre-proline 0 CA--C 1.545 0.78 0 CA-C-N 116.636 -0.257 . . . . 65.53 111.346 176.709 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 67' ' ' PRO . . . . . 0.478 ' HD2' ' HB ' ' A' ' 66' ' ' VAL . 37.3 Cg_exo -36.04 -57.91 0.51 Allowed 'Trans proline' 0 C--N 1.359 1.081 0 C-N-CA 123.814 3.009 . . . . 71.35 115.176 -175.695 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . -119.76 63.57 0.46 Allowed Glycine 0 CA--C 1.527 0.814 0 C-N-CA 120.758 -0.734 . . . . 64.23 114.042 -175.422 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . -162.27 147.22 9.85 Favored Pre-proline 0 N--CA 1.47 0.574 0 O-C-N 122.352 -0.499 . . . . 41.35 111.951 176.065 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 70' ' ' PRO . . . . . . . . . . . . . 70.2 Cg_endo -73.3 163.65 37.32 Favored 'Trans proline' 0 CA--C 1.541 0.839 0 C-N-CA 122.498 2.132 . . . . 70.44 112.606 176.793 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 71' ' ' LYS . . . . . 0.507 ' N ' ' HD3' ' A' ' 71' ' ' LYS . 0.0 OUTLIER -152.3 168.66 24.67 Favored 'General case' 0 N--CA 1.47 0.572 0 CA-C-O 121.348 0.595 . . . . 53.13 112.511 -174.928 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -135.33 107.64 10.22 Favored Pre-proline 0 CA--C 1.539 0.54 0 CA-C-N 115.752 -0.658 . . . . 54.15 110.541 175.378 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 73' ' ' PRO . . . . . . . . . . . . . 74.5 Cg_endo -74.44 130.55 14.01 Favored 'Trans proline' 0 CA--C 1.542 0.909 0 C-N-CA 122.522 2.148 . . . . 71.43 113.536 -176.999 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -96.52 97.7 9.62 Favored 'General case' 0 CA--C 1.536 0.438 0 CA-C-N 116.385 -0.371 . . . . 73.52 111.176 177.113 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 75' ' ' ALA . . . . . 0.403 ' HB2' ' HD3' ' A' ' 19' ' ' PRO . . . . . . . . 0 C--O 1.253 1.242 0 CA-C-O 118.727 -0.654 . . . . 74.25 111.613 -178.838 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 49.9 ttp . . . . . 0 N--CA 1.49 1.54 0 CA-C-O 120.607 0.242 . . . . 62.32 111.063 . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . 150.22 66.47 0.01 OUTLIER Glycine 0 CA--C 1.524 0.646 0 C-N-CA 120.962 -0.637 . . . . 73.03 113.245 177.607 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 3' ' ' HIS . . . . . . . . . . . . . 53.8 m80 -65.91 108.22 2.1 Favored 'General case' 0 N--CA 1.468 0.468 0 CA-C-O 120.95 0.405 . . . . 72.33 111.326 178.508 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 4' ' ' HIS . . . . . . . . . . . . . 40.3 m80 -67.55 118.73 11.25 Favored 'General case' 0 CA--C 1.539 0.542 0 CA-C-O 120.968 0.414 . . . . 71.02 111.144 -179.7 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 5' ' ' HIS . . . . . . . . . . . . . 33.1 p80 -75.15 157.01 35.31 Favored 'General case' 0 N--CA 1.473 0.695 0 N-CA-C 113.318 0.859 . . . . 74.44 113.318 -172.771 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 5.0 p-80 -127.04 161.02 29.39 Favored 'General case' 0 N--CA 1.469 0.483 0 CA-C-N 115.133 -0.939 . . . . 75.22 110.046 175.381 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 7.1 p80 -157.14 127.96 6.65 Favored 'General case' 0 CA--C 1.542 0.657 0 CA-C-O 121.258 0.552 . . . . 74.11 112.156 177.632 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 8' ' ' HIS . . . . . . . . . . . . . 15.8 p-80 -78.48 135.58 37.4 Favored 'General case' 0 N--CA 1.47 0.55 0 CA-C-N 115.859 -0.61 . . . . 73.43 111.411 179.045 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 78.5 p -135.88 125.36 25.08 Favored 'General case' 0 N--CA 1.471 0.605 0 CA-C-O 121.017 0.437 . . . . 75.12 111.697 179.595 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 59.1 t-80 -154.21 145.61 23.05 Favored 'General case' 0 CA--C 1.538 0.513 0 CA-C-N 116.285 -0.416 . . . . 63.3 110.785 176.841 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 11' ' ' MET . . . . . . . . . . . . . 58.5 ttp -113.97 146.94 39.41 Favored 'General case' 0 CA--C 1.545 0.753 0 CA-C-O 120.92 0.391 . . . . 74.42 111.982 -176.882 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 47.1 t -135.81 94.79 3.12 Favored 'General case' 0 N--CA 1.475 0.778 0 CA-C-O 121.085 0.469 . . . . 75.21 111.014 175.729 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 13' ' ' THR . . . . . . . . . . . . . 46.8 p -119.34 112.59 35.76 Favored Pre-proline 0 N--CA 1.472 0.633 0 CA-C-N 116.401 -0.363 . . . . 73.3 111.854 -178.834 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 14' ' ' PRO . . . . . . . . . . . . . 63.5 Cg_endo -72.98 123.27 8.77 Favored 'Trans proline' 0 CA--C 1.542 0.904 0 C-N-CA 122.393 2.062 . . . . 64.22 112.419 177.22 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 2.4 pp -85.04 170.5 12.91 Favored 'General case' 0 CA--C 1.539 0.547 0 CA-C-O 121.204 0.526 . . . . 54.11 112.041 -177.553 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 16' ' ' THR . . . . . . . . . . . . . 64.9 p -110.57 162.77 14.39 Favored 'General case' 0 N--CA 1.471 0.594 0 CA-C-O 121.084 0.469 . . . . 53.21 111.86 -179.55 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . 145.62 139.42 3.38 Favored Glycine 0 CA--C 1.526 0.749 0 CA-C-N 116.104 -0.498 . . . . 74.24 112.554 179.74 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 16.8 ptpt -141.83 90.07 8.74 Favored Pre-proline 0 CA--C 1.542 0.648 0 CA-C-O 121.189 0.518 . . . . 74.14 111.887 -178.628 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 87.9 Cg_endo -85.2 123.59 2.69 Favored 'Trans proline' 0 CA--C 1.543 0.929 0 C-N-CA 122.745 2.297 . . . . 75.3 112.686 176.318 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . -75.82 71.53 1.89 Allowed Glycine 0 CA--C 1.525 0.7 0 C-N-CA 120.947 -0.644 . . . . 73.14 112.639 179.335 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -141.17 173.9 11.05 Favored 'General case' 0 CA--C 1.539 0.544 0 CA-C-O 120.995 0.426 . . . . 73.45 112.022 -178.509 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 22' ' ' LEU . . . . . 0.457 ' HG ' ' HG3' ' A' ' 60' ' ' GLN . 91.3 mt -130.24 144.01 51.5 Favored Pre-proline 0 N--CA 1.475 0.786 0 CA-C-N 116.03 -0.532 . . . . 74.34 111.269 177.941 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 23' ' ' PRO . . . . . 0.434 ' HG2' HD23 ' A' ' 26' ' ' LEU . 46.9 Cg_endo -70.32 150.34 64.65 Favored 'Trans proline' 0 CA--C 1.541 0.838 0 C-N-CA 122.191 1.927 . . . . 74.23 111.751 170.714 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -67.17 -39.63 86.5 Favored 'General case' 0 N--CA 1.47 0.556 0 CA-C-O 121.023 0.44 . . . . 74.02 112.02 -177.855 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 25' ' ' ASN . . . . . 0.429 ' HB3' ' HB2' ' A' ' 28' ' ' ASP . 1.9 m-20 -92.57 72.44 5.08 Favored 'General case' 0 CA--C 1.537 0.456 0 CA-C-O 121.107 0.479 . . . . 75.34 111.812 -178.613 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 26' ' ' LEU . . . . . 0.434 HD23 ' HG2' ' A' ' 23' ' ' PRO . 92.9 mt -72.28 -33.49 67.48 Favored 'General case' 0 CA--C 1.536 0.412 0 CA-C-N 116.332 -0.395 . . . . 71.41 111.685 179.029 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 36.3 t70 -72.83 -25.17 61.03 Favored 'General case' 0 CA--C 1.538 0.516 0 O-C-N 122.17 -0.331 . . . . 64.43 111.42 178.611 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 28' ' ' ASP . . . . . 0.429 ' HB2' ' HB3' ' A' ' 25' ' ' ASN . 16.3 m-20 -74.91 -15.36 60.7 Favored 'General case' 0 N--CA 1.469 0.508 0 CA-C-O 120.89 0.376 . . . . 74.02 111.296 175.155 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 29' ' ' MET . . . . . . . . . . . . . 86.1 mtp -81.65 137.8 35.4 Favored 'General case' 0 CA--C 1.536 0.419 0 CA-C-O 121.01 0.433 . . . . 65.21 110.947 175.76 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 30' ' ' LYS . . . . . 0.46 ' HB2' ' HG2' ' A' ' 33' ' ' GLU . 51.3 mtmt -66.85 155.41 38.4 Favored 'General case' 0 CA--C 1.541 0.624 0 CA-C-N 116.302 -0.408 . . . . 74.41 111.357 -179.989 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 90.2 t -54.06 -42.4 54.82 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.713 0 N-CA-C 111.963 0.357 . . . . 73.24 111.963 -177.673 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -63.27 -33.08 74.72 Favored 'General case' 0 CA--C 1.539 0.528 0 CA-C-O 120.791 0.329 . . . . 74.51 111.643 177.68 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 33' ' ' GLU . . . . . 0.46 ' HG2' ' HB2' ' A' ' 30' ' ' LYS . 57.9 mm-40 -70.22 -47.61 60.68 Favored 'General case' 0 N--CA 1.468 0.426 0 CA-C-O 120.919 0.39 . . . . 65.4 110.636 177.462 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 97.7 mt -57.35 -46.08 83.68 Favored 'General case' 0 CA--C 1.539 0.535 0 CA-C-N 116.234 -0.439 . . . . 61.24 111.144 176.228 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 55.2 mtmt -63.98 -32.47 74.01 Favored 'General case' 0 CA--C 1.539 0.538 0 CA-C-N 116.426 -0.352 . . . . 74.23 111.568 177.5 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 51.5 tp60 -65.81 -49.6 67.69 Favored 'General case' 0 CA--C 1.539 0.533 0 CA-C-O 121.008 0.433 . . . . 71.51 110.067 175.495 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 37' ' ' GLU . . . . . 0.639 ' HB3' HH21 ' A' ' 41' ' ' ARG . 42.2 mm-40 -54.75 -31.77 59.0 Favored 'General case' 0 N--CA 1.472 0.637 0 CA-C-N 115.921 -0.581 . . . . 70.12 111.591 175.562 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 38' ' ' LEU . . . . . 0.45 ' CD1' HD22 ' A' ' 52' ' ' LEU . 91.5 mt -72.02 -62.2 1.51 Allowed 'General case' 0 CA--C 1.538 0.488 0 CA-C-N 116.284 -0.416 . . . . 73.41 111.92 176.694 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 20.6 ptmt -58.92 -34.28 71.53 Favored 'General case' 0 CA--C 1.541 0.599 0 N-CA-C 112.622 0.601 . . . . 72.21 112.622 -172.929 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 93.0 mt -64.87 -22.46 67.0 Favored 'General case' 0 N--CA 1.475 0.793 0 CA-C-O 121.193 0.521 . . . . 43.22 111.568 177.743 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 41' ' ' ARG . . . . . 0.639 HH21 ' HB3' ' A' ' 37' ' ' GLU . 15.5 mtm180 -109.72 27.12 9.89 Favored 'General case' 0 CA--C 1.541 0.603 0 CA-C-N 116.136 -0.484 . . . . 75.22 111.604 177.77 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 28.0 t 70.23 5.34 5.27 Favored 'General case' 0 N--CA 1.478 0.97 0 N-CA-C 112.809 0.67 . . . . 74.05 112.809 174.818 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 61.4 mt -82.8 142.38 45.26 Favored Pre-proline 0 CA--C 1.542 0.639 0 CA-C-O 120.723 0.297 . . . . 71.52 111.468 -179.569 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 44' ' ' PRO . . . . . 0.434 ' HG2' ' NH1' ' A' ' 55' ' ' ARG . 59.2 Cg_endo -70.13 143.79 50.14 Favored 'Trans proline' 0 C--N 1.352 0.723 0 C-N-CA 122.476 2.117 . . . . 72.32 112.567 178.411 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 30.2 m -95.09 16.45 1.99 Allowed 'Isoleucine or valine' 0 CA--C 1.54 0.59 0 CA-C-O 121.22 0.533 . . . . 71.31 111.93 -177.063 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 33.0 t -90.53 89.42 7.55 Favored 'General case' 0 N--CA 1.47 0.528 0 CA-C-N 116.247 -0.433 . . . . 72.12 111.455 179.713 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . -172.82 174.88 45.88 Favored Glycine 0 CA--C 1.528 0.867 0 C-N-CA 120.711 -0.757 . . . . 62.12 113.851 178.68 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 48' ' ' THR . . . . . 0.601 ' O ' ' HG ' ' A' ' 52' ' ' LEU . 68.3 p -93.12 170.03 9.95 Favored 'General case' 0 N--CA 1.469 0.516 0 C-N-CA 122.58 0.352 . . . . 72.4 111.019 178.748 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 22.8 tptm -44.47 -54.57 5.84 Favored 'General case' 0 N--CA 1.472 0.656 0 N-CA-C 112.135 0.42 . . . . 72.32 112.135 -179.02 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 50' ' ' THR . . . . . . . . . . . . . 51.4 m -69.96 -40.9 75.14 Favored 'General case' 0 CA--C 1.538 0.482 0 CA-C-N 116.405 -0.361 . . . . 72.43 111.781 -179.59 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 2.9 tm-20 -55.17 -48.82 73.24 Favored 'General case' 0 CA--C 1.542 0.647 0 CA-C-N 116.354 -0.384 . . . . 72.23 111.246 179.298 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 52' ' ' LEU . . . . . 0.601 ' HG ' ' O ' ' A' ' 48' ' ' THR . 54.2 mt -56.47 -46.38 80.44 Favored 'General case' 0 N--CA 1.47 0.556 0 CA-C-O 121.137 0.494 . . . . 73.24 111.059 179.169 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 53' ' ' ILE . . . . . . . . . . . . . 78.9 mt -56.23 -53.12 43.28 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.534 0 CA-C-N 115.948 -0.569 . . . . 75.15 111.634 178.162 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 38.9 mt-10 -68.31 -28.14 66.91 Favored 'General case' 0 CA--C 1.536 0.438 0 CA-C-N 116.243 -0.435 . . . . 72.45 111.816 -178.897 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 55' ' ' ARG . . . . . 0.434 ' NH1' ' HG2' ' A' ' 44' ' ' PRO . 41.9 ttm-85 -68.69 -38.71 80.54 Favored 'General case' 0 CA--C 1.537 0.481 0 CA-C-O 121.122 0.486 . . . . 74.23 110.596 176.752 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 62.4 mt -56.73 -48.39 77.88 Favored 'General case' 0 CA--C 1.538 0.494 0 CA-C-N 116.088 -0.506 . . . . 72.31 111.137 173.482 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 54.1 mtm180 -61.48 -41.96 98.05 Favored 'General case' 0 N--CA 1.469 0.497 0 CA-C-N 116.577 -0.283 . . . . 75.45 111.186 177.78 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -55.25 -41.21 71.85 Favored 'General case' 0 N--CA 1.471 0.584 0 CA-C-O 120.943 0.402 . . . . 61.12 111.682 179.703 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 59' ' ' TYR . . . . . . . . . . . . . 87.0 t80 -69.73 -51.57 33.07 Favored 'General case' 0 CA--C 1.536 0.44 0 CA-C-O 121.092 0.472 . . . . 74.32 110.833 176.207 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 60' ' ' GLN . . . . . 0.457 ' HG3' ' HG ' ' A' ' 22' ' ' LEU . 17.6 mm100 -58.42 -29.29 65.99 Favored 'General case' 0 CA--C 1.539 0.547 0 CA-C-N 116.101 -0.499 . . . . 71.11 112.264 179.484 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 61' ' ' ASP . . . . . . . . . . . . . 19.5 t70 -71.91 -45.27 61.8 Favored 'General case' 0 C--N 1.321 -0.65 0 CA-C-N 116.178 -0.465 . . . . 74.25 111.633 179.094 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 62' ' ' GLN . . . . . . . . . . . . . 11.0 pt20 -80.33 -18.62 48.64 Favored 'General case' 0 CA--C 1.54 0.589 0 N-CA-C 112.706 0.632 . . . . 75.43 112.706 -175.348 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 63' ' ' ILE . . . . . . . . . . . . . 39.5 pt -90.15 -22.34 6.41 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.721 0 O-C-N 121.841 -0.537 . . . . 74.22 112.076 177.012 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 64' ' ' SER . . . . . 0.408 ' HA ' ' HD3' ' A' ' 65' ' ' PRO . 33.0 t -102.19 133.43 20.62 Favored Pre-proline 0 N--CA 1.473 0.688 0 O-C-N 122.298 -0.251 . . . . 75.25 111.388 -178.073 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 65' ' ' PRO . . . . . 0.408 ' HD3' ' HA ' ' A' ' 64' ' ' SER . 51.1 Cg_exo -56.74 122.11 11.23 Favored 'Trans proline' 0 CA--C 1.539 0.737 0 C-N-CA 122.659 2.24 . . . . 74.52 112.819 178.275 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 66' ' ' VAL . . . . . . . . . . . . . 27.6 m -67.79 114.14 18.48 Favored Pre-proline 0 CA--C 1.546 0.789 0 CA-C-O 120.864 0.364 . . . . 75.12 111.501 -179.79 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 67' ' ' PRO . . . . . . . . . . . . . 17.9 Cg_exo -66.84 93.92 0.33 Allowed 'Trans proline' 0 CA--C 1.537 0.639 0 C-N-CA 122.76 2.307 . . . . 72.42 112.767 -177.445 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 76.96 -55.7 3.51 Favored Glycine 0 CA--C 1.531 1.07 0 C-N-CA 121.235 -0.507 . . . . 61.32 113.489 -179.468 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . 70.29 145.33 0.11 Allowed Pre-proline 0 N--CA 1.472 0.653 0 C-N-CA 123.07 0.548 . . . . 71.23 112.09 -179.471 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 70' ' ' PRO . . . . . . . . . . . . . 52.2 Cg_exo -56.78 143.96 88.81 Favored 'Trans proline' 0 CA--C 1.542 0.901 0 C-N-CA 122.708 2.272 . . . . 73.15 113.123 177.653 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 71' ' ' LYS . . . . . 0.503 ' O ' ' HD3' ' A' ' 71' ' ' LYS . 0.1 OUTLIER -78.79 142.71 36.74 Favored 'General case' 0 CA--C 1.539 0.545 0 CA-C-O 121.114 0.483 . . . . 63.53 111.465 179.011 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -93.65 141.96 24.51 Favored Pre-proline 0 CA--C 1.542 0.65 0 CA-C-N 116.151 -0.477 . . . . 61.33 111.65 179.351 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 73' ' ' PRO . . . . . . . . . . . . . 33.9 Cg_exo -58.22 104.13 0.17 Allowed 'Trans proline' 0 CA--C 1.542 0.897 0 C-N-CA 122.609 2.206 . . . . 75.52 112.82 178.201 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -73.91 138.04 44.04 Favored 'General case' 0 CA--C 1.537 0.451 0 CA-C-O 120.941 0.4 . . . . 74.42 111.585 -178.973 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.253 1.275 0 CA-C-O 118.676 -0.678 . . . . 65.14 111.512 177.652 . . . . . . . . 0 0 . 1 . 011 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 21.2 mmt . . . . . 0 N--CA 1.49 1.539 0 N-CA-C 110.533 -0.173 . . . . 55.42 110.533 . . . . . . . . . 0 0 . 1 . 011 nuclear nobuild full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . 145.86 164.99 11.15 Favored Glycine 0 CA--C 1.526 0.748 0 C-N-CA 120.834 -0.698 . . . . 53.34 113.46 179.414 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 3' ' ' HIS . . . . . . . . . . . . . 47.7 m80 -146.85 -178.85 6.41 Favored 'General case' 0 N--CA 1.473 0.71 0 CA-C-O 121.448 0.642 . . . . 72.1 112.461 -178.186 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 4' ' ' HIS . . . . . . . . . . . . . 16.2 p-80 -151.22 121.17 7.11 Favored 'General case' 0 CA--C 1.54 0.587 0 CA-C-N 115.632 -0.713 . . . . 72.03 110.849 -178.85 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 5' ' ' HIS . . . . . . . . . . . . . 53.3 t-80 -144.19 138.62 28.21 Favored 'General case' 0 CA--C 1.54 0.594 0 CA-C-O 121.175 0.512 . . . . 75.44 112.355 -173.855 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 66.9 m80 -115.08 178.55 4.24 Favored 'General case' 0 N--CA 1.47 0.546 0 CA-C-N 115.933 -0.576 . . . . 72.33 110.479 172.612 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 29.1 p80 -126.11 161.67 27.11 Favored 'General case' 0 N--CA 1.472 0.636 0 CA-C-O 120.809 0.338 . . . . 75.11 111.256 178.533 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 8' ' ' HIS . . . . . . . . . . . . . 96.6 m-70 -77.67 167.08 22.16 Favored 'General case' 0 N--CA 1.469 0.487 0 CA-C-O 121.482 0.658 . . . . 64.32 112.602 -177.781 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 57.7 p -91.73 169.74 10.47 Favored 'General case' 0 N--CA 1.469 0.487 0 CA-C-N 115.062 -0.972 . . . . 73.51 110.674 174.355 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 49.0 m80 -106.06 87.79 2.65 Favored 'General case' 0 N--CA 1.469 0.483 0 CA-C-O 121.291 0.567 . . . . 51.11 112.153 -178.436 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 11' ' ' MET . . . . . . . . . . . . . 24.0 mmt -103.0 121.34 42.35 Favored 'General case' 0 CA--C 1.536 0.442 0 CA-C-N 116.033 -0.531 . . . . 74.5 110.956 179.65 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 35.2 t -114.81 176.64 4.96 Favored 'General case' 0 N--CA 1.474 0.764 0 CA-C-O 121.115 0.483 . . . . 74.34 112.083 -176.672 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 13' ' ' THR . . . . . . . . . . . . . 72.1 p -109.86 143.52 28.09 Favored Pre-proline 0 N--CA 1.473 0.689 0 CA-C-N 116.025 -0.534 . . . . 72.24 111.237 178.714 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 14' ' ' PRO . . . . . . . . . . . . . 15.5 Cg_exo -69.91 172.13 13.36 Favored 'Trans proline' 0 CA--C 1.54 0.793 0 C-N-CA 122.657 2.238 . . . . 63.14 112.743 177.33 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 76.4 mt -79.62 147.96 31.86 Favored 'General case' 0 CA--C 1.537 0.474 0 O-C-N 122.251 -0.28 . . . . 75.11 111.292 179.41 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 16' ' ' THR . . . . . . . . . . . . . 7.3 m -52.21 -48.03 65.31 Favored 'General case' 0 N--CA 1.475 0.776 0 N-CA-C 112.045 0.387 . . . . 60.25 112.045 -179.188 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . 173.46 61.65 0.05 OUTLIER Glycine 0 CA--C 1.527 0.837 0 C-N-CA 120.985 -0.626 . . . . 72.01 113.375 177.966 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 14.2 mptt -96.13 133.09 25.6 Favored Pre-proline 0 CA--C 1.544 0.74 0 O-C-N 122.39 -0.477 . . . . 65.32 111.223 178.272 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 71.8 Cg_endo -75.23 117.71 4.96 Favored 'Trans proline' 0 CA--C 1.541 0.831 0 C-N-CA 122.986 2.458 . . . . 73.05 113.264 -178.491 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . -100.47 124.6 8.3 Favored Glycine 0 CA--C 1.528 0.892 0 C-N-CA 121.089 -0.577 . . . . 55.5 113.216 179.52 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -160.67 -178.11 6.64 Favored 'General case' 0 N--CA 1.47 0.549 0 CA-C-O 121.011 0.434 . . . . 61.42 112.056 -179.576 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 98.8 mt -72.87 155.58 90.5 Favored Pre-proline 0 CA--C 1.541 0.632 0 CA-C-N 116.232 -0.44 . . . . 72.23 111.051 177.716 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 23' ' ' PRO . . . . . . . . . . . . . 74.5 Cg_exo -50.81 130.39 30.63 Favored 'Trans proline' 0 CA--C 1.541 0.87 0 C-N-CA 122.538 2.159 . . . . 71.42 112.898 177.266 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 24' ' ' ALA . . . . . 0.405 ' HB1' ' HB2' ' A' ' 75' ' ' ALA . . . -55.33 -43.83 75.32 Favored 'General case' 0 CA--C 1.539 0.523 0 CA-C-O 121.106 0.479 . . . . 44.24 112.132 -178.022 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 14.7 m120 -97.77 67.97 2.03 Favored 'General case' 0 CA--C 1.537 0.455 0 N-CA-C 112.122 0.416 . . . . 62.12 112.122 179.219 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 26' ' ' LEU . . . . . 0.414 ' HB2' HG23 ' A' ' 53' ' ' ILE . 96.5 mt -63.63 -28.58 70.01 Favored 'General case' 0 N--CA 1.47 0.539 0 CA-C-O 121.614 0.721 . . . . 73.34 110.086 170.444 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 8.8 p-10 -64.74 -25.17 67.81 Favored 'General case' 0 CA--C 1.539 0.54 0 CA-C-N 115.346 -0.843 . . . . 72.04 111.835 177.788 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 34.7 t70 -84.23 -6.77 59.44 Favored 'General case' 0 CA--C 1.543 0.698 0 CA-C-O 120.945 0.402 . . . . 73.32 111.65 -179.857 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 29' ' ' MET . . . . . 0.457 ' O ' ' HE3' ' A' ' 49' ' ' LYS . 83.6 mtp -87.66 166.78 14.43 Favored 'General case' 0 CA--C 1.541 0.613 0 CA-C-O 121.062 0.458 . . . . 64.11 111.752 179.875 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 30' ' ' LYS . . . . . 0.573 ' HB2' ' HG2' ' A' ' 33' ' ' GLU . 29.0 mtpp -84.17 153.1 23.87 Favored 'General case' 0 CA--C 1.54 0.585 0 CA-C-N 116.487 -0.324 . . . . 74.1 111.458 179.731 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 65.6 t -53.47 -57.1 5.77 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.772 0 N-CA-C 112.164 0.431 . . . . 71.24 112.164 -178.261 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 32' ' ' ALA . . . . . 0.53 ' HA ' ' HD3' ' A' ' 35' ' ' LYS . . . -58.38 -29.3 65.92 Favored 'General case' 0 N--CA 1.472 0.641 0 N-CA-C 112.214 0.449 . . . . 70.15 112.214 -178.85 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 33' ' ' GLU . . . . . 0.573 ' HG2' ' HB2' ' A' ' 30' ' ' LYS . 13.9 mm-40 -74.41 -38.95 62.94 Favored 'General case' 0 CA--C 1.538 0.519 0 CA-C-O 120.75 0.309 . . . . 74.32 110.938 179.413 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 92.9 mt -63.61 -44.14 94.82 Favored 'General case' 0 N--CA 1.47 0.531 0 CA-C-O 121.271 0.558 . . . . 72.23 110.308 172.925 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 35' ' ' LYS . . . . . 0.53 ' HD3' ' HA ' ' A' ' 32' ' ' ALA . 58.2 mtpt -55.84 -41.26 74.02 Favored 'General case' 0 N--CA 1.468 0.469 0 CA-C-N 115.775 -0.648 . . . . 63.42 111.447 176.658 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 36' ' ' GLN . . . . . 0.414 ' O ' ' HG ' ' A' ' 40' ' ' LEU . 58.3 tp60 -56.69 -52.85 63.34 Favored 'General case' 0 CA--C 1.539 0.531 0 CA-C-O 120.876 0.37 . . . . 55.23 110.775 175.855 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 37' ' ' GLU . . . . . 0.629 ' HB3' ' NH2' ' A' ' 41' ' ' ARG . 25.9 mm-40 -57.91 -36.43 72.43 Favored 'General case' 0 CA--C 1.54 0.594 0 N-CA-C 112.253 0.464 . . . . 71.44 112.253 177.784 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 38' ' ' LEU . . . . . 0.446 ' CD1' HD22 ' A' ' 52' ' ' LEU . 88.0 mt -66.26 -58.33 5.59 Favored 'General case' 0 CA--C 1.539 0.54 0 CA-C-O 120.887 0.375 . . . . 71.41 111.549 177.14 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 20.7 ptmt -61.25 -30.24 70.33 Favored 'General case' 0 CA--C 1.54 0.585 0 N-CA-C 111.99 0.367 . . . . 73.23 111.99 -175.433 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 40' ' ' LEU . . . . . 0.414 ' HG ' ' O ' ' A' ' 36' ' ' GLN . 87.1 mt -68.21 -25.9 65.45 Favored 'General case' 0 CA--C 1.541 0.611 0 O-C-N 122.249 -0.282 . . . . 74.55 111.722 176.851 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 41' ' ' ARG . . . . . 0.678 HH21 HD22 ' A' ' 56' ' ' LEU . 80.8 mtm-85 -110.77 25.5 11.71 Favored 'General case' 0 N--CA 1.472 0.656 0 N-CA-C 112.051 0.389 . . . . 71.24 112.051 179.953 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 31.9 t 63.1 34.15 13.94 Favored 'General case' 0 N--CA 1.479 1.008 0 N-CA-C 112.415 0.524 . . . . 72.24 112.415 174.832 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 64.3 mt -105.16 138.55 19.56 Favored Pre-proline 0 CA--C 1.541 0.625 0 CA-C-N 116.554 -0.293 . . . . 74.15 111.499 179.367 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 44' ' ' PRO . . . . . 0.412 ' HG2' ' NH1' ' A' ' 55' ' ' ARG . 37.2 Cg_endo -66.84 131.64 26.24 Favored 'Trans proline' 0 CA--C 1.544 1.007 0 C-N-CA 122.524 2.149 . . . . 53.22 112.801 178.066 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 34.2 m -102.47 17.22 4.51 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.748 0 N-CA-C 112.356 0.502 . . . . 75.15 112.356 -174.948 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 69.3 m -81.36 13.33 3.0 Favored 'General case' 0 N--CA 1.478 0.942 0 N-CA-C 113.329 0.863 . . . . 61.03 113.329 -175.552 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . -104.45 172.28 20.18 Favored Glycine 0 CA--C 1.529 0.912 0 C-N-CA 120.908 -0.663 . . . . 22.22 113.973 -175.983 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 48' ' ' THR . . . . . 0.575 ' O ' ' HG ' ' A' ' 52' ' ' LEU . 43.4 p -77.0 169.23 18.71 Favored 'General case' 0 N--CA 1.473 0.707 0 O-C-N 122.504 -0.41 . . . . 71.23 110.87 176.785 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 49' ' ' LYS . . . . . 0.512 ' HE2' HD11 ' A' ' 53' ' ' ILE . 23.7 tptm -42.22 -51.15 4.81 Favored 'General case' 0 N--CA 1.475 0.776 0 CA-C-O 120.942 0.401 . . . . 73.43 111.598 176.818 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 50' ' ' THR . . . . . . . . . . . . . 31.1 m -60.88 -47.07 88.08 Favored 'General case' 0 CA--C 1.539 0.548 0 CA-C-N 116.01 -0.541 . . . . 71.35 111.769 -179.919 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 42.4 mt-10 -64.44 -38.13 89.96 Favored 'General case' 0 N--CA 1.472 0.637 0 CA-C-O 120.798 0.332 . . . . 73.41 111.789 -177.018 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 52' ' ' LEU . . . . . 0.575 ' HG ' ' O ' ' A' ' 48' ' ' THR . 43.8 mt -61.24 -44.23 97.59 Favored 'General case' 0 N--CA 1.47 0.542 0 CA-C-O 121.309 0.576 . . . . 72.44 110.458 177.175 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 53' ' ' ILE . . . . . 0.512 HD11 ' HE2' ' A' ' 49' ' ' LYS . 70.0 mt -60.77 -55.82 22.01 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.51 0 CA-C-N 115.643 -0.708 . . . . 75.35 111.149 176.645 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 53.9 mm-40 -54.99 -41.11 70.82 Favored 'General case' 0 CA--C 1.538 0.493 0 CA-C-N 116.161 -0.472 . . . . 73.34 111.74 -179.493 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 55' ' ' ARG . . . . . 0.412 ' NH1' ' HG2' ' A' ' 44' ' ' PRO . 30.9 ttm180 -63.36 -38.12 89.9 Favored 'General case' 0 CA--C 1.541 0.625 0 CA-C-N 116.237 -0.438 . . . . 54.43 111.361 179.643 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 56' ' ' LEU . . . . . 0.678 HD22 HH21 ' A' ' 41' ' ' ARG . 68.6 mt -68.72 -46.81 67.98 Favored 'General case' 0 N--CA 1.472 0.631 0 CA-C-O 120.757 0.313 . . . . 73.41 111.452 174.563 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 57' ' ' ARG . . . . . 0.44 ' HG3' ' O ' ' A' ' 53' ' ' ILE . 69.0 mtp180 -55.79 -46.17 78.03 Favored 'General case' 0 N--CA 1.471 0.593 0 CA-C-O 121.246 0.546 . . . . 54.3 111.073 178.713 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -69.13 -40.97 77.94 Favored 'General case' 0 CA--C 1.536 0.434 0 CA-C-N 116.021 -0.536 . . . . 74.5 112.132 -179.954 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 59' ' ' TYR . . . . . . . . . . . . . 49.6 t80 -63.84 -28.47 69.88 Favored 'General case' 0 N--CA 1.469 0.508 0 CA-C-O 121.051 0.453 . . . . 75.2 110.894 177.695 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 60' ' ' GLN . . . . . . . . . . . . . 17.4 tm0? -78.36 -44.8 24.1 Favored 'General case' 0 CA--C 1.542 0.663 0 CA-C-N 116.196 -0.456 . . . . 75.31 110.355 176.381 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 61' ' ' ASP . . . . . . . . . . . . . 17.1 t70 -55.17 -45.97 75.78 Favored 'General case' 0 CA--C 1.542 0.642 0 N-CA-C 112.36 0.504 . . . . 62.12 112.36 179.359 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 62' ' ' GLN . . . . . . . . . . . . . 9.3 pt20 -65.29 -22.35 66.84 Favored 'General case' 0 CA--C 1.542 0.671 0 N-CA-C 112.588 0.588 . . . . 71.1 112.588 -177.36 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 63' ' ' ILE . . . . . . . . . . . . . 34.9 pt -102.37 -17.1 7.12 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.71 0 N-CA-C 112.0 0.37 . . . . 64.53 112.0 177.535 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 35.4 t 71.19 147.33 0.12 Allowed Pre-proline 0 N--CA 1.483 1.182 0 C-N-CA 123.348 0.659 . . . . 63.52 112.554 177.985 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 65' ' ' PRO . . . . . . . . . . . . . 36.1 Cg_exo -60.3 103.54 0.22 Allowed 'Trans proline' 0 C--N 1.357 0.983 0 C-N-CA 122.353 2.035 . . . . 72.02 112.422 174.186 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 66' ' ' VAL . . . . . . . . . . . . . 26.8 m -96.82 143.67 26.51 Favored Pre-proline 0 CA--C 1.542 0.644 0 N-CA-C 112.25 0.463 . . . . 63.03 112.25 -175.94 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 67' ' ' PRO . . . . . . . . . . . . . 38.2 Cg_endo -66.1 122.04 9.49 Favored 'Trans proline' 0 C--N 1.352 0.745 0 C-N-CA 122.597 2.198 . . . . 71.24 112.329 177.943 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 124.15 -32.64 4.1 Favored Glycine 0 CA--C 1.525 0.718 0 C-N-CA 121.244 -0.503 . . . . 70.42 112.55 -178.538 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 69' ' ' ALA . . . . . 0.456 ' HB1' ' HD2' ' A' ' 70' ' ' PRO . . . -70.58 167.01 30.37 Favored Pre-proline 0 CA--C 1.543 0.683 0 O-C-N 122.665 -0.315 . . . . 65.25 111.108 176.232 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 70' ' ' PRO . . . . . 0.456 ' HD2' ' HB1' ' A' ' 69' ' ' ALA . 86.0 Cg_exo -44.11 118.49 1.67 Allowed 'Trans proline' 0 CA--C 1.544 0.996 0 C-N-CA 122.663 2.242 . . . . 73.41 113.677 177.544 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 58.5 pttt -59.12 107.46 0.55 Allowed 'General case' 0 CA--C 1.545 0.781 0 CA-C-O 121.184 0.516 . . . . 71.31 112.161 -179.002 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -159.26 106.95 1.53 Allowed Pre-proline 0 CA--C 1.537 0.455 0 N-CA-C 112.32 0.489 . . . . 72.1 112.32 -179.565 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 73' ' ' PRO . . . . . . . . . . . . . 73.7 Cg_endo -75.33 167.6 26.37 Favored 'Trans proline' 0 CA--C 1.54 0.8 0 C-N-CA 122.017 1.812 . . . . 74.42 112.201 173.365 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -63.56 157.31 24.04 Favored 'General case' 0 CA--C 1.54 0.574 0 N-CA-C 112.24 0.459 . . . . 53.55 112.24 -178.159 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 75' ' ' ALA . . . . . 0.405 ' HB2' ' HB1' ' A' ' 24' ' ' ALA . . . . . . . . 0 C--O 1.253 1.277 0 CA-C-O 118.887 -0.577 . . . . 72.51 112.339 -178.606 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 25.9 ptt? . . . . . 0 N--CA 1.49 1.55 0 CA-C-O 120.773 0.32 . . . . 62.32 111.291 . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . 72.55 29.22 66.11 Favored Glycine 0 CA--C 1.529 0.948 0 C-N-CA 120.855 -0.688 . . . . 72.03 113.124 -178.806 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 3' ' ' HIS . . . . . . . . . . . . . 32.1 t-80 -86.33 11.55 11.99 Favored 'General case' 0 CA--C 1.545 0.776 0 O-C-N 122.545 -0.385 . . . . 60.22 111.609 -178.125 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 4' ' ' HIS . . . . . . . . . . . . . 28.0 p80 -46.71 140.32 4.62 Favored 'General case' 0 N--CA 1.474 0.75 0 CA-C-O 120.957 0.408 . . . . 72.32 112.099 177.568 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 5' ' ' HIS . . . . . . . . . . . . . 12.1 p80 -149.39 98.09 2.74 Favored 'General case' 0 CA--C 1.539 0.538 0 CA-C-O 121.203 0.525 . . . . 73.3 111.551 179.898 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 10.3 p-80 -160.49 128.93 4.69 Favored 'General case' 0 N--CA 1.469 0.481 0 CA-C-N 116.214 -0.448 . . . . 74.22 110.932 177.869 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 8.1 p80 -173.4 139.39 0.76 Allowed 'General case' 0 N--CA 1.468 0.469 0 CA-C-N 116.541 -0.299 . . . . 61.34 111.219 -179.644 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 8' ' ' HIS . . . . . . . . . . . . . 28.5 t-80 -164.28 112.96 1.15 Allowed 'General case' 0 CA--C 1.538 0.494 0 CA-C-O 120.805 0.336 . . . . 75.33 111.474 178.966 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 66.7 m -94.62 147.11 23.62 Favored 'General case' 0 N--CA 1.471 0.62 0 CA-C-N 116.388 -0.369 . . . . 53.24 111.209 177.736 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 87.5 m-70 -100.12 155.91 17.47 Favored 'General case' 0 N--CA 1.471 0.621 0 CA-C-O 121.078 0.466 . . . . 64.54 111.665 178.809 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 11' ' ' MET . . . . . . . . . . . . . 65.5 mtt -109.85 133.01 53.63 Favored 'General case' 0 N--CA 1.468 0.46 0 CA-C-N 116.235 -0.439 . . . . 54.43 110.741 176.93 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 50.7 m -127.27 132.39 50.36 Favored 'General case' 0 N--CA 1.471 0.611 0 CA-C-O 120.946 0.403 . . . . 74.42 111.169 -178.298 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 13' ' ' THR . . . . . . . . . . . . . 67.8 p -90.38 152.18 45.24 Favored Pre-proline 0 N--CA 1.47 0.53 0 CA-C-O 120.67 0.271 . . . . 62.03 111.455 -179.351 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 14' ' ' PRO . . . . . . . . . . . . . 73.0 Cg_endo -74.01 -166.37 0.31 Allowed 'Trans proline' 0 CA--C 1.542 0.888 0 C-N-CA 122.673 2.249 . . . . 75.33 113.698 -178.956 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 15' ' ' LEU . . . . . 0.444 ' N ' HD23 ' A' ' 15' ' ' LEU . 2.3 pt? -143.27 -173.7 4.0 Favored 'General case' 0 CA--C 1.54 0.558 0 CA-C-N 116.124 -0.489 . . . . 73.41 110.938 -178.924 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 16' ' ' THR . . . . . . . . . . . . . 71.6 p -74.65 -57.97 3.58 Favored 'General case' 0 N--CA 1.474 0.738 0 CA-C-O 120.971 0.415 . . . . 52.22 111.681 179.422 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . 68.84 22.06 75.4 Favored Glycine 0 CA--C 1.525 0.683 0 CA-C-N 116.115 -0.493 . . . . 52.35 112.374 -177.02 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 18' ' ' LYS . . . . . 0.42 ' HA ' ' HD3' ' A' ' 19' ' ' PRO . 9.3 mtpm? -144.52 149.93 45.72 Favored Pre-proline 0 CA--C 1.541 0.628 0 O-C-N 122.619 -0.342 . . . . 71.04 111.917 -175.461 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 19' ' ' PRO . . . . . 0.42 ' HD3' ' HA ' ' A' ' 18' ' ' LYS . 11.3 Cg_exo -72.02 161.2 45.49 Favored 'Trans proline' 0 CA--C 1.54 0.786 0 C-N-CA 123.031 2.488 . . . . 62.42 112.461 173.97 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . -58.32 -46.92 92.3 Favored Glycine 0 CA--C 1.529 0.948 0 C-N-CA 120.887 -0.673 . . . . 53.2 113.212 178.24 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -88.67 -164.61 1.16 Allowed 'General case' 0 CA--C 1.541 0.622 0 CA-C-O 121.02 0.438 . . . . 72.25 111.708 178.85 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 22' ' ' LEU . . . . . 0.519 HD12 ' HB2' ' A' ' 60' ' ' GLN . 88.8 mt -65.73 127.35 93.0 Favored Pre-proline 0 CA--C 1.542 0.655 0 CA-C-N 116.483 -0.326 . . . . 74.3 110.984 177.637 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 23' ' ' PRO . . . . . 0.482 ' HD3' ' HA ' ' A' ' 22' ' ' LEU . 23.3 Cg_exo -62.86 163.1 23.06 Favored 'Trans proline' 0 CA--C 1.539 0.762 0 C-N-CA 123.013 2.475 . . . . 54.34 113.942 -174.554 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -87.27 14.07 8.52 Favored 'General case' 0 N--CA 1.47 0.567 0 CA-C-O 121.269 0.557 . . . . 22.53 111.289 176.293 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 12.0 m120 -104.13 9.27 36.36 Favored 'General case' 0 CA--C 1.536 0.432 0 CA-C-N 116.0 -0.545 . . . . 74.44 111.739 -177.639 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 26' ' ' LEU . . . . . 0.457 HD23 ' SD ' ' A' ' 29' ' ' MET . 63.3 mt -56.39 -27.04 55.1 Favored 'General case' 0 N--CA 1.475 0.812 0 CA-C-O 121.052 0.453 . . . . 53.53 111.849 -174.811 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 5.1 m-20 -61.73 -53.21 59.06 Favored 'General case' 0 CA--C 1.543 0.681 0 CA-C-N 116.07 -0.514 . . . . 60.53 111.158 174.825 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 12.2 m-20 -73.48 -32.55 64.38 Favored 'General case' 0 N--CA 1.471 0.586 0 CA-C-N 116.188 -0.46 . . . . 65.05 111.696 179.484 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 29' ' ' MET . . . . . 0.457 ' SD ' HD23 ' A' ' 26' ' ' LEU . 87.7 mtp -57.13 123.01 13.77 Favored 'General case' 0 N--CA 1.468 0.426 0 CA-C-O 121.049 0.452 . . . . 61.11 110.67 178.461 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 30' ' ' LYS . . . . . 0.451 ' HB2' ' OE1' ' A' ' 33' ' ' GLU . 59.8 mtpt -70.22 167.1 18.62 Favored 'General case' 0 CA--C 1.541 0.624 0 N-CA-C 113.098 0.777 . . . . 75.03 113.098 -170.722 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 46.5 t -50.66 -55.47 6.55 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.681 0 N-CA-C 112.726 0.639 . . . . 64.4 112.726 -174.46 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -60.47 -40.15 90.21 Favored 'General case' 0 N--CA 1.471 0.587 0 CA-C-O 120.979 0.419 . . . . 62.32 111.717 -179.378 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 33' ' ' GLU . . . . . 0.451 ' OE1' ' HB2' ' A' ' 30' ' ' LYS . 0.9 OUTLIER -58.49 -46.19 87.17 Favored 'General case' 0 CA--C 1.541 0.62 0 CA-C-N 115.838 -0.619 . . . . 71.34 111.412 177.113 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 91.6 mt -64.77 -46.43 82.17 Favored 'General case' 0 N--CA 1.471 0.594 0 CA-C-O 121.305 0.574 . . . . 74.43 111.019 176.756 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 35' ' ' LYS . . . . . 0.401 ' HA ' HD12 ' A' ' 38' ' ' LEU . 9.0 mtpm? -60.94 -29.36 69.57 Favored 'General case' 0 CA--C 1.538 0.519 0 CA-C-N 115.882 -0.599 . . . . 71.45 111.929 179.112 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 54.2 tp60 -62.48 -47.63 83.17 Favored 'General case' 0 CA--C 1.538 0.496 0 CA-C-O 120.838 0.352 . . . . 74.1 110.849 176.95 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 29.9 mm-40 -61.92 -45.22 94.67 Favored 'General case' 0 N--CA 1.47 0.555 0 CA-C-O 121.104 0.478 . . . . 75.0 111.129 175.446 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 38' ' ' LEU . . . . . 0.479 ' CD1' HD22 ' A' ' 52' ' ' LEU . 97.3 mt -57.63 -53.95 52.33 Favored 'General case' 0 CA--C 1.541 0.626 0 CA-C-N 116.092 -0.503 . . . . 73.23 112.342 -178.781 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 19.3 ptpt -57.25 -38.25 73.57 Favored 'General case' 0 N--CA 1.474 0.743 0 CA-C-O 120.823 0.344 . . . . 72.35 111.745 -176.975 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 95.8 mt -65.78 -24.34 66.91 Favored 'General case' 0 CA--C 1.538 0.514 0 CA-C-O 121.187 0.518 . . . . 65.34 111.493 178.279 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 41' ' ' ARG . . . . . . . . . . . . . 80.4 mtt-85 -107.13 13.84 26.93 Favored 'General case' 0 CA--C 1.539 0.549 0 CA-C-N 116.143 -0.48 . . . . 73.35 111.754 -177.454 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 69.0 m 62.78 21.75 12.97 Favored 'General case' 0 N--CA 1.478 0.926 0 CA-C-O 121.022 0.439 . . . . 71.14 112.176 178.937 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 57.1 mt -88.57 147.81 40.5 Favored Pre-proline 0 CA--C 1.54 0.575 0 CA-C-N 116.224 -0.443 . . . . 74.03 111.516 -179.563 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 44' ' ' PRO . . . . . 0.527 ' HD2' ' HD3' ' A' ' 55' ' ' ARG . 51.8 Cg_exo -55.47 117.48 4.09 Favored 'Trans proline' 0 C--N 1.353 0.799 0 C-N-CA 122.888 2.392 . . . . 71.01 113.607 177.176 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 33.4 m -92.21 -18.38 7.25 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.579 0 CA-C-N 116.251 -0.431 . . . . 71.02 112.007 -179.944 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 57.2 m -84.51 50.44 1.89 Allowed 'General case' 0 N--CA 1.473 0.705 0 CA-C-O 120.993 0.425 . . . . 71.5 112.025 -177.634 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . -125.16 165.71 18.19 Favored Glycine 0 CA--C 1.526 0.722 0 C-N-CA 121.406 -0.426 . . . . 51.43 112.58 175.486 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 48' ' ' THR . . . . . 0.516 ' O ' ' HG ' ' A' ' 52' ' ' LEU . 68.7 p -76.09 165.05 25.5 Favored 'General case' 0 N--CA 1.472 0.64 0 O-C-N 122.517 -0.402 . . . . 54.15 111.801 178.808 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 49' ' ' LYS . . . . . 0.434 ' O ' HG13 ' A' ' 53' ' ' ILE . 26.7 tptp -44.97 -53.77 7.31 Favored 'General case' 0 N--CA 1.474 0.728 0 C-N-CA 123.234 0.614 . . . . 65.34 112.549 -174.994 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 50' ' ' THR . . . . . . . . . . . . . 60.1 m -62.0 -42.97 99.73 Favored 'General case' 0 N--CA 1.47 0.575 0 CA-C-N 116.617 -0.265 . . . . 72.02 111.703 -179.841 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 44.2 mt-10 -57.4 -41.87 81.13 Favored 'General case' 0 N--CA 1.471 0.622 0 CA-C-O 120.927 0.394 . . . . 72.0 110.933 177.88 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 52' ' ' LEU . . . . . 0.516 ' HG ' ' O ' ' A' ' 48' ' ' THR . 39.1 mt -63.7 -43.21 97.27 Favored 'General case' 0 CA--C 1.539 0.549 0 CA-C-N 116.194 -0.457 . . . . 71.44 111.152 179.376 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 53' ' ' ILE . . . . . 0.434 HG13 ' O ' ' A' ' 49' ' ' LYS . 68.2 mt -65.2 -51.72 61.87 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.524 0 CA-C-N 116.281 -0.418 . . . . 72.15 111.529 -179.917 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 43.7 mt-10 -57.69 -44.47 85.85 Favored 'General case' 0 N--CA 1.47 0.553 0 CA-C-O 120.968 0.413 . . . . 65.32 110.997 177.663 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 55' ' ' ARG . . . . . 0.527 ' HD3' ' HD2' ' A' ' 44' ' ' PRO . 37.2 ttm180 -57.42 -46.49 83.48 Favored 'General case' 0 CA--C 1.539 0.53 0 CA-C-N 115.847 -0.615 . . . . 71.23 111.955 179.496 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 56' ' ' LEU . . . . . 0.449 ' HB3' HD13 ' A' ' 22' ' ' LEU . 77.8 mt -63.78 -49.1 74.28 Favored 'General case' 0 CA--C 1.538 0.485 0 CA-C-O 120.773 0.32 . . . . 52.12 111.725 177.647 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 57' ' ' ARG . . . . . 0.42 ' O ' ' HB2' ' A' ' 61' ' ' ASP . 32.8 mtm180 -64.54 -37.58 88.05 Favored 'General case' 0 CA--C 1.539 0.529 0 N-CA-C 111.83 0.307 . . . . 75.54 111.83 -178.698 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -73.71 -34.57 64.87 Favored 'General case' 0 N--CA 1.47 0.542 0 CA-C-O 121.165 0.507 . . . . 71.14 111.393 178.933 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 59' ' ' TYR . . . . . . . . . . . . . 85.3 t80 -64.43 -55.83 18.31 Favored 'General case' 0 CA--C 1.537 0.453 0 CA-C-O 121.034 0.445 . . . . 74.32 110.701 175.983 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 60' ' ' GLN . . . . . 0.519 ' HB2' HD12 ' A' ' 22' ' ' LEU . 57.0 tp60 -59.99 -38.53 82.84 Favored 'General case' 0 CA--C 1.539 0.544 0 CA-C-N 116.087 -0.506 . . . . 63.34 111.426 178.049 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 61' ' ' ASP . . . . . 0.42 ' HB2' ' O ' ' A' ' 57' ' ' ARG . 15.8 t70 -54.54 -56.71 16.07 Favored 'General case' 0 CA--C 1.541 0.626 0 CA-C-N 116.107 -0.497 . . . . 64.33 112.086 179.107 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 62' ' ' GLN . . . . . . . . . . . . . 11.3 pt20 -72.94 -30.38 63.83 Favored 'General case' 0 CA--C 1.541 0.619 0 N-CA-C 112.941 0.719 . . . . 65.13 112.941 -173.473 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 63' ' ' ILE . . . . . . . . . . . . . 32.5 pt -80.96 -18.96 11.72 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.737 0 O-C-N 122.06 -0.4 . . . . 63.12 111.425 179.82 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 27.7 t -88.53 136.76 30.96 Favored Pre-proline 0 N--CA 1.47 0.539 0 CA-C-N 116.329 -0.396 . . . . 62.32 111.172 177.222 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 65' ' ' PRO . . . . . . . . . . . . . 59.3 Cg_endo -71.2 119.54 6.36 Favored 'Trans proline' 0 CA--C 1.543 0.94 0 C-N-CA 122.535 2.156 . . . . 74.1 112.504 179.194 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 66' ' ' VAL . . . . . 0.55 ' HB ' ' HB3' ' A' ' 69' ' ' ALA . 27.9 m -60.45 124.41 78.27 Favored Pre-proline 0 CA--C 1.547 0.833 0 CA-C-O 121.128 0.489 . . . . 74.05 112.093 -179.127 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 67' ' ' PRO . . . . . . . . . . . . . 98.7 Cg_endo -78.58 91.71 1.18 Allowed 'Trans proline' 0 CA--C 1.541 0.837 0 C-N-CA 122.605 2.203 . . . . 52.32 113.252 -175.949 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 64.43 15.42 59.18 Favored Glycine 0 CA--C 1.531 1.033 0 CA-C-N 116.331 -0.395 . . . . 63.01 113.876 178.791 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 69' ' ' ALA . . . . . 0.55 ' HB3' ' HB ' ' A' ' 66' ' ' VAL . . . -77.55 139.37 63.23 Favored Pre-proline 0 CA--C 1.539 0.557 0 O-C-N 122.624 -0.339 . . . . 32.22 111.477 -179.145 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 70' ' ' PRO . . . . . . . . . . . . . 51.0 Cg_endo -68.26 89.92 0.39 Allowed 'Trans proline' 0 CA--C 1.538 0.7 0 C-N-CA 122.491 2.127 . . . . 63.01 112.992 -179.03 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 36.3 ttpt -82.47 -22.53 35.14 Favored 'General case' 0 CA--C 1.538 0.481 0 CA-C-N 115.941 -0.572 . . . . 73.3 111.088 178.03 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -108.18 95.24 14.93 Favored Pre-proline 0 CA--C 1.541 0.629 0 N-CA-C 112.219 0.451 . . . . 75.45 112.219 -176.647 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 73' ' ' PRO . . . . . . . . . . . . . 97.4 Cg_endo -83.84 -166.83 0.39 Allowed 'Trans proline' 0 CA--C 1.541 0.869 0 C-N-CA 122.446 2.097 . . . . 72.35 112.333 174.465 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -173.59 179.66 2.03 Favored 'General case' 0 N--CA 1.471 0.6 0 C-N-CA 122.49 0.316 . . . . 75.32 110.818 178.761 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.251 1.18 0 CA-C-O 118.989 -0.529 . . . . 71.11 111.297 175.43 . . . . . . . . 0 0 . 1 . 013 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 87.6 mtp . . . . . 0 N--CA 1.489 1.498 0 CA-C-O 120.775 0.322 . . . . 72.3 111.176 . . . . . . . . . 0 0 . 1 . 013 nuclear nobuild full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . 166.5 169.19 29.78 Favored Glycine 0 CA--C 1.521 0.441 0 C-N-CA 120.392 -0.909 . . . . 32.15 113.527 179.304 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 3' ' ' HIS . . . . . . . . . . . . . 87.9 m-70 -99.82 89.8 4.22 Favored 'General case' 0 CA--C 1.535 0.397 0 CA-C-O 121.541 0.686 . . . . 63.13 111.119 -179.058 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 4' ' ' HIS . . . . . . . . . . . . . 15.4 p80 -94.54 89.68 5.9 Favored 'General case' 0 CA--C 1.54 0.568 0 CA-C-N 115.721 -0.672 . . . . 74.33 111.563 -178.338 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 5' ' ' HIS . . . . . . . . . . . . . 14.9 p-80 -93.08 1.19 57.33 Favored 'General case' 0 CA--C 1.543 0.674 0 CA-C-N 115.935 -0.575 . . . . 63.34 111.894 -178.969 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 61.1 t60 69.03 161.59 0.21 Allowed 'General case' 0 CA--C 1.55 0.965 0 CA-C-O 121.082 0.468 . . . . 62.11 111.537 175.707 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 93.4 m-70 -95.2 166.43 11.91 Favored 'General case' 0 N--CA 1.475 0.799 0 O-C-N 121.888 -0.508 . . . . 70.2 112.023 -179.823 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 8' ' ' HIS . . . . . . . . . . . . . 80.2 m-70 -125.47 78.3 1.72 Allowed 'General case' 0 N--CA 1.47 0.572 0 CA-C-O 121.238 0.542 . . . . 75.04 111.012 173.323 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 71.5 p -81.86 115.55 21.11 Favored 'General case' 0 N--CA 1.468 0.452 0 CA-C-N 116.29 -0.413 . . . . 74.11 110.685 178.498 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 63.9 m-70 -76.88 124.81 28.29 Favored 'General case' 0 N--CA 1.469 0.48 0 CA-C-N 116.418 -0.356 . . . . 70.01 111.146 -175.915 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 11' ' ' MET . . . . . . . . . . . . . 22.9 ptt? -140.23 149.52 42.99 Favored 'General case' 0 N--CA 1.469 0.51 0 CA-C-N 116.481 -0.327 . . . . 44.1 111.008 -179.741 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 93.8 p -146.78 179.11 7.8 Favored 'General case' 0 N--CA 1.471 0.618 0 CA-C-O 121.24 0.543 . . . . 75.01 112.331 -177.703 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 13' ' ' THR . . . . . . . . . . . . . 35.1 p -94.62 148.78 35.47 Favored Pre-proline 0 N--CA 1.47 0.575 0 CA-C-N 115.957 -0.565 . . . . 73.45 111.504 177.264 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 14' ' ' PRO . . . . . . . . . . . . . 59.8 Cg_endo -71.7 133.22 21.65 Favored 'Trans proline' 0 CA--C 1.541 0.838 0 C-N-CA 122.593 2.195 . . . . 73.54 112.947 178.379 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 75.9 mt -98.38 170.41 8.87 Favored 'General case' 0 CA--C 1.54 0.589 0 CA-C-O 121.254 0.55 . . . . 45.24 111.837 -177.786 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 16' ' ' THR . . . . . . . . . . . . . 8.9 t -156.5 155.12 31.45 Favored 'General case' 0 N--CA 1.472 0.651 0 CA-C-N 116.267 -0.424 . . . . 71.24 111.363 177.731 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . -138.31 28.33 2.69 Favored Glycine 0 CA--C 1.525 0.659 0 C-N-CA 121.332 -0.461 . . . . 63.25 112.841 179.096 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 10.3 mtmp? -113.69 138.75 22.78 Favored Pre-proline 0 N--CA 1.472 0.632 0 O-C-N 122.606 -0.349 . . . . 52.23 111.651 179.545 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 73.4 Cg_endo -84.16 165.81 12.88 Favored 'Trans proline' 0 CA--C 1.543 0.951 0 C-N-CA 122.84 2.36 . . . . 54.12 112.852 175.674 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . -153.0 78.38 0.2 Allowed Glycine 0 CA--C 1.528 0.864 0 C-N-CA 120.92 -0.657 . . . . 55.35 113.461 179.774 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -139.87 134.63 31.94 Favored 'General case' 0 N--CA 1.47 0.551 0 CA-C-O 120.866 0.365 . . . . 71.31 111.766 178.305 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 88.5 mt -80.44 153.09 73.69 Favored Pre-proline 0 CA--C 1.542 0.648 0 CA-C-N 116.573 -0.285 . . . . 72.31 111.675 178.706 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 23' ' ' PRO . . . . . 0.473 ' O ' ' HG ' ' A' ' 26' ' ' LEU . 15.6 Cg_exo -68.74 114.21 3.46 Favored 'Trans proline' 0 CA--C 1.541 0.84 0 C-N-CA 122.418 2.079 . . . . 72.33 111.767 172.612 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -47.02 -30.68 2.77 Favored 'General case' 0 N--CA 1.474 0.771 0 N-CA-C 113.122 0.786 . . . . 71.13 113.122 -176.781 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 25' ' ' ASN . . . . . 0.484 ' HB3' ' HB3' ' A' ' 28' ' ' ASP . 14.4 m120 -82.34 33.84 0.41 Allowed 'General case' 0 CA--C 1.545 0.786 0 N-CA-C 112.465 0.542 . . . . 74.44 112.465 -178.719 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 26' ' ' LEU . . . . . 0.473 ' HG ' ' O ' ' A' ' 23' ' ' PRO . 85.6 mt -50.75 -56.84 10.17 Favored 'General case' 0 N--CA 1.476 0.829 0 N-CA-C 112.221 0.452 . . . . 52.21 112.221 179.128 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 15.5 t70 -64.59 -22.54 67.0 Favored 'General case' 0 CA--C 1.544 0.741 0 CA-C-O 120.893 0.378 . . . . 75.23 111.753 -177.768 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 28' ' ' ASP . . . . . 0.484 ' HB3' ' HB3' ' A' ' 25' ' ' ASN . 26.0 t70 -74.56 -34.18 62.86 Favored 'General case' 0 CA--C 1.54 0.591 0 CA-C-N 116.385 -0.371 . . . . 73.42 111.431 178.885 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 29' ' ' MET . . . . . . . . . . . . . 49.4 mtm -73.92 150.97 40.53 Favored 'General case' 0 CA--C 1.537 0.448 0 CA-C-O 121.048 0.451 . . . . 74.31 111.486 -179.694 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 52.0 mtmt -69.12 153.77 43.17 Favored 'General case' 0 CA--C 1.537 0.479 0 CA-C-N 116.162 -0.472 . . . . 73.24 111.822 -178.049 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 31' ' ' VAL . . . . . 0.423 HG13 HD11 ' A' ' 52' ' ' LEU . 91.7 t -49.09 -43.37 15.53 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.679 0 N-CA-C 112.316 0.488 . . . . 72.13 112.316 -177.75 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -58.96 -44.03 91.39 Favored 'General case' 0 N--CA 1.47 0.574 0 CA-C-O 120.814 0.34 . . . . 75.52 111.756 176.687 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 47.3 mt-10 -63.61 -36.36 83.57 Favored 'General case' 0 N--CA 1.47 0.56 0 CA-C-O 120.928 0.394 . . . . 71.25 111.079 178.73 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 34' ' ' LEU . . . . . 0.457 HD21 ' O ' ' A' ' 26' ' ' LEU . 89.4 mt -69.06 -40.83 78.28 Favored 'General case' 0 CA--C 1.539 0.537 0 CA-C-O 120.923 0.392 . . . . 73.51 111.339 176.372 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 94.6 mttt -67.56 -28.15 67.55 Favored 'General case' 0 CA--C 1.536 0.433 0 CA-C-O 120.873 0.368 . . . . 50.31 110.82 174.844 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 53.2 tp60 -64.68 -44.12 91.36 Favored 'General case' 0 N--CA 1.469 0.512 0 N-CA-C 109.89 -0.411 . . . . 70.12 109.89 172.912 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 37' ' ' GLU . . . . . 0.455 ' HB3' ' NH2' ' A' ' 41' ' ' ARG . 55.9 mm-40 -53.23 -40.9 64.89 Favored 'General case' 0 N--CA 1.471 0.607 0 CA-C-N 115.971 -0.559 . . . . 75.12 111.473 174.636 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 38' ' ' LEU . . . . . 0.525 HD13 ' O ' ' A' ' 44' ' ' PRO . 96.6 mt -70.53 -57.48 4.72 Favored 'General case' 0 CA--C 1.538 0.499 0 CA-C-N 115.958 -0.564 . . . . 71.43 112.129 -179.874 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 17.8 ptpt -59.54 -39.13 82.96 Favored 'General case' 0 N--CA 1.472 0.648 0 N-CA-C 112.265 0.469 . . . . 74.13 112.265 -173.99 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 86.0 mt -64.62 -13.6 54.32 Favored 'General case' 0 N--CA 1.473 0.691 0 N-CA-C 112.1 0.408 . . . . 73.52 112.1 179.826 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 41' ' ' ARG . . . . . 0.455 ' NH2' ' HB3' ' A' ' 37' ' ' GLU . 39.0 mtm-85 -124.83 25.59 7.35 Favored 'General case' 0 CA--C 1.543 0.679 0 CA-C-O 120.838 0.351 . . . . 61.45 111.526 179.506 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 73.3 m 63.58 32.44 14.05 Favored 'General case' 0 N--CA 1.48 1.035 0 N-CA-C 113.118 0.785 . . . . 54.44 113.118 174.175 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 43' ' ' LEU . . . . . 0.42 ' HA ' ' HD3' ' A' ' 44' ' ' PRO . 71.6 mt -104.02 145.41 30.6 Favored Pre-proline 0 CA--C 1.544 0.741 0 CA-C-O 120.712 0.292 . . . . 53.13 111.731 178.226 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 44' ' ' PRO . . . . . 0.525 ' O ' HD13 ' A' ' 38' ' ' LEU . 32.1 Cg_exo -62.44 135.59 54.36 Favored 'Trans proline' 0 C--N 1.354 0.849 0 C-N-CA 122.724 2.283 . . . . 54.4 112.898 178.662 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 45' ' ' VAL . . . . . 0.465 HG12 ' HB2' ' A' ' 38' ' ' LEU . 33.1 m -109.39 12.1 8.8 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.853 0 N-CA-C 112.55 0.574 . . . . 71.3 112.55 -176.524 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 46.8 m -79.7 9.17 5.4 Favored 'General case' 0 N--CA 1.476 0.841 0 N-CA-C 113.22 0.822 . . . . 54.31 113.22 -173.869 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . -106.21 170.82 17.0 Favored Glycine 0 CA--C 1.529 0.909 0 C-N-CA 120.797 -0.716 . . . . 43.41 113.911 -178.966 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 48' ' ' THR . . . . . 0.614 ' O ' ' HG ' ' A' ' 52' ' ' LEU . 74.9 p -83.21 178.04 8.27 Favored 'General case' 0 N--CA 1.472 0.645 0 C-N-CA 122.494 0.318 . . . . 73.23 111.446 176.627 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 88.5 tttt -46.42 -47.02 19.05 Favored 'General case' 0 CA--C 1.545 0.782 0 N-CA-C 112.755 0.65 . . . . 71.03 112.755 -175.903 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 50' ' ' THR . . . . . . . . . . . . . 56.7 m -64.43 -44.53 90.87 Favored 'General case' 0 N--CA 1.474 0.775 0 CA-C-O 120.714 0.292 . . . . 75.21 111.243 178.752 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 23.4 mm-40 -55.75 -44.64 77.78 Favored 'General case' 0 N--CA 1.473 0.717 0 CA-C-O 121.167 0.508 . . . . 74.11 111.28 177.101 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 52' ' ' LEU . . . . . 0.614 ' HG ' ' O ' ' A' ' 48' ' ' THR . 28.9 mt -57.63 -51.83 67.89 Favored 'General case' 0 N--CA 1.469 0.491 0 CA-C-N 115.773 -0.649 . . . . 70.33 111.607 -177.771 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 53' ' ' ILE . . . . . 0.401 ' O ' ' HG3' ' A' ' 57' ' ' ARG . 68.2 mt -60.47 -52.54 60.29 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.457 0 CA-C-N 116.352 -0.385 . . . . 65.44 111.772 179.887 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 33.7 mt-10 -60.73 -34.01 73.77 Favored 'General case' 0 N--CA 1.471 0.586 0 CA-C-O 120.931 0.396 . . . . 63.14 111.595 -178.949 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -64.82 -42.87 94.62 Favored 'General case' 0 CA--C 1.54 0.573 0 CA-C-O 121.221 0.534 . . . . 75.14 110.408 177.87 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 56' ' ' LEU . . . . . 0.413 HD22 HH21 ' A' ' 41' ' ' ARG . 97.3 mt -61.45 -46.13 91.37 Favored 'General case' 0 N--CA 1.47 0.53 0 CA-C-N 115.988 -0.551 . . . . 74.31 111.001 174.214 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 57' ' ' ARG . . . . . 0.401 ' HG3' ' O ' ' A' ' 53' ' ' ILE . 66.8 mtp180 -60.67 -36.04 77.73 Favored 'General case' 0 CA--C 1.544 0.73 0 CA-C-N 116.382 -0.372 . . . . 74.23 111.707 179.563 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -67.76 -39.02 84.19 Favored 'General case' 0 N--CA 1.472 0.654 0 CA-C-O 121.1 0.476 . . . . 65.3 111.12 175.797 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 59' ' ' TYR . . . . . . . . . . . . . 75.2 t80 -62.74 -44.82 95.22 Favored 'General case' 0 CA--C 1.542 0.661 0 CA-C-N 116.215 -0.448 . . . . 71.23 111.154 175.772 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 60' ' ' GLN . . . . . . . . . . . . . 15.5 mm100 -65.18 -45.78 83.45 Favored 'General case' 0 N--CA 1.471 0.584 0 CA-C-O 121.12 0.486 . . . . 74.25 111.501 177.494 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 61' ' ' ASP . . . . . . . . . . . . . 27.1 t70 -47.13 -38.83 12.26 Favored 'General case' 0 CA--C 1.543 0.704 0 CA-C-N 115.565 -0.743 . . . . 70.24 112.892 -178.231 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 62' ' ' GLN . . . . . . . . . . . . . 9.6 pt20 -87.05 -26.99 23.43 Favored 'General case' 0 CA--C 1.544 0.725 0 N-CA-C 112.954 0.724 . . . . 74.13 112.954 -175.612 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 63' ' ' ILE . . . . . . . . . . . . . 36.4 pt -97.09 -20.28 5.74 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.828 0 N-CA-C 112.576 0.584 . . . . 72.34 112.576 -176.212 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 26.0 t -70.48 141.7 88.37 Favored Pre-proline 0 N--CA 1.473 0.676 0 N-CA-C 111.689 0.255 . . . . 73.11 111.689 -177.113 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 65' ' ' PRO . . . . . . . . . . . . . 56.4 Cg_endo -69.19 78.51 0.81 Allowed 'Trans proline' 0 CA--C 1.542 0.896 0 C-N-CA 122.531 2.154 . . . . 64.5 113.254 -179.702 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 66' ' ' VAL . . . . . 0.403 ' HA ' ' HD3' ' A' ' 67' ' ' PRO . 23.9 m -94.91 146.98 32.32 Favored Pre-proline 0 CA--C 1.545 0.788 0 CA-C-N 116.039 -0.528 . . . . 73.4 111.786 178.554 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 67' ' ' PRO . . . . . 0.403 ' HD3' ' HA ' ' A' ' 66' ' ' VAL . 45.5 Cg_exo -57.91 -52.12 6.6 Favored 'Trans proline' 0 CA--C 1.544 0.983 0 C-N-CA 123.0 2.467 . . . . 71.42 114.322 -176.89 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . -69.91 -43.9 64.02 Favored Glycine 0 CA--C 1.529 0.937 0 C-N-CA 121.067 -0.587 . . . . 53.2 113.533 -178.943 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . 68.32 115.77 0.03 OUTLIER Pre-proline 0 N--CA 1.472 0.669 0 C-N-CA 123.185 0.594 . . . . 63.2 112.261 178.963 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 70' ' ' PRO . . . . . . . . . . . . . 72.0 Cg_exo -50.93 134.96 43.18 Favored 'Trans proline' 0 CA--C 1.542 0.901 0 C-N-CA 122.767 2.312 . . . . 72.24 113.039 178.326 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 18.7 ptpt -61.18 -19.05 61.14 Favored 'General case' 0 N--CA 1.471 0.611 0 N-CA-C 112.931 0.715 . . . . 70.2 112.931 -175.868 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -120.06 81.31 27.84 Favored Pre-proline 0 N--CA 1.472 0.636 0 CA-C-O 120.867 0.365 . . . . 72.42 111.482 177.941 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 73' ' ' PRO . . . . . . . . . . . . . 42.4 Cg_endo -96.37 -170.5 0.16 Allowed 'Trans proline' 0 CA--C 1.54 0.821 0 C-N-CA 123.344 2.696 . . . . 75.21 113.416 179.478 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -101.1 138.11 38.57 Favored 'General case' 0 CA--C 1.54 0.579 0 CA-C-N 116.237 -0.438 . . . . 63.22 111.271 176.249 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.252 1.229 0 CA-C-O 118.622 -0.704 . . . . 73.34 111.85 -179.875 . . . . . . . . 0 0 . 1 . 014 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . 0.482 ' SD ' ' N ' ' A' ' 1' ' ' MET . 0.0 OUTLIER . . . . . 0 N--CA 1.487 1.41 0 CA-C-O 120.762 0.315 . . . . 64.14 111.251 . . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . -154.4 157.76 27.75 Favored Glycine 0 CA--C 1.526 0.727 0 C-N-CA 120.974 -0.632 . . . . 32.2 113.404 -178.889 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 3' ' ' HIS . . . . . . . . . . . . . 59.4 t-80 -84.79 121.48 27.76 Favored 'General case' 0 CA--C 1.54 0.57 0 CA-C-O 120.672 0.273 . . . . 64.23 111.343 -179.377 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 4' ' ' HIS . . . . . . . . . . . . . 50.1 t60 -102.67 104.12 14.44 Favored 'General case' 0 N--CA 1.473 0.685 0 CA-C-O 120.847 0.356 . . . . 72.21 111.143 178.84 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 5' ' ' HIS . . . . . . . . . . . . . 51.7 t-80 -93.76 104.79 16.86 Favored 'General case' 0 CA--C 1.541 0.598 0 CA-C-O 120.939 0.399 . . . . 70.12 111.436 -179.562 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 6.6 p-80 -75.92 146.29 39.8 Favored 'General case' 0 N--CA 1.474 0.742 0 N-CA-C 112.26 0.467 . . . . 73.22 112.26 -178.003 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 25.7 p80 -164.52 163.48 21.99 Favored 'General case' 0 N--CA 1.472 0.644 0 CA-C-N 116.219 -0.446 . . . . 75.22 112.039 -179.464 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 8' ' ' HIS . . . . . . . . . . . . . 54.4 p-80 -144.5 160.96 40.23 Favored 'General case' 0 CA--C 1.543 0.679 0 CA-C-N 116.42 -0.355 . . . . 75.32 110.975 174.939 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 92.3 p -141.14 -176.51 4.72 Favored 'General case' 0 N--CA 1.477 0.911 0 CA-C-O 120.96 0.41 . . . . 64.41 111.664 -177.828 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 45.2 m80 -113.47 160.84 18.04 Favored 'General case' 0 N--CA 1.471 0.616 0 CA-C-O 120.923 0.392 . . . . 64.31 111.477 179.205 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 11' ' ' MET . . . . . . . . . . . . . 52.0 ttm -141.41 104.45 4.59 Favored 'General case' 0 CA--C 1.54 0.566 0 CA-C-O 120.92 0.391 . . . . 74.03 110.977 176.14 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 66.1 p -86.22 138.12 32.11 Favored 'General case' 0 N--CA 1.472 0.64 0 CA-C-O 121.057 0.456 . . . . 75.02 111.838 -178.762 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 13' ' ' THR . . . . . . . . . . . . . 81.1 p -100.62 154.77 36.99 Favored Pre-proline 0 N--CA 1.473 0.689 0 CA-C-N 116.168 -0.469 . . . . 74.11 111.239 179.396 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 14' ' ' PRO . . . . . . . . . . . . . 98.4 Cg_endo -80.07 158.85 23.79 Favored 'Trans proline' 0 CA--C 1.544 1.011 0 C-N-CA 122.513 2.142 . . . . 64.15 113.99 -176.831 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 2.3 pt? -73.49 166.32 23.44 Favored 'General case' 0 CA--C 1.541 0.6 0 CA-C-N 116.04 -0.527 . . . . 74.4 111.098 173.915 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 16' ' ' THR . . . . . . . . . . . . . 90.9 m -147.08 138.93 24.33 Favored 'General case' 0 N--CA 1.472 0.651 0 CA-C-O 120.908 0.385 . . . . 70.51 111.905 -179.347 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . -93.29 103.52 3.05 Favored Glycine 0 CA--C 1.528 0.859 0 CA-C-N 116.312 -0.404 . . . . 21.01 112.168 175.499 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 45.7 mtmt -55.76 116.75 12.92 Favored Pre-proline 0 CA--C 1.544 0.727 0 N-CA-C 112.31 0.485 . . . . 72.45 112.31 -175.767 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 87.9 Cg_endo -83.84 131.52 5.31 Favored 'Trans proline' 0 CA--C 1.541 0.826 0 C-N-CA 122.594 2.196 . . . . 73.31 113.161 178.488 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . -129.84 -54.61 0.1 Allowed Glycine 0 N--CA 1.465 0.589 0 CA-C-N 116.308 -0.405 . . . . 71.4 112.117 175.633 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -124.4 134.95 52.96 Favored 'General case' 0 CA--C 1.535 0.397 0 CA-C-O 120.825 0.345 . . . . 70.34 110.811 176.65 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 22' ' ' LEU . . . . . 0.548 ' HG ' ' HG3' ' A' ' 60' ' ' GLN . 94.3 mt -78.3 149.18 75.46 Favored Pre-proline 0 N--CA 1.47 0.568 0 N-CA-C 111.955 0.354 . . . . 72.42 111.955 -177.533 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 23' ' ' PRO . . . . . 0.62 ' O ' ' HG ' ' A' ' 26' ' ' LEU . 22.9 Cg_exo -64.85 125.51 14.9 Favored 'Trans proline' 0 CA--C 1.538 0.701 0 C-N-CA 122.626 2.217 . . . . 71.53 111.773 173.269 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -56.27 -23.96 39.82 Favored 'General case' 0 CA--C 1.542 0.656 0 N-CA-C 112.934 0.716 . . . . 72.31 112.934 -176.339 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 3.7 m-20 -82.23 19.21 1.23 Allowed 'General case' 0 CA--C 1.545 0.772 0 N-CA-C 113.314 0.857 . . . . 72.24 113.314 -177.063 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 26' ' ' LEU . . . . . 0.62 ' HG ' ' O ' ' A' ' 23' ' ' PRO . 77.8 mt -50.32 -47.77 55.61 Favored 'General case' 0 N--CA 1.479 0.996 0 O-C-N 121.946 -0.471 . . . . 74.24 111.771 176.86 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 27' ' ' ASP . . . . . 0.442 ' HB3' HD13 ' A' ' 53' ' ' ILE . 1.0 OUTLIER -71.59 -28.7 64.0 Favored 'General case' 0 CA--C 1.539 0.551 0 N-CA-C 112.246 0.461 . . . . 62.3 112.246 179.055 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 34.6 t70 -77.31 -24.15 50.94 Favored 'General case' 0 CA--C 1.544 0.745 0 N-CA-C 111.725 0.268 . . . . 63.11 111.725 -179.784 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 29' ' ' MET . . . . . . . . . . . . . 68.8 mtm -79.07 -178.26 6.04 Favored 'General case' 0 CA--C 1.539 0.55 0 CA-C-O 121.296 0.569 . . . . 70.43 111.95 178.484 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 28.2 mtpp -87.37 165.23 15.75 Favored 'General case' 0 CA--C 1.539 0.523 0 CA-C-O 121.225 0.536 . . . . 71.14 112.094 -177.206 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 42.3 t -62.16 -42.63 95.88 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.556 0 CA-C-N 116.215 -0.448 . . . . 71.23 111.218 179.574 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -54.98 -39.03 68.55 Favored 'General case' 0 CA--C 1.539 0.542 0 CA-C-N 116.163 -0.471 . . . . 73.0 112.193 179.004 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 22.5 mm-40 -60.34 -48.43 81.76 Favored 'General case' 0 N--CA 1.469 0.507 0 CA-C-O 120.933 0.397 . . . . 72.03 111.177 177.954 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 34' ' ' LEU . . . . . 0.434 ' O ' ' HG ' ' A' ' 38' ' ' LEU . 67.8 mt -58.89 -47.04 86.36 Favored 'General case' 0 N--CA 1.468 0.438 0 CA-C-O 121.174 0.511 . . . . 73.52 111.169 178.289 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 35' ' ' LYS . . . . . 0.531 ' HA ' HD12 ' A' ' 38' ' ' LEU . 7.4 mtpm? -58.02 -37.75 74.91 Favored 'General case' 0 CA--C 1.541 0.619 0 CA-C-N 115.969 -0.559 . . . . 65.13 111.258 177.745 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 19.6 tm0? -68.88 -42.73 76.58 Favored 'General case' 0 CA--C 1.544 0.731 0 CA-C-O 120.957 0.408 . . . . 73.24 110.209 177.053 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 37' ' ' GLU . . . . . 0.471 ' HB3' HH21 ' A' ' 41' ' ' ARG . 36.9 mm-40 -58.57 -29.88 66.73 Favored 'General case' 0 N--CA 1.474 0.738 0 CA-C-N 116.287 -0.415 . . . . 64.14 111.937 176.166 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 38' ' ' LEU . . . . . 0.547 HD11 HD22 ' A' ' 52' ' ' LEU . 78.7 mt -73.95 -54.85 7.02 Favored 'General case' 0 CA--C 1.541 0.62 0 CA-C-N 116.137 -0.483 . . . . 74.33 112.126 -179.051 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -57.04 -31.16 64.87 Favored 'General case' 0 N--CA 1.476 0.854 0 N-CA-C 112.423 0.527 . . . . 52.32 112.423 -176.57 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 98.6 mt -61.34 -36.16 79.4 Favored 'General case' 0 N--CA 1.471 0.608 0 CA-C-O 121.235 0.54 . . . . 73.55 111.427 177.366 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 41' ' ' ARG . . . . . 0.471 HH21 ' HB3' ' A' ' 37' ' ' GLU . 13.9 mtm180 -109.03 27.24 9.71 Favored 'General case' 0 CA--C 1.542 0.649 0 CA-C-N 116.002 -0.545 . . . . 73.02 112.307 -175.949 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 38.3 t 68.98 12.63 8.67 Favored 'General case' 0 N--CA 1.48 1.059 0 N-CA-C 112.578 0.585 . . . . 72.1 112.578 173.566 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 71.9 mt -87.47 148.11 43.53 Favored Pre-proline 0 CA--C 1.542 0.661 0 O-C-N 122.333 -0.23 . . . . 72.42 111.137 -179.971 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 44' ' ' PRO . . . . . 0.444 ' O ' HD13 ' A' ' 38' ' ' LEU . 67.9 Cg_endo -70.73 125.35 11.55 Favored 'Trans proline' 0 C--N 1.352 0.752 0 C-N-CA 122.284 1.989 . . . . 71.14 112.637 -177.895 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 45' ' ' VAL . . . . . 0.451 HG12 ' O ' ' A' ' 35' ' ' LYS . 30.5 m -76.72 27.42 0.04 OUTLIER 'Isoleucine or valine' 0 CA--C 1.546 0.808 0 N-CA-C 112.936 0.717 . . . . 74.41 112.936 -176.108 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 68.7 m -123.65 130.51 52.77 Favored 'General case' 0 N--CA 1.471 0.595 0 CA-C-O 121.231 0.539 . . . . 75.24 111.777 -178.428 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 152.29 164.12 12.1 Favored Glycine 0 CA--C 1.528 0.906 0 CA-C-N 115.363 -0.835 . . . . 73.54 112.045 -179.182 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 48' ' ' THR . . . . . 0.424 ' O ' ' HG ' ' A' ' 52' ' ' LEU . 44.1 p -77.09 162.16 27.7 Favored 'General case' 0 N--CA 1.475 0.806 0 CA-C-N 117.629 0.714 . . . . 73.0 111.786 -179.8 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 49' ' ' LYS . . . . . 0.499 ' O ' HG13 ' A' ' 53' ' ' ILE . 24.2 tptm -44.26 -61.57 1.46 Allowed 'General case' 0 N--CA 1.472 0.651 0 CA-C-N 116.032 -0.531 . . . . 72.12 112.154 -178.883 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 50' ' ' THR . . . . . 0.474 ' HA ' HD12 ' A' ' 53' ' ' ILE . 34.6 m -56.59 -45.48 81.37 Favored 'General case' 0 N--CA 1.472 0.643 0 N-CA-C 112.129 0.418 . . . . 73.21 112.129 -176.718 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 48.0 mt-10 -66.09 -41.0 91.24 Favored 'General case' 0 CA--C 1.536 0.433 0 N-CA-C 112.248 0.462 . . . . 75.31 112.248 -176.441 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 52' ' ' LEU . . . . . 0.547 HD22 HD11 ' A' ' 38' ' ' LEU . 62.6 mt -62.8 -42.02 99.54 Favored 'General case' 0 N--CA 1.469 0.517 0 CA-C-O 121.046 0.45 . . . . 70.24 111.24 179.024 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 53' ' ' ILE . . . . . 0.499 HG13 ' O ' ' A' ' 49' ' ' LYS . 35.1 mt -58.02 -54.64 29.38 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.435 0 CA-C-O 121.365 0.603 . . . . 62.24 110.914 176.68 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 54.1 mm-40 -67.23 -24.64 65.84 Favored 'General case' 0 CA--C 1.535 0.39 0 CA-C-N 115.935 -0.575 . . . . 70.42 111.876 179.363 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 37.1 ttm180 -67.06 -45.83 76.2 Favored 'General case' 0 N--CA 1.467 0.419 0 CA-C-O 120.991 0.424 . . . . 73.44 110.408 175.637 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 83.0 mt -60.72 -48.65 80.85 Favored 'General case' 0 CA--C 1.539 0.522 0 CA-C-O 121.125 0.488 . . . . 74.44 111.079 174.925 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 65.7 mtt180 -62.03 -38.25 87.99 Favored 'General case' 0 N--CA 1.469 0.5 0 CA-C-N 116.194 -0.457 . . . . 74.42 111.555 178.246 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -66.08 -40.56 90.94 Favored 'General case' 0 CA--C 1.534 0.328 0 CA-C-O 120.884 0.373 . . . . 73.51 111.068 177.352 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 59' ' ' TYR . . . . . 0.436 ' O ' ' HG2' ' A' ' 62' ' ' GLN . 71.1 t80 -58.91 -48.42 81.53 Favored 'General case' 0 CA--C 1.538 0.494 0 CA-C-N 116.144 -0.48 . . . . 73.24 110.987 177.457 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 60' ' ' GLN . . . . . 0.548 ' HG3' ' HG ' ' A' ' 22' ' ' LEU . 14.3 mm100 -63.35 -42.54 98.93 Favored 'General case' 0 CA--C 1.539 0.537 0 CA-C-O 120.747 0.308 . . . . 71.25 111.275 175.861 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 61' ' ' ASP . . . . . . . . . . . . . 27.0 t70 -56.81 -47.69 79.68 Favored 'General case' 0 CA--C 1.541 0.6 0 N-CA-C 112.022 0.379 . . . . 74.53 112.022 179.498 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 62' ' ' GLN . . . . . 0.436 ' HG2' ' O ' ' A' ' 59' ' ' TYR . 3.4 pt20 -69.38 -31.21 69.45 Favored 'General case' 0 CA--C 1.539 0.544 0 N-CA-C 112.026 0.38 . . . . 75.22 112.026 -177.343 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 63' ' ' ILE . . . . . . . . . . . . . 26.0 pt -95.34 5.19 8.34 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.77 0 N-CA-C 111.833 0.308 . . . . 74.22 111.833 178.922 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 46.9 t 71.98 105.2 0.03 OUTLIER Pre-proline 0 N--CA 1.475 0.791 0 C-N-CA 123.327 0.651 . . . . 72.32 111.797 -178.588 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 65' ' ' PRO . . . . . . . . . . . . . 14.4 Cg_exo -68.34 112.4 2.78 Favored 'Trans proline' 0 CA--C 1.537 0.646 0 C-N-CA 122.664 2.242 . . . . 75.42 112.157 179.454 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 66' ' ' VAL . . . . . . . . . . . . . 27.0 m -103.6 132.33 21.17 Favored Pre-proline 0 CA--C 1.542 0.64 0 CA-C-O 120.99 0.424 . . . . 64.23 111.928 -178.506 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 67' ' ' PRO . . . . . . . . . . . . . 85.9 Cg_endo -77.55 0.22 10.0 Favored 'Trans proline' 0 CA--C 1.54 0.818 0 C-N-CA 122.565 2.177 . . . . 74.21 112.591 178.038 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 123.41 -25.64 6.23 Favored Glycine 0 CA--C 1.523 0.56 0 CA-C-N 116.281 -0.418 . . . . 61.2 112.394 -177.022 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 69' ' ' ALA . . . . . 0.405 ' HB1' ' HD2' ' A' ' 70' ' ' PRO . . . 68.48 159.1 0.15 Allowed Pre-proline 0 CA--C 1.545 0.75 0 C-N-CA 122.977 0.511 . . . . 61.34 112.056 178.906 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 70' ' ' PRO . . . . . 0.405 ' HD2' ' HB1' ' A' ' 69' ' ' ALA . 56.8 Cg_endo -70.43 30.25 0.2 Allowed 'Trans proline' 0 CA--C 1.548 1.215 0 C-N-CA 122.554 2.17 . . . . 71.33 113.563 177.818 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 7.0 mtpm? -80.14 82.13 6.26 Favored 'General case' 0 CA--C 1.537 0.477 0 CA-C-O 121.034 0.445 . . . . 75.45 110.764 177.839 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -105.06 108.16 60.61 Favored Pre-proline 0 CA--C 1.539 0.551 0 N-CA-C 112.511 0.56 . . . . 42.3 112.511 -175.982 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 73' ' ' PRO . . . . . . . . . . . . . 73.8 Cg_endo -86.27 12.32 3.05 Favored 'Trans proline' 0 CA--C 1.542 0.887 0 C-N-CA 122.842 2.361 . . . . 63.53 112.842 174.643 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -96.72 -166.45 1.41 Allowed 'General case' 0 CA--C 1.543 0.699 0 CA-C-N 116.358 -0.383 . . . . 73.02 111.798 -179.121 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.253 1.24 0 CA-C-O 118.996 -0.526 . . . . 75.15 111.826 178.379 . . . . . . . . 0 0 . 1 . 015 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 86.5 mtp . . . . . 0 N--CA 1.491 1.596 0 CA-C-O 120.814 0.34 . . . . 55.14 111.235 . . . . . . . . . 0 0 . 1 . 015 nuclear nobuild full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . 118.68 167.9 14.03 Favored Glycine 0 CA--C 1.521 0.416 0 C-N-CA 121.19 -0.528 . . . . 73.15 111.982 -178.223 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 3' ' ' HIS . . . . . . . . . . . . . 97.1 m-70 -133.05 160.07 38.24 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-O 121.25 0.548 . . . . 74.42 111.776 -178.775 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 4' ' ' HIS . . . . . . . . . . . . . 12.2 p80 -120.28 129.75 54.17 Favored 'General case' 0 CA--C 1.534 0.349 0 CA-C-N 115.947 -0.57 . . . . 72.13 111.205 -177.969 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 5' ' ' HIS . . . . . . . . . . . . . 49.4 t-80 -131.13 130.89 43.66 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-O 120.744 0.307 . . . . 72.23 111.147 -178.509 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 72.5 m80 -108.96 159.21 17.0 Favored 'General case' 0 N--CA 1.468 0.431 0 CA-C-O 121.252 0.548 . . . . 73.41 111.816 179.199 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 20.6 t-80 -147.91 113.27 5.59 Favored 'General case' 0 CA--C 1.537 0.478 0 CA-C-N 115.78 -0.646 . . . . 64.44 110.437 176.931 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 8' ' ' HIS . . . . . . . . . . . . . 61.9 t60 -105.59 108.04 19.35 Favored 'General case' 0 CA--C 1.54 0.564 0 CA-C-N 116.116 -0.493 . . . . 71.1 111.559 -174.695 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 75.7 m -106.73 101.42 10.87 Favored 'General case' 0 N--CA 1.471 0.605 0 CA-C-O 120.832 0.349 . . . . 73.02 111.288 178.01 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 51.4 t-80 -75.22 94.83 3.03 Favored 'General case' 0 CA--C 1.538 0.492 0 CA-C-O 121.067 0.46 . . . . 73.35 110.656 178.493 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 11' ' ' MET . . . . . . . . . . . . . 11.0 ptt? -99.24 157.95 16.03 Favored 'General case' 0 N--CA 1.467 0.42 0 CA-C-N 116.119 -0.491 . . . . 74.25 111.371 -179.694 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 34.8 m -89.22 172.75 8.83 Favored 'General case' 0 N--CA 1.471 0.599 0 CA-C-O 121.575 0.702 . . . . 71.23 112.824 -172.026 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 13' ' ' THR . . . . . . . . . . . . . 67.4 p -118.23 118.04 34.47 Favored Pre-proline 0 N--CA 1.47 0.568 0 CA-C-N 115.539 -0.755 . . . . 75.44 110.987 179.865 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 14' ' ' PRO . . . . . . . . . . . . . 62.1 Cg_endo -72.98 122.59 8.24 Favored 'Trans proline' 0 CA--C 1.54 0.805 0 C-N-CA 122.219 1.946 . . . . 75.25 112.873 178.496 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 15' ' ' LEU . . . . . 0.454 ' O ' HD12 ' A' ' 15' ' ' LEU . 3.0 pp -66.88 150.24 49.46 Favored 'General case' 0 CA--C 1.541 0.599 0 CA-C-O 121.16 0.505 . . . . 71.04 111.403 178.741 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 16' ' ' THR . . . . . . . . . . . . . 59.1 m -116.14 110.21 18.53 Favored 'General case' 0 N--CA 1.468 0.428 0 CA-C-O 121.16 0.505 . . . . 71.51 112.066 -176.362 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . -81.91 171.47 52.36 Favored Glycine 0 CA--C 1.526 0.762 0 CA-C-N 115.9 -0.591 . . . . 53.52 112.421 175.452 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 57.4 pttt -86.3 120.95 72.59 Favored Pre-proline 0 CA--C 1.54 0.56 0 CA-C-O 121.011 0.434 . . . . 74.22 111.899 -179.372 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 52.3 Cg_endo -96.4 27.53 0.22 Allowed 'Trans proline' 0 CA--C 1.541 0.851 0 C-N-CA 123.314 2.676 . . . . 73.42 112.913 176.294 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . -78.4 56.87 4.11 Favored Glycine 0 CA--C 1.531 1.042 0 N-CA-C 114.01 0.364 . . . . 63.55 114.01 -175.475 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -178.27 126.35 0.12 Allowed 'General case' 0 N--CA 1.472 0.645 0 C-N-CA 122.823 0.449 . . . . 74.13 111.011 177.184 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 22' ' ' LEU . . . . . 0.426 ' HA ' ' HD3' ' A' ' 23' ' ' PRO . 99.4 mt -92.86 140.61 23.62 Favored Pre-proline 0 CA--C 1.536 0.436 0 N-CA-C 111.943 0.349 . . . . 65.23 111.943 -178.49 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 23' ' ' PRO . . . . . 0.54 ' O ' ' HG ' ' A' ' 26' ' ' LEU . 11.4 Cg_exo -73.69 152.34 47.69 Favored 'Trans proline' 0 CA--C 1.543 0.937 0 C-N-CA 122.985 2.456 . . . . 72.21 112.681 173.685 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -73.81 -19.44 60.75 Favored 'General case' 0 N--CA 1.471 0.619 0 CA-C-O 121.279 0.562 . . . . 72.54 111.088 175.567 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 15.3 m120 -84.41 24.12 1.02 Allowed 'General case' 0 CA--C 1.541 0.625 0 N-CA-C 112.986 0.736 . . . . 72.15 112.986 -179.486 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 26' ' ' LEU . . . . . 0.54 ' HG ' ' O ' ' A' ' 23' ' ' PRO . 67.2 mt -52.88 -37.4 60.44 Favored 'General case' 0 N--CA 1.479 1.018 0 CA-C-N 118.327 0.512 . . . . 52.41 111.615 179.221 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 4.3 m-20 -68.55 -36.31 78.62 Favored 'General case' 0 CA--C 1.544 0.722 0 CA-C-O 121.278 0.561 . . . . 74.44 111.544 177.707 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 9.1 m-20 -76.32 -37.47 57.35 Favored 'General case' 0 CA--C 1.538 0.509 0 CA-C-N 116.165 -0.471 . . . . 75.23 111.681 179.202 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 29' ' ' MET . . . . . . . . . . . . . 81.4 mtp -59.68 141.78 54.38 Favored 'General case' 0 N--CA 1.466 0.373 0 CA-C-N 115.871 -0.604 . . . . 72.41 112.546 -175.07 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 30' ' ' LYS . . . . . 0.566 ' HB2' ' HG2' ' A' ' 33' ' ' GLU . 48.3 mtmt -68.94 149.38 48.91 Favored 'General case' 0 CA--C 1.539 0.52 0 CA-C-N 115.545 -0.752 . . . . 71.0 111.992 -179.725 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 90.0 t -48.24 -44.47 12.67 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.724 0 CA-C-N 115.868 -0.606 . . . . 62.25 112.194 -179.797 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -61.25 -39.67 91.21 Favored 'General case' 0 N--CA 1.469 0.523 0 N-CA-C 112.12 0.415 . . . . 41.42 112.12 179.252 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 33' ' ' GLU . . . . . 0.566 ' HG2' ' HB2' ' A' ' 30' ' ' LYS . 16.3 mm-40 -68.23 -37.32 80.7 Favored 'General case' 0 N--CA 1.467 0.424 0 CA-C-O 120.971 0.415 . . . . 74.43 111.23 -178.779 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 83.2 mt -61.49 -45.99 91.88 Favored 'General case' 0 CA--C 1.538 0.481 0 CA-C-O 121.23 0.538 . . . . 75.43 110.5 175.56 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 35' ' ' LYS . . . . . 0.469 ' HA ' HD12 ' A' ' 38' ' ' LEU . 96.6 mttt -64.82 -29.13 70.08 Favored 'General case' 0 CA--C 1.539 0.532 0 CA-C-N 116.293 -0.412 . . . . 71.3 111.398 176.684 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 36' ' ' GLN . . . . . 0.505 ' HA ' ' HE3' ' A' ' 39' ' ' LYS . 55.9 tp60 -61.95 -37.39 84.55 Favored 'General case' 0 CA--C 1.539 0.552 0 CA-C-N 116.334 -0.394 . . . . 62.22 111.297 178.256 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 36.6 mt-10 -81.49 -30.2 33.38 Favored 'General case' 0 CA--C 1.539 0.531 0 O-C-N 122.166 -0.334 . . . . 72.13 111.698 176.06 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 38' ' ' LEU . . . . . 0.469 HD12 ' HA ' ' A' ' 35' ' ' LYS . 89.2 mt -58.71 -54.35 48.05 Favored 'General case' 0 N--CA 1.472 0.655 0 CA-C-O 120.741 0.305 . . . . 53.21 111.377 174.94 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 39' ' ' LYS . . . . . 0.505 ' HE3' ' HA ' ' A' ' 36' ' ' GLN . 17.5 ptpt -55.36 -37.13 67.12 Favored 'General case' 0 CA--C 1.543 0.687 0 CA-C-N 116.463 -0.335 . . . . 54.22 111.553 -179.781 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 40' ' ' LEU . . . . . 0.43 ' HG ' ' O ' ' A' ' 36' ' ' GLN . 94.2 mt -69.03 -29.39 67.54 Favored 'General case' 0 CA--C 1.538 0.49 0 N-CA-C 112.002 0.371 . . . . 65.51 112.002 -179.086 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 41' ' ' ARG . . . . . 0.61 HH21 HD23 ' A' ' 56' ' ' LEU . 61.5 mtm180 -105.92 22.82 14.98 Favored 'General case' 0 CA--C 1.542 0.659 0 N-CA-C 112.118 0.414 . . . . 71.44 112.118 -177.78 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 31.1 t 62.69 28.96 16.79 Favored 'General case' 0 N--CA 1.482 1.156 0 CA-C-O 121.33 0.586 . . . . 60.02 112.046 176.133 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 65.3 mt -100.6 148.63 35.24 Favored Pre-proline 0 CA--C 1.543 0.692 0 CA-C-N 116.056 -0.52 . . . . 74.4 111.182 179.125 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 44' ' ' PRO . . . . . . . . . . . . . 56.8 Cg_endo -69.36 130.27 19.53 Favored 'Trans proline' 0 CA--C 1.541 0.852 0 C-N-CA 122.364 2.043 . . . . 55.33 113.094 179.644 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 34.8 m -76.06 -21.77 15.63 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.533 0 CA-C-N 116.153 -0.476 . . . . 52.51 111.618 179.339 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 31.5 t -62.22 101.57 0.23 Allowed 'General case' 0 N--CA 1.473 0.721 0 CA-C-N 116.36 -0.382 . . . . 72.1 111.902 178.501 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 176.89 154.03 11.47 Favored Glycine 0 CA--C 1.532 1.119 0 C-N-CA 120.854 -0.689 . . . . 55.43 114.063 177.516 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 48' ' ' THR . . . . . 0.575 ' O ' ' HG ' ' A' ' 52' ' ' LEU . 44.0 p -76.82 174.06 10.96 Favored 'General case' 0 N--CA 1.476 0.871 0 O-C-N 122.633 -0.333 . . . . 72.13 110.87 174.133 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 49' ' ' LYS . . . . . 0.407 ' HE2' HD11 ' A' ' 53' ' ' ILE . 24.5 tptm -49.85 -49.59 48.64 Favored 'General case' 0 N--CA 1.474 0.745 0 CA-C-O 120.84 0.353 . . . . 75.35 111.357 -179.566 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 50' ' ' THR . . . . . . . . . . . . . 82.7 m -58.27 -50.33 73.98 Favored 'General case' 0 N--CA 1.475 0.783 0 CA-C-O 120.954 0.407 . . . . 70.41 111.317 176.832 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 15.6 mm-40 -54.1 -46.76 72.19 Favored 'General case' 0 N--CA 1.469 0.484 0 CA-C-N 115.846 -0.615 . . . . 64.3 111.803 -179.71 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 52' ' ' LEU . . . . . 0.575 ' HG ' ' O ' ' A' ' 48' ' ' THR . 50.9 mt -63.03 -48.63 77.93 Favored 'General case' 0 CA--C 1.537 0.476 0 CA-C-N 116.304 -0.407 . . . . 73.32 111.309 -178.167 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 53' ' ' ILE . . . . . 0.407 HD11 ' HE2' ' A' ' 49' ' ' LYS . 74.3 mt -59.13 -48.07 88.03 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.568 0 N-CA-C 111.998 0.37 . . . . 61.0 111.998 -179.609 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 54' ' ' GLU . . . . . 0.754 ' HG2' HH21 ' A' ' 57' ' ' ARG . 27.2 mt-10 -68.87 -38.4 79.67 Favored 'General case' 0 CA--C 1.537 0.455 0 O-C-N 122.243 -0.286 . . . . 75.44 111.341 179.49 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 39.7 ttm180 -62.41 -43.83 97.89 Favored 'General case' 0 CA--C 1.539 0.554 0 CA-C-O 120.98 0.419 . . . . 73.33 111.14 177.591 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 56' ' ' LEU . . . . . 0.61 HD23 HH21 ' A' ' 41' ' ' ARG . 48.7 mt -58.76 -51.55 69.51 Favored 'General case' 0 C--O 1.237 0.415 0 CA-C-N 116.206 -0.452 . . . . 75.41 111.057 174.029 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 57' ' ' ARG . . . . . 0.754 HH21 ' HG2' ' A' ' 54' ' ' GLU . 79.0 mtm180 -60.62 -47.59 85.56 Favored 'General case' 0 CA--C 1.538 0.513 0 N-CA-C 112.205 0.446 . . . . 75.31 112.205 -178.761 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -55.12 -51.3 66.88 Favored 'General case' 0 N--CA 1.472 0.646 0 CA-C-O 120.863 0.363 . . . . 63.33 111.936 -178.348 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 59' ' ' TYR . . . . . . . . . . . . . 76.9 t80 -57.56 -41.34 80.84 Favored 'General case' 0 CA--C 1.54 0.596 0 CA-C-O 121.183 0.516 . . . . 61.34 111.59 179.222 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 60' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -74.61 -30.57 61.72 Favored 'General case' 0 N--CA 1.472 0.635 0 CA-C-O 121.381 0.61 . . . . 64.14 110.573 178.857 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 61' ' ' ASP . . . . . . . . . . . . . 8.0 t70 -64.62 -37.16 86.61 Favored 'General case' 0 CA--C 1.541 0.625 0 CA-C-N 115.891 -0.595 . . . . 53.54 111.491 -176.338 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 62' ' ' GLN . . . . . . . . . . . . . 51.5 mt-30 -63.52 -33.97 76.76 Favored 'General case' 0 CA--C 1.541 0.604 0 N-CA-C 112.129 0.418 . . . . 55.23 112.129 178.872 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 63' ' ' ILE . . . . . . . . . . . . . 28.9 pt -103.4 9.88 8.88 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.76 0 N-CA-C 112.524 0.565 . . . . 64.12 112.524 -176.424 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 30.0 t -128.41 130.11 23.55 Favored Pre-proline 0 N--CA 1.475 0.815 0 C-N-CA 122.511 0.324 . . . . 75.43 110.994 -179.886 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 65' ' ' PRO . . . . . . . . . . . . . 10.8 Cg_endo -53.25 114.34 1.7 Allowed 'Trans proline' 0 CA--C 1.541 0.869 0 C-N-CA 122.777 2.318 . . . . 41.51 113.24 -177.482 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 66' ' ' VAL . . . . . . . . . . . . . 35.3 m -88.98 138.62 29.12 Favored Pre-proline 0 CA--C 1.542 0.667 0 N-CA-C 112.584 0.587 . . . . 73.3 112.584 -174.528 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 67' ' ' PRO . . . . . . . . . . . . . 95.7 Cg_endo -87.68 104.1 0.54 Allowed 'Trans proline' 0 CA--C 1.545 1.036 0 C-N-CA 122.979 2.452 . . . . 65.22 112.859 177.026 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 79.87 -69.44 3.06 Favored Glycine 0 CA--C 1.53 1.009 0 C-N-CA 121.225 -0.512 . . . . 60.54 113.233 -179.762 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . 68.2 153.92 0.14 Allowed Pre-proline 0 N--CA 1.478 0.939 0 C-N-CA 123.369 0.668 . . . . 55.11 112.797 178.061 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 70' ' ' PRO . . . . . . . . . . . . . 67.7 Cg_endo -72.63 158.22 51.08 Favored 'Trans proline' 0 CA--C 1.54 0.795 0 C-N-CA 122.439 2.093 . . . . 64.44 112.894 177.327 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 85.0 tttt -98.63 107.52 19.99 Favored 'General case' 0 N--CA 1.467 0.418 0 CA-C-O 120.801 0.334 . . . . 72.11 111.212 -179.055 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -150.13 102.18 3.17 Favored Pre-proline 0 CA--C 1.537 0.46 0 CA-C-O 120.614 0.245 . . . . 71.44 111.58 -179.214 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 73' ' ' PRO . . . . . . . . . . . . . 59.0 Cg_endo -71.35 148.62 55.3 Favored 'Trans proline' 0 CA--C 1.539 0.751 0 C-N-CA 122.467 2.112 . . . . 71.4 112.548 177.859 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -92.53 165.32 13.07 Favored 'General case' 0 CA--C 1.538 0.483 0 CA-C-O 120.919 0.39 . . . . 64.23 111.558 178.698 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.253 1.277 0 CA-C-O 118.667 -0.682 . . . . 63.32 111.507 179.166 . . . . . . . . 0 0 . 1 . 016 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 65.0 mtt . . . . . 0 N--CA 1.494 1.729 0 CA-C-O 120.704 0.288 . . . . 75.13 111.335 . . . . . . . . . 0 0 . 1 . 016 nuclear nobuild full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . 131.8 73.97 0.11 Allowed Glycine 0 CA--C 1.524 0.645 0 C-N-CA 121.097 -0.573 . . . . 62.55 113.053 -179.526 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 3' ' ' HIS . . . . . . . . . . . . . 99.5 m-70 -134.78 150.37 50.53 Favored 'General case' 0 N--CA 1.469 0.511 0 CA-C-O 121.017 0.437 . . . . 74.4 111.441 178.249 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 4' ' ' HIS . . . . . . . . . . . . . 58.3 m-70 -111.12 147.55 34.64 Favored 'General case' 0 N--CA 1.47 0.528 0 CA-C-N 116.287 -0.415 . . . . 72.35 110.962 177.211 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 5' ' ' HIS . . . . . . . . . . . . . 36.4 m80 -74.22 104.41 4.99 Favored 'General case' 0 N--CA 1.467 0.383 0 CA-C-O 121.415 0.626 . . . . 72.31 111.933 179.684 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 50.5 m80 -69.38 81.62 0.38 Allowed 'General case' 0 CA--C 1.538 0.484 0 CA-C-N 115.487 -0.779 . . . . 74.44 111.476 -179.665 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 13.0 p-80 -58.69 135.03 57.31 Favored 'General case' 0 CA--C 1.539 0.554 0 CA-C-N 116.148 -0.478 . . . . 65.34 111.526 176.799 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 8' ' ' HIS . . . . . . . . . . . . . 83.2 t60 -154.89 133.55 12.05 Favored 'General case' 0 CA--C 1.536 0.412 0 CA-C-N 116.408 -0.36 . . . . 75.32 111.418 -178.809 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 36.0 t -126.14 136.75 53.24 Favored 'General case' 0 N--CA 1.471 0.624 0 CA-C-N 116.406 -0.361 . . . . 53.44 110.802 178.262 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 8.1 p80 -68.57 94.85 0.6 Allowed 'General case' 0 CA--C 1.543 0.676 0 CA-C-O 121.583 0.706 . . . . 73.43 110.807 178.721 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 11' ' ' MET . . . . . . . . . . . . . 28.0 ttt -115.6 109.44 17.77 Favored 'General case' 0 CA--C 1.538 0.485 0 CA-C-N 116.121 -0.491 . . . . 65.41 111.905 -176.695 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 75.4 m -114.2 167.83 10.35 Favored 'General case' 0 N--CA 1.47 0.565 0 CA-C-N 116.094 -0.503 . . . . 72.5 110.669 174.1 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 13' ' ' THR . . . . . . . . . . . . . 68.8 p -100.01 135.94 20.28 Favored Pre-proline 0 N--CA 1.468 0.461 0 CA-C-N 116.641 -0.254 . . . . 64.1 110.722 176.977 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 14' ' ' PRO . . . . . . . . . . . . . 38.4 Cg_endo -66.06 124.09 12.15 Favored 'Trans proline' 0 CA--C 1.539 0.736 0 C-N-CA 122.436 2.09 . . . . 45.45 112.825 179.433 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 1.9 pp -70.69 158.31 36.48 Favored 'General case' 0 CA--C 1.541 0.623 0 CA-C-O 121.103 0.478 . . . . 71.24 111.953 178.064 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 16' ' ' THR . . . . . . . . . . . . . 48.8 m -84.85 -54.87 4.39 Favored 'General case' 0 N--CA 1.473 0.719 0 CA-C-O 120.99 0.424 . . . . 62.32 112.102 -176.975 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . 80.72 -149.94 30.59 Favored Glycine 0 CA--C 1.53 0.972 0 C-N-CA 121.129 -0.558 . . . . 64.12 112.357 -174.835 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 37.4 mtmm -112.23 100.32 49.13 Favored Pre-proline 0 CA--C 1.54 0.56 0 O-C-N 122.382 -0.481 . . . . 75.23 111.552 178.704 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 1.3 Cg_endo -85.66 -160.17 0.11 Allowed 'Trans proline' 0 CA--C 1.536 0.59 0 C-N-CA 122.902 2.401 . . . . 74.14 112.066 174.246 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . 168.71 -102.59 0.19 Allowed Glycine 0 CA--C 1.523 0.574 0 C-N-CA 120.5 -0.857 . . . . 53.01 113.045 176.658 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -97.59 179.75 4.74 Favored 'General case' 0 CA--C 1.538 0.507 0 CA-C-O 121.248 0.547 . . . . 71.42 111.903 -177.005 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 22' ' ' LEU . . . . . 0.449 HD13 ' HB3' ' A' ' 56' ' ' LEU . 94.3 mt -127.0 137.67 31.09 Favored Pre-proline 0 CA--C 1.538 0.501 0 CA-C-N 116.195 -0.457 . . . . 71.44 110.61 178.983 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 23' ' ' PRO . . . . . 0.468 ' O ' ' HG ' ' A' ' 26' ' ' LEU . 37.8 Cg_endo -64.92 139.22 60.96 Favored 'Trans proline' 0 CA--C 1.54 0.805 0 C-N-CA 122.605 2.204 . . . . 64.11 113.134 -178.386 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -72.15 -2.83 20.12 Favored 'General case' 0 CA--C 1.543 0.694 0 CA-C-O 121.04 0.448 . . . . 71.51 111.874 179.124 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 11.2 m120 -82.54 18.73 1.42 Allowed 'General case' 0 CA--C 1.542 0.658 0 N-CA-C 112.183 0.438 . . . . 73.13 112.183 -178.768 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 26' ' ' LEU . . . . . 0.468 ' HG ' ' O ' ' A' ' 23' ' ' PRO . 90.7 mt -58.18 -40.12 80.67 Favored 'General case' 0 N--CA 1.471 0.612 0 CA-C-O 120.842 0.353 . . . . 70.11 111.84 -178.632 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 7.3 m-20 -63.28 -34.81 78.49 Favored 'General case' 0 CA--C 1.539 0.534 0 CA-C-O 120.978 0.418 . . . . 71.15 111.206 175.283 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 36.6 t70 -72.45 -42.55 64.89 Favored 'General case' 0 CA--C 1.542 0.66 0 CA-C-N 116.255 -0.43 . . . . 74.52 111.533 -178.649 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 29' ' ' MET . . . . . . . . . . . . . 50.2 mtm -68.92 159.81 31.95 Favored 'General case' 0 N--CA 1.471 0.606 0 CA-C-O 121.092 0.472 . . . . 71.23 111.608 179.279 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 54.5 mtpt -88.9 171.43 9.91 Favored 'General case' 0 CA--C 1.54 0.583 0 N-CA-C 112.689 0.626 . . . . 73.25 112.689 -173.623 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 31' ' ' VAL . . . . . 0.474 HG22 ' HD3' ' A' ' 49' ' ' LYS . 86.5 t -56.66 -47.89 81.59 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.615 0 CA-C-N 115.798 -0.637 . . . . 41.11 112.372 -176.74 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -58.67 -38.52 78.37 Favored 'General case' 0 CA--C 1.536 0.426 0 CA-C-N 116.448 -0.342 . . . . 53.25 111.871 -179.353 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 37.4 mt-10 -69.73 -41.86 74.73 Favored 'General case' 0 CA--C 1.537 0.469 0 CA-C-O 121.114 0.483 . . . . 73.44 111.192 179.42 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 95.4 mt -63.34 -47.21 83.11 Favored 'General case' 0 CA--C 1.54 0.559 0 CA-C-N 116.346 -0.388 . . . . 52.43 111.305 178.171 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 35' ' ' LYS . . . . . 0.473 ' HE2' ' O ' ' A' ' 45' ' ' VAL . 98.5 mttt -61.31 -35.66 77.98 Favored 'General case' 0 CA--C 1.537 0.464 0 CA-C-N 116.577 -0.283 . . . . 72.01 111.513 177.598 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 36' ' ' GLN . . . . . 0.499 ' NE2' HD11 ' A' ' 40' ' ' LEU . 22.4 tm0? -60.59 -44.52 96.16 Favored 'General case' 0 CA--C 1.539 0.536 0 CA-C-O 120.868 0.366 . . . . 72.13 110.771 177.38 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 37' ' ' GLU . . . . . 0.594 ' HB3' ' NH2' ' A' ' 41' ' ' ARG . 24.8 mm-40 -64.31 -41.03 97.03 Favored 'General case' 0 CA--C 1.543 0.698 0 CA-C-N 116.329 -0.396 . . . . 74.23 111.884 175.04 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 38' ' ' LEU . . . . . 0.482 ' HB2' HG12 ' A' ' 45' ' ' VAL . 88.5 mt -62.24 -56.01 22.81 Favored 'General case' 0 N--CA 1.472 0.628 0 N-CA-C 112.164 0.431 . . . . 70.34 112.164 179.552 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 18.6 ptpt -57.03 -34.75 68.52 Favored 'General case' 0 N--CA 1.473 0.683 0 N-CA-C 112.582 0.586 . . . . 75.11 112.582 -174.475 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 40' ' ' LEU . . . . . 0.499 HD11 ' NE2' ' A' ' 36' ' ' GLN . 92.7 mt -63.55 -33.5 75.72 Favored 'General case' 0 N--CA 1.473 0.679 0 CA-C-O 120.904 0.383 . . . . 70.53 111.694 177.91 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 41' ' ' ARG . . . . . 0.764 HH21 HD22 ' A' ' 56' ' ' LEU . 70.0 mtm-85 -105.69 23.11 14.4 Favored 'General case' 0 CA--C 1.54 0.565 0 CA-C-N 116.44 -0.346 . . . . 71.42 111.923 -178.013 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 23.2 t 64.48 22.81 12.79 Favored 'General case' 0 N--CA 1.478 0.959 0 N-CA-C 112.317 0.488 . . . . 64.22 112.317 173.134 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 72.5 mt -92.12 134.39 28.65 Favored Pre-proline 0 CA--C 1.546 0.805 0 CA-C-N 116.626 -0.261 . . . . 62.21 111.611 -178.482 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 44' ' ' PRO . . . . . 0.513 ' HD2' ' HD3' ' A' ' 55' ' ' ARG . 77.8 Cg_exo -52.06 115.37 2.12 Favored 'Trans proline' 0 C--N 1.356 0.949 0 C-N-CA 122.994 2.463 . . . . 53.31 113.71 178.638 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 45' ' ' VAL . . . . . 0.482 HG12 ' HB2' ' A' ' 38' ' ' LEU . 33.0 m -85.5 -10.77 11.4 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.608 0 N-CA-C 112.523 0.564 . . . . 71.45 112.523 -178.955 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 33.2 t -80.9 32.3 0.32 Allowed 'General case' 0 N--CA 1.481 1.1 0 N-CA-C 113.064 0.764 . . . . 70.03 113.064 -173.424 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . -107.8 176.45 20.67 Favored Glycine 0 CA--C 1.527 0.833 0 C-N-CA 121.028 -0.606 . . . . 72.24 113.471 179.459 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 48' ' ' THR . . . . . 0.556 ' O ' ' HG ' ' A' ' 52' ' ' LEU . 72.3 p -76.31 163.14 27.3 Favored 'General case' 0 N--CA 1.475 0.812 0 O-C-N 122.668 -0.313 . . . . 72.44 111.372 176.829 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 49' ' ' LYS . . . . . 0.474 ' HD3' HG22 ' A' ' 31' ' ' VAL . 29.6 tptp -44.37 -44.24 8.14 Favored 'General case' 0 N--CA 1.473 0.721 0 CA-C-O 120.962 0.41 . . . . 63.24 111.795 178.169 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 50' ' ' THR . . . . . . . . . . . . . 30.5 m -68.2 -44.79 75.06 Favored 'General case' 0 CA--C 1.538 0.504 0 CA-C-N 116.213 -0.449 . . . . 65.32 111.675 179.037 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 44.0 mt-10 -60.7 -42.47 97.24 Favored 'General case' 0 N--CA 1.471 0.611 0 N-CA-C 111.952 0.352 . . . . 71.2 111.952 179.446 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 52' ' ' LEU . . . . . 0.556 ' HG ' ' O ' ' A' ' 48' ' ' THR . 46.7 mt -54.81 -39.2 68.26 Favored 'General case' 0 N--CA 1.469 0.523 0 CA-C-O 121.504 0.669 . . . . 75.12 110.325 178.457 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 53' ' ' ILE . . . . . . . . . . . . . 88.5 mt -70.25 -58.09 6.34 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.517 0 CA-C-N 115.184 -0.916 . . . . 70.44 111.911 179.287 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 40.6 mt-10 -61.29 -31.7 71.53 Favored 'General case' 0 N--CA 1.468 0.469 0 N-CA-C 111.897 0.332 . . . . 53.34 111.897 -178.019 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 55' ' ' ARG . . . . . 0.513 ' HD3' ' HD2' ' A' ' 44' ' ' PRO . 35.2 ttm180 -65.53 -41.22 93.3 Favored 'General case' 0 CA--C 1.538 0.486 0 CA-C-O 120.76 0.314 . . . . 65.41 111.258 177.187 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 56' ' ' LEU . . . . . 0.764 HD22 HH21 ' A' ' 41' ' ' ARG . 79.6 mt -63.72 -47.7 80.07 Favored 'General case' 0 CA--C 1.537 0.46 0 CA-C-O 121.023 0.44 . . . . 52.01 111.043 174.015 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 74.6 mtp180 -61.67 -43.12 99.45 Favored 'General case' 0 CA--C 1.54 0.583 0 CA-C-N 116.098 -0.501 . . . . 72.12 111.466 179.328 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -64.8 -39.51 93.71 Favored 'General case' 0 N--CA 1.469 0.507 0 CA-C-N 116.419 -0.355 . . . . 33.01 111.673 179.456 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 59' ' ' TYR . . . . . . . . . . . . . 84.8 t80 -64.56 -47.29 79.28 Favored 'General case' 0 CA--C 1.537 0.468 0 CA-C-O 120.977 0.418 . . . . 71.32 110.677 176.371 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 60' ' ' GLN . . . . . . . . . . . . . 8.4 tp-100 -60.15 -41.35 92.56 Favored 'General case' 0 CA--C 1.54 0.564 0 CA-C-O 121.092 0.472 . . . . 73.41 110.914 176.664 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 61' ' ' ASP . . . . . . . . . . . . . 26.9 t70 -59.86 -49.4 77.87 Favored 'General case' 0 CA--C 1.543 0.704 0 CA-C-N 115.895 -0.593 . . . . 65.44 111.959 179.863 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 62' ' ' GLN . . . . . . . . . . . . . 10.8 pt20 -70.82 -25.82 63.02 Favored 'General case' 0 CA--C 1.542 0.64 0 N-CA-C 112.681 0.623 . . . . 65.2 112.681 -176.573 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 63' ' ' ILE . . . . . . . . . . . . . 32.5 pt -90.26 -18.01 7.76 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.771 0 O-C-N 121.917 -0.489 . . . . 75.51 111.872 179.124 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 64' ' ' SER . . . . . 0.415 ' HA ' ' HD3' ' A' ' 65' ' ' PRO . 38.1 t -90.13 129.13 46.95 Favored Pre-proline 0 N--CA 1.471 0.614 0 CA-C-O 120.546 0.212 . . . . 73.52 111.229 178.842 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 65' ' ' PRO . . . . . 0.415 ' HD3' ' HA ' ' A' ' 64' ' ' SER . 24.6 Cg_exo -63.42 88.08 0.13 Allowed 'Trans proline' 0 CA--C 1.539 0.761 0 C-N-CA 122.4 2.066 . . . . 64.14 112.654 178.652 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 66' ' ' VAL . . . . . . . . . . . . . 27.0 m -116.92 146.64 38.34 Favored Pre-proline 0 CA--C 1.541 0.599 0 CA-C-N 116.513 -0.312 . . . . 72.15 111.585 -179.351 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 67' ' ' PRO . . . . . . . . . . . . . 52.8 Cg_exo -53.51 -48.24 22.99 Favored 'Trans proline' 0 C--N 1.354 0.822 0 C-N-CA 122.617 2.211 . . . . 74.52 112.554 178.512 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . -84.46 35.66 3.0 Favored Glycine 0 CA--C 1.527 0.815 0 C-N-CA 121.379 -0.439 . . . . 71.45 113.467 179.445 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . -58.43 153.24 39.77 Favored Pre-proline 0 CA--C 1.541 0.612 0 O-C-N 122.751 -0.264 . . . . 54.33 111.557 177.669 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 70' ' ' PRO . . . . . . . . . . . . . 19.6 Cg_endo -57.14 151.28 51.93 Favored 'Trans proline' 0 CA--C 1.54 0.79 0 C-N-CA 122.404 2.069 . . . . 71.02 112.74 179.454 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 26.4 ttpp -70.67 -19.82 62.75 Favored 'General case' 0 CA--C 1.541 0.597 0 CA-C-O 121.156 0.503 . . . . 72.35 111.029 178.895 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 72' ' ' ALA . . . . . 0.482 ' HA ' ' HD3' ' A' ' 73' ' ' PRO . . . -71.1 126.91 92.04 Favored Pre-proline 0 CA--C 1.543 0.691 0 CA-C-N 116.229 -0.441 . . . . 63.21 111.378 175.634 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 73' ' ' PRO . . . . . 0.482 ' HD3' ' HA ' ' A' ' 72' ' ' ALA . 15.8 Cg_exo -69.07 174.37 9.01 Favored 'Trans proline' 0 CA--C 1.542 0.904 0 C-N-CA 122.698 2.265 . . . . 55.42 113.395 -179.478 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -61.86 137.77 58.28 Favored 'General case' 0 CA--C 1.538 0.492 0 CA-C-O 120.915 0.388 . . . . 33.4 111.834 178.919 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.255 1.374 0 CA-C-O 118.999 -0.525 . . . . 73.42 111.782 -179.102 . . . . . . . . 0 0 . 1 . 017 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . 0.461 ' SD ' ' C ' ' A' ' 1' ' ' MET . 0.0 OUTLIER . . . . . 0 N--CA 1.49 1.567 0 CA-C-O 120.983 0.421 . . . . 45.4 111.788 . . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . 103.78 -172.94 21.37 Favored Glycine 0 CA--C 1.527 0.793 0 C-N-CA 121.241 -0.504 . . . . 73.44 113.085 -177.712 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 3' ' ' HIS . . . . . . . . . . . . . 79.6 t60 -154.21 -50.87 0.09 Allowed 'General case' 0 N--CA 1.467 0.379 0 CA-C-O 121.13 0.49 . . . . 73.1 110.726 179.19 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 4' ' ' HIS . . . . . . . . . . . . . 78.2 t60 -146.38 114.9 6.76 Favored 'General case' 0 CA--C 1.538 0.486 0 CA-C-N 116.143 -0.48 . . . . 74.44 110.535 177.417 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 5' ' ' HIS . . . . . . . . . . . . . 42.8 m80 -73.83 100.31 3.43 Favored 'General case' 0 CA--C 1.538 0.481 0 CA-C-O 121.042 0.448 . . . . 73.01 111.684 -175.368 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 83.5 t60 -75.34 103.63 5.57 Favored 'General case' 0 CA--C 1.538 0.513 0 CA-C-O 121.001 0.429 . . . . 71.04 110.409 176.963 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 72.2 m80 -67.66 140.4 56.82 Favored 'General case' 0 CA--C 1.538 0.498 0 CA-C-N 116.237 -0.438 . . . . 73.13 111.901 -176.686 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 8' ' ' HIS . . . . . . . . . . . . . 57.0 m-70 -71.55 93.65 1.23 Allowed 'General case' 0 N--CA 1.471 0.595 0 CA-C-O 121.29 0.566 . . . . 64.43 111.859 -179.566 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 21.1 m -97.94 149.42 22.44 Favored 'General case' 0 N--CA 1.469 0.484 0 CA-C-N 115.869 -0.605 . . . . 73.05 110.919 178.228 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 32.2 p-80 -110.97 143.1 42.17 Favored 'General case' 0 N--CA 1.472 0.654 0 CA-C-O 120.481 0.181 . . . . 71.23 111.231 179.553 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 11' ' ' MET . . . . . . . . . . . . . 21.5 ptp -167.68 170.79 10.69 Favored 'General case' 0 N--CA 1.47 0.575 0 N-CA-C 112.449 0.537 . . . . 73.21 112.449 -177.238 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 94.1 p 54.63 26.58 7.56 Favored 'General case' 0 N--CA 1.478 0.939 0 N-CA-C 113.402 0.89 . . . . 71.3 113.402 176.233 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 13' ' ' THR . . . . . 0.475 ' HA ' ' HD3' ' A' ' 14' ' ' PRO . 80.8 p -73.93 130.01 83.86 Favored Pre-proline 0 N--CA 1.473 0.712 0 O-C-N 122.037 -0.414 . . . . 73.44 111.32 179.186 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 14' ' ' PRO . . . . . 0.475 ' HD3' ' HA ' ' A' ' 13' ' ' THR . 9.2 Cg_exo -73.29 24.4 0.31 Allowed 'Trans proline' 0 CA--C 1.549 1.241 0 C-N-CA 123.472 2.781 . . . . 54.31 114.958 -174.766 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 7.1 mp 59.33 -175.65 0.1 Allowed 'General case' 0 CA--C 1.546 0.825 0 CA-C-O 121.636 0.731 . . . . 74.3 112.928 177.362 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 16' ' ' THR . . . . . . . . . . . . . 44.4 p -127.03 106.93 9.61 Favored 'General case' 0 N--CA 1.472 0.675 0 CA-C-N 115.641 -0.709 . . . . 71.31 110.992 178.322 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . -105.19 -175.22 24.36 Favored Glycine 0 CA--C 1.528 0.874 0 C-N-CA 121.15 -0.548 . . . . 33.24 113.606 -177.214 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 6.2 ptpp? -130.71 153.64 81.61 Favored Pre-proline 0 CA--C 1.542 0.642 0 O-C-N 122.653 -0.322 . . . . 74.4 111.577 179.564 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 90.9 Cg_endo -91.32 127.66 1.13 Allowed 'Trans proline' 0 CA--C 1.543 0.961 0 C-N-CA 122.831 2.354 . . . . 74.1 112.315 170.556 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . -79.33 48.01 3.31 Favored Glycine 0 CA--C 1.53 0.998 0 C-N-CA 121.152 -0.547 . . . . 75.14 113.904 -178.832 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -177.06 173.33 1.84 Allowed 'General case' 0 N--CA 1.469 0.512 0 C-N-CA 122.738 0.415 . . . . 74.43 110.843 -179.376 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 22' ' ' LEU . . . . . 0.489 ' HB3' HD11 ' A' ' 26' ' ' LEU . 59.0 mt -92.16 137.9 24.72 Favored Pre-proline 0 N--CA 1.469 0.486 0 CA-C-O 120.685 0.279 . . . . 73.45 111.714 178.046 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 23' ' ' PRO . . . . . 0.477 ' O ' ' HG ' ' A' ' 26' ' ' LEU . 53.6 Cg_exo -54.74 143.3 70.71 Favored 'Trans proline' 0 CA--C 1.541 0.833 0 C-N-CA 122.68 2.253 . . . . 74.23 112.523 173.899 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -72.02 -23.47 61.4 Favored 'General case' 0 CA--C 1.538 0.51 0 N-CA-C 112.36 0.504 . . . . 63.11 112.36 -177.547 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 25' ' ' ASN . . . . . 0.561 ' HB3' ' HB3' ' A' ' 28' ' ' ASP . 47.8 m-80 -102.13 27.13 6.91 Favored 'General case' 0 CA--C 1.543 0.702 0 N-CA-C 113.063 0.764 . . . . 75.15 113.063 -175.964 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 26' ' ' LEU . . . . . 0.489 HD11 ' HB3' ' A' ' 22' ' ' LEU . 71.5 mt -49.83 -42.37 47.13 Favored 'General case' 0 N--CA 1.479 1.017 0 CA-C-O 120.976 0.417 . . . . 65.12 111.973 177.738 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 3.7 m-20 -66.81 -35.11 79.31 Favored 'General case' 0 CA--C 1.543 0.676 0 CA-C-O 121.13 0.49 . . . . 75.22 111.286 178.402 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 28' ' ' ASP . . . . . 0.561 ' HB3' ' HB3' ' A' ' 25' ' ' ASN . 21.5 t70 -73.07 -31.49 64.42 Favored 'General case' 0 CA--C 1.542 0.649 0 CA-C-N 116.18 -0.464 . . . . 63.43 111.239 -179.732 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 29' ' ' MET . . . . . 0.463 ' HG3' ' O ' ' A' ' 25' ' ' ASN . 86.9 mtp -63.84 156.31 27.85 Favored 'General case' 0 CA--C 1.541 0.604 0 CA-C-O 121.434 0.635 . . . . 52.55 112.288 -177.531 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 30' ' ' LYS . . . . . 0.454 ' HB2' ' HG3' ' A' ' 33' ' ' GLU . 55.3 mtpt -80.82 157.78 25.62 Favored 'General case' 0 CA--C 1.538 0.515 0 CA-C-N 116.012 -0.54 . . . . 74.14 111.836 -178.643 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 31' ' ' VAL . . . . . 0.584 HG22 ' HB2' ' A' ' 49' ' ' LYS . 16.0 t -52.14 -50.77 34.61 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.614 0 CA-C-N 115.961 -0.563 . . . . 74.14 112.188 -176.61 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -64.1 -27.69 69.26 Favored 'General case' 0 CA--C 1.539 0.546 0 N-CA-C 112.435 0.532 . . . . 75.42 112.435 -179.714 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 33' ' ' GLU . . . . . 0.454 ' HG3' ' HB2' ' A' ' 30' ' ' LYS . 40.6 mt-10 -72.92 -42.36 63.6 Favored 'General case' 0 N--CA 1.469 0.51 0 CA-C-O 120.899 0.381 . . . . 74.44 110.809 179.248 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 84.8 mt -59.94 -35.22 74.46 Favored 'General case' 0 N--CA 1.469 0.522 0 CA-C-O 121.308 0.575 . . . . 65.41 110.805 174.898 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 35' ' ' LYS . . . . . 0.499 ' HE3' HG12 ' A' ' 31' ' ' VAL . 99.3 mttt -64.89 -30.14 71.12 Favored 'General case' 0 CA--C 1.537 0.473 0 CA-C-N 115.998 -0.546 . . . . 62.32 111.668 176.262 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 57.2 tp60 -66.73 -44.15 82.32 Favored 'General case' 0 CA--C 1.539 0.545 0 CA-C-O 120.934 0.397 . . . . 72.4 110.402 173.954 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 14.1 mm-40 -54.8 -51.9 64.34 Favored 'General case' 0 N--CA 1.471 0.575 0 CA-C-O 121.425 0.631 . . . . 65.31 110.895 173.887 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 38' ' ' LEU . . . . . 0.452 ' CD1' HD22 ' A' ' 52' ' ' LEU . 90.6 mt -58.74 -53.46 58.08 Favored 'General case' 0 CA--C 1.541 0.628 0 N-CA-C 113.207 0.817 . . . . 61.11 113.207 -176.773 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 18.2 ptpt -59.09 -33.67 71.1 Favored 'General case' 0 N--CA 1.474 0.768 0 N-CA-C 112.511 0.559 . . . . 72.11 112.511 -174.462 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 97.4 mt -67.8 -10.83 56.16 Favored 'General case' 0 N--CA 1.471 0.603 0 CA-C-O 121.072 0.463 . . . . 75.22 111.532 178.264 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 41' ' ' ARG . . . . . . . . . . . . . 33.8 mtt180 -123.1 15.77 9.91 Favored 'General case' 0 CA--C 1.54 0.564 0 CA-C-N 116.182 -0.463 . . . . 75.54 111.121 -177.058 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 69.8 m 60.85 31.56 20.04 Favored 'General case' 0 N--CA 1.476 0.862 0 CA-C-N 116.192 -0.458 . . . . 45.43 111.868 -179.224 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 43' ' ' LEU . . . . . 0.404 ' HB3' HD22 ' A' ' 38' ' ' LEU . 83.7 mt -98.6 137.2 20.61 Favored Pre-proline 0 CA--C 1.543 0.676 0 CA-C-N 116.488 -0.324 . . . . 74.42 111.378 179.443 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 44' ' ' PRO . . . . . . . . . . . . . 32.0 Cg_endo -64.06 130.12 26.42 Favored 'Trans proline' 0 CA--C 1.543 0.971 0 C-N-CA 122.941 2.427 . . . . 72.41 113.122 -178.746 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 45' ' ' VAL . . . . . 0.415 HG12 ' HB2' ' A' ' 38' ' ' LEU . 23.0 m -102.34 15.04 5.69 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.725 0 CA-C-N 115.953 -0.567 . . . . 71.2 112.027 -176.154 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 29.6 t -68.47 -43.12 77.68 Favored 'General case' 0 N--CA 1.474 0.733 0 N-CA-C 113.479 0.918 . . . . 73.51 113.479 -174.053 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . -71.52 179.97 32.41 Favored Glycine 0 CA--C 1.528 0.903 0 N-CA-C 115.393 0.917 . . . . 43.14 115.393 -170.898 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 48' ' ' THR . . . . . 0.575 ' O ' ' HG ' ' A' ' 52' ' ' LEU . 69.4 p -77.05 170.6 16.24 Favored 'General case' 0 N--CA 1.471 0.582 0 C-N-CA 122.86 0.464 . . . . 74.43 111.647 178.365 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 49' ' ' LYS . . . . . 0.584 ' HB2' HG22 ' A' ' 31' ' ' VAL . 88.2 tttt -50.53 -51.82 44.25 Favored 'General case' 0 N--CA 1.47 0.563 0 N-CA-C 112.41 0.522 . . . . 75.43 112.41 -176.794 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 50' ' ' THR . . . . . . . . . . . . . 91.5 m -54.9 -44.77 74.43 Favored 'General case' 0 N--CA 1.471 0.6 0 CA-C-O 120.79 0.329 . . . . 71.13 111.141 178.157 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 49.3 mt-10 -59.38 -42.25 91.25 Favored 'General case' 0 N--CA 1.47 0.554 0 CA-C-O 120.973 0.416 . . . . 63.23 111.319 177.066 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 52' ' ' LEU . . . . . 0.575 ' HG ' ' O ' ' A' ' 48' ' ' THR . 32.9 mt -65.38 -47.04 77.73 Favored 'General case' 0 CA--C 1.539 0.545 0 CA-C-N 116.312 -0.404 . . . . 64.43 111.141 -179.655 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 53' ' ' ILE . . . . . . . . . . . . . 66.9 mt -58.14 -50.46 78.16 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.545 0 CA-C-O 120.84 0.352 . . . . 71.51 111.117 178.235 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 47.3 mt-10 -58.35 -41.81 85.52 Favored 'General case' 0 CA--C 1.536 0.413 0 CA-C-N 116.347 -0.388 . . . . 73.33 111.181 177.702 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 41.7 ttm180 -63.3 -40.19 96.67 Favored 'General case' 0 CA--C 1.543 0.703 0 CA-C-N 116.586 -0.279 . . . . 63.42 111.471 178.592 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 78.9 mt -62.13 -51.27 68.54 Favored 'General case' 0 N--CA 1.47 0.544 0 CA-C-O 121.098 0.475 . . . . 53.33 111.366 175.113 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 55.1 mtt180 -74.4 -18.42 60.66 Favored 'General case' 0 CA--C 1.542 0.639 0 CA-C-N 116.268 -0.424 . . . . 70.24 111.999 -178.267 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -76.03 -42.68 47.12 Favored 'General case' 0 N--CA 1.468 0.464 0 CA-C-O 121.162 0.505 . . . . 74.34 110.333 170.596 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 59' ' ' TYR . . . . . . . . . . . . . 48.6 t80 -62.91 -27.35 69.31 Favored 'General case' 0 CA--C 1.54 0.577 0 CA-C-N 115.932 -0.576 . . . . 70.41 110.452 175.32 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 60' ' ' GLN . . . . . 0.478 ' HB2' HD11 ' A' ' 22' ' ' LEU . 8.4 tp-100 -76.45 -40.43 50.53 Favored 'General case' 0 CA--C 1.542 0.635 0 CA-C-N 115.919 -0.582 . . . . 65.52 111.664 177.009 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 61' ' ' ASP . . . . . . . . . . . . . 26.8 t70 -56.44 -26.66 54.38 Favored 'General case' 0 CA--C 1.547 0.837 0 N-CA-C 112.211 0.448 . . . . 63.32 112.211 -176.888 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 62' ' ' GLN . . . . . . . . . . . . . 14.1 pt20 -91.8 -0.3 57.52 Favored 'General case' 0 CA--C 1.546 0.797 0 N-CA-C 112.345 0.498 . . . . 74.22 112.345 -178.791 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 63' ' ' ILE . . . . . . . . . . . . . 32.3 pt -135.92 -0.14 0.97 Allowed 'Isoleucine or valine' 0 N--CA 1.476 0.856 0 N-CA-C 112.352 0.501 . . . . 75.44 112.352 178.631 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 64' ' ' SER . . . . . 0.467 ' HB2' ' HG3' ' A' ' 60' ' ' GLN . 47.8 t -85.49 137.81 36.36 Favored Pre-proline 0 N--CA 1.474 0.744 0 N-CA-C 112.175 0.435 . . . . 74.43 112.175 -175.877 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 65' ' ' PRO . . . . . . . . . . . . . 60.6 Cg_endo -73.73 90.83 0.92 Allowed 'Trans proline' 0 CA--C 1.54 0.79 0 C-N-CA 122.29 1.993 . . . . 61.14 112.071 173.165 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 66' ' ' VAL . . . . . . . . . . . . . 34.3 m -72.03 145.54 88.97 Favored Pre-proline 0 CA--C 1.545 0.753 0 N-CA-C 112.31 0.485 . . . . 73.31 112.31 -177.128 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 67' ' ' PRO . . . . . . . . . . . . . 33.3 Cg_exo -60.33 -57.93 0.63 Allowed 'Trans proline' 0 CA--C 1.541 0.873 0 C-N-CA 122.739 2.292 . . . . 74.35 112.921 174.817 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . -138.32 -41.14 0.1 OUTLIER Glycine 0 CA--C 1.526 0.757 0 C-N-CA 121.117 -0.563 . . . . 70.22 113.594 -178.949 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . 68.23 151.64 0.13 Allowed Pre-proline 0 CA--C 1.544 0.739 0 C-N-CA 122.75 0.42 . . . . 52.42 111.828 -178.055 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 70' ' ' PRO . . . . . 0.472 ' HB2' ' HG3' ' A' ' 73' ' ' PRO . 87.8 Cg_exo -48.43 110.73 0.36 Allowed 'Trans proline' 0 CA--C 1.542 0.923 0 C-N-CA 122.73 2.287 . . . . 74.31 113.625 179.902 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 71' ' ' LYS . . . . . 0.473 ' NZ ' ' HB2' ' A' ' 71' ' ' LYS . 2.7 ttmp? -72.65 105.38 4.24 Favored 'General case' 0 CA--C 1.537 0.46 0 CA-C-N 116.379 -0.373 . . . . 65.11 110.598 177.173 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . 55.9 76.23 0.52 Allowed Pre-proline 0 CA--C 1.543 0.704 0 CA-C-N 116.151 -0.477 . . . . 73.23 111.231 -174.009 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 73' ' ' PRO . . . . . 0.472 ' HG3' ' HB2' ' A' ' 70' ' ' PRO . 51.9 Cg_exo -54.26 80.43 0.03 OUTLIER 'Trans proline' 0 CA--C 1.543 0.931 0 C-N-CA 123.402 2.735 . . . . 64.35 114.272 -172.993 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . 50.76 27.56 3.12 Favored 'General case' 0 CA--C 1.541 0.603 0 C-N-CA 123.22 0.608 . . . . 72.43 112.576 177.349 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.252 1.222 0 CA-C-O 118.922 -0.561 . . . . 52.14 112.276 -178.465 . . . . . . . . 0 0 . 1 . 018 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 44.0 tpp . . . . . 0 N--CA 1.487 1.425 0 CA-C-O 120.919 0.39 . . . . 73.02 111.52 . . . . . . . . . 0 0 . 1 . 018 nuclear nobuild full ' A' A ' 2' ' ' GLY . . . . . 0.479 ' HA3' ' HE1' ' A' ' 5' ' ' HIS . . . 82.24 56.92 2.74 Favored Glycine 0 CA--C 1.53 1.002 0 C-N-CA 121.069 -0.586 . . . . 60.51 114.448 174.641 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 3' ' ' HIS . . . . . . . . . . . . . 10.3 p80 42.31 -75.59 0.0 OUTLIER 'General case' 0 N--CA 1.487 1.41 0 N-CA-C 115.27 1.581 . . . . 63.45 115.27 172.205 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 4' ' ' HIS . . . . . 0.463 ' N ' ' O ' ' A' ' 2' ' ' GLY . 67.4 t60 -131.86 121.24 23.75 Favored 'General case' 0 N--CA 1.472 0.664 0 O-C-N 121.94 -0.475 . . . . 74.52 111.58 -172.534 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 5' ' ' HIS . . . . . 0.479 ' HE1' ' HA3' ' A' ' 2' ' ' GLY . 31.9 m80 -142.06 74.66 1.46 Allowed 'General case' 0 N--CA 1.476 0.838 0 N-CA-C 112.288 0.477 . . . . 64.22 112.288 177.913 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 2.9 p80 177.48 115.42 0.03 OUTLIER 'General case' 0 N--CA 1.476 0.873 0 C-N-CA 123.394 0.677 . . . . 61.33 110.315 173.957 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 7.5 p-80 -109.21 -175.48 2.77 Favored 'General case' 0 N--CA 1.472 0.656 0 CA-C-O 121.09 0.471 . . . . 53.21 112.138 -176.787 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 8' ' ' HIS . . . . . . . . . . . . . 13.9 p80 -137.79 114.51 10.53 Favored 'General case' 0 N--CA 1.471 0.581 0 CA-C-N 116.351 -0.386 . . . . 71.1 111.045 176.745 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 77.4 p -101.56 173.71 6.3 Favored 'General case' 0 N--CA 1.474 0.759 0 CA-C-O 121.114 0.483 . . . . 74.51 111.834 -176.672 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 26.7 p-80 -135.09 92.84 2.92 Favored 'General case' 0 CA--C 1.543 0.676 0 CA-C-O 120.932 0.396 . . . . 73.51 111.732 178.786 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 11' ' ' MET . . . . . . . . . . . . . 62.9 mtt -92.17 140.36 29.7 Favored 'General case' 0 N--CA 1.472 0.674 0 CA-C-N 116.568 -0.287 . . . . 65.33 111.082 177.601 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 40.6 t -90.8 -33.85 15.54 Favored 'General case' 0 N--CA 1.473 0.713 0 N-CA-C 112.021 0.378 . . . . 64.04 112.021 -179.589 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 13' ' ' THR . . . . . . . . . . . . . 13.3 p 62.96 143.74 0.07 OUTLIER Pre-proline 0 N--CA 1.483 1.221 0 C-N-CA 123.992 0.917 . . . . 74.21 112.402 -177.627 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 14' ' ' PRO . . . . . . . . . . . . . 52.4 Cg_exo -55.6 164.02 4.7 Favored 'Trans proline' 0 CA--C 1.544 0.979 0 C-N-CA 122.766 2.311 . . . . 72.42 113.848 -178.928 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 15' ' ' LEU . . . . . 0.449 HD23 ' H ' ' A' ' 15' ' ' LEU . 1.1 pt? -120.88 164.09 17.2 Favored 'General case' 0 CA--C 1.536 0.419 0 CA-C-O 120.909 0.385 . . . . 73.25 111.32 179.596 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 16' ' ' THR . . . . . . . . . . . . . 71.3 p -68.84 113.82 6.62 Favored 'General case' 0 N--CA 1.471 0.619 0 N-CA-C 112.884 0.698 . . . . 70.11 112.884 -174.175 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . -72.88 125.94 10.21 Favored Glycine 0 CA--C 1.525 0.662 0 N-CA-C 111.562 -0.615 . . . . 74.13 111.562 172.136 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 19.2 pttm -160.34 146.83 11.9 Favored Pre-proline 0 CA--C 1.538 0.512 0 N-CA-C 112.092 0.404 . . . . 72.14 112.092 -170.662 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 72.2 Cg_endo -77.38 117.95 4.49 Favored 'Trans proline' 0 CA--C 1.541 0.85 0 C-N-CA 122.347 2.031 . . . . 74.33 111.923 172.007 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . -53.11 -36.42 51.93 Favored Glycine 0 CA--C 1.527 0.841 0 C-N-CA 121.28 -0.486 . . . . 74.32 113.045 -179.821 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -145.05 169.96 17.11 Favored 'General case' 0 CA--C 1.536 0.434 0 CA-C-O 120.778 0.323 . . . . 44.33 110.787 176.389 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 92.1 mt -98.39 152.43 37.94 Favored Pre-proline 0 CA--C 1.541 0.602 0 CA-C-N 116.717 -0.22 . . . . 75.24 110.989 179.3 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 23' ' ' PRO . . . . . . . . . . . . . 19.2 Cg_endo -59.21 142.24 98.96 Favored 'Trans proline' 0 CA--C 1.54 0.82 0 C-N-CA 122.692 2.261 . . . . 70.02 112.931 -179.818 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -75.26 -24.41 57.61 Favored 'General case' 0 N--CA 1.469 0.49 0 CA-C-O 120.861 0.363 . . . . 54.2 111.833 -179.853 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 85.5 m-20 -86.49 36.67 0.71 Allowed 'General case' 0 CA--C 1.544 0.715 0 N-CA-C 112.873 0.694 . . . . 63.13 112.873 -175.705 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 26' ' ' LEU . . . . . 0.539 HD23 ' SD ' ' A' ' 29' ' ' MET . 87.5 mt -55.74 -29.28 59.29 Favored 'General case' 0 N--CA 1.475 0.795 0 CA-C-O 121.111 0.482 . . . . 65.22 110.856 175.433 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 3.6 m-20 -64.47 -35.33 80.58 Favored 'General case' 0 CA--C 1.541 0.627 0 CA-C-N 116.073 -0.512 . . . . 65.05 111.343 176.019 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 31.3 m-20 -81.71 -22.28 37.48 Favored 'General case' 0 CA--C 1.537 0.467 0 CA-C-O 121.062 0.458 . . . . 65.31 111.306 177.452 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 29' ' ' MET . . . . . 0.539 ' SD ' HD23 ' A' ' 26' ' ' LEU . 85.1 mtp -72.47 124.42 25.15 Favored 'General case' 0 CA--C 1.536 0.436 0 CA-C-O 120.958 0.409 . . . . 75.42 110.512 175.104 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 61.1 mtpt -72.42 170.53 14.08 Favored 'General case' 0 CA--C 1.537 0.459 0 CA-C-O 120.988 0.423 . . . . 72.22 111.807 -177.04 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 45.8 t -53.19 -46.76 56.41 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.659 0 CA-C-N 116.039 -0.528 . . . . 72.04 111.8 -175.475 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -61.45 -40.55 94.89 Favored 'General case' 0 N--CA 1.469 0.507 0 N-CA-C 112.064 0.394 . . . . 64.1 112.064 179.441 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 39.7 mt-10 -64.28 -46.39 83.87 Favored 'General case' 0 CA--C 1.537 0.471 0 CA-C-O 120.991 0.424 . . . . 73.15 111.117 179.42 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 92.9 mt -63.81 -49.17 73.93 Favored 'General case' 0 N--CA 1.47 0.53 0 CA-C-N 116.159 -0.473 . . . . 63.31 111.646 178.18 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 35' ' ' LYS . . . . . 0.427 ' HG2' ' HB ' ' A' ' 45' ' ' VAL . 56.1 mtpt -52.83 -45.18 67.18 Favored 'General case' 0 N--CA 1.473 0.678 0 CA-C-O 121.203 0.525 . . . . 71.21 111.149 175.252 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 36' ' ' GLN . . . . . 0.548 ' O ' ' HG ' ' A' ' 40' ' ' LEU . 1.0 OUTLIER -57.75 -49.6 76.02 Favored 'General case' 0 CA--C 1.541 0.632 0 CA-C-N 115.761 -0.654 . . . . 65.35 110.673 177.553 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 37' ' ' GLU . . . . . 0.416 ' HB3' ' NH2' ' A' ' 41' ' ' ARG . 55.8 mm-40 -62.47 -35.14 78.39 Favored 'General case' 0 N--CA 1.471 0.578 0 N-CA-C 112.183 0.438 . . . . 73.05 112.183 178.743 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 38' ' ' LEU . . . . . 0.49 ' HB2' HG12 ' A' ' 45' ' ' VAL . 91.9 mt -66.53 -54.6 21.97 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-O 120.929 0.395 . . . . 63.41 111.591 177.88 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 17.6 ptmt -63.87 -24.2 67.65 Favored 'General case' 0 CA--C 1.541 0.616 0 N-CA-C 112.337 0.495 . . . . 60.14 112.337 -174.229 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 40' ' ' LEU . . . . . 0.548 ' HG ' ' O ' ' A' ' 36' ' ' GLN . 78.6 mt -58.03 -38.52 76.39 Favored 'General case' 0 N--CA 1.472 0.661 0 CA-C-O 121.421 0.629 . . . . 75.11 111.017 172.804 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 41' ' ' ARG . . . . . 0.416 ' NH2' ' HB3' ' A' ' 37' ' ' GLU . 41.6 mtm-85 -108.72 25.27 11.94 Favored 'General case' 0 CA--C 1.539 0.54 0 CA-C-N 115.514 -0.766 . . . . 73.13 111.724 -175.831 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 48.7 m 64.88 15.77 10.1 Favored 'General case' 0 N--CA 1.48 1.045 0 N-CA-C 112.877 0.695 . . . . 53.41 112.877 175.619 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 75.4 mt -79.57 140.52 55.55 Favored Pre-proline 0 CA--C 1.54 0.579 0 C-N-CA 122.029 0.132 . . . . 74.3 111.221 178.998 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 44' ' ' PRO . . . . . 0.458 ' HD2' ' HD3' ' A' ' 55' ' ' ARG . 41.4 Cg_endo -66.0 126.1 15.28 Favored 'Trans proline' 0 CA--C 1.538 0.717 0 C-N-CA 122.227 1.951 . . . . 73.2 112.452 -178.829 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 45' ' ' VAL . . . . . 0.49 HG12 ' HB2' ' A' ' 38' ' ' LEU . 21.5 m -94.04 -8.23 9.92 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.476 0 CA-C-O 121.103 0.478 . . . . 73.11 111.767 -177.352 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 38.6 m -76.7 74.85 3.37 Favored 'General case' 0 N--CA 1.47 0.534 0 CA-C-O 121.119 0.485 . . . . 60.52 111.938 -177.615 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . -166.89 177.2 41.71 Favored Glycine 0 CA--C 1.524 0.62 0 C-N-CA 121.298 -0.477 . . . . 71.54 112.909 176.2 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 48' ' ' THR . . . . . 0.552 ' O ' ' HG ' ' A' ' 52' ' ' LEU . 31.1 p -72.04 159.06 34.83 Favored 'General case' 0 N--CA 1.471 0.614 0 O-C-N 122.535 -0.391 . . . . 73.52 110.957 179.178 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 49' ' ' LYS . . . . . 0.424 ' HE3' ' O ' ' A' ' 29' ' ' MET . 87.4 tttt -48.84 -35.98 15.82 Favored 'General case' 0 N--CA 1.471 0.585 0 CA-C-O 121.174 0.511 . . . . 73.2 110.897 176.481 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 50' ' ' THR . . . . . 0.427 ' O ' ' HG3' ' A' ' 54' ' ' GLU . 10.1 m -58.24 -53.87 53.36 Favored 'General case' 0 N--CA 1.467 0.399 0 CA-C-N 115.726 -0.67 . . . . 64.53 110.979 176.367 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 41.1 mt-10 -58.16 -40.38 81.25 Favored 'General case' 0 N--CA 1.468 0.467 0 CA-C-N 116.076 -0.511 . . . . 64.21 111.66 178.526 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 52' ' ' LEU . . . . . 0.552 ' HG ' ' O ' ' A' ' 48' ' ' THR . 22.4 mt -60.68 -43.49 97.66 Favored 'General case' 0 CA--C 1.542 0.638 0 CA-C-O 121.155 0.502 . . . . 62.31 111.123 -179.843 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 53' ' ' ILE . . . . . . . . . . . . . 78.7 mt -65.5 -52.03 56.25 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.686 0 CA-C-N 116.162 -0.472 . . . . 65.45 111.36 177.065 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 54' ' ' GLU . . . . . 0.427 ' HG3' ' O ' ' A' ' 50' ' ' THR . 45.5 mt-10 -55.88 -42.54 76.09 Favored 'General case' 0 N--CA 1.471 0.622 0 CA-C-O 121.204 0.526 . . . . 65.31 111.068 178.966 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 55' ' ' ARG . . . . . 0.458 ' HD3' ' HD2' ' A' ' 44' ' ' PRO . 30.0 ttm180 -65.22 -43.89 90.02 Favored 'General case' 0 CA--C 1.539 0.55 0 CA-C-N 115.681 -0.69 . . . . 75.42 112.187 -177.171 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 51.1 mt -62.35 -47.28 84.91 Favored 'General case' 0 CA--C 1.54 0.561 0 O-C-N 122.249 -0.282 . . . . 74.23 111.288 175.881 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 98.3 mtt180 -57.92 -51.46 69.52 Favored 'General case' 0 N--CA 1.471 0.577 0 CA-C-O 120.971 0.415 . . . . 72.22 111.139 176.788 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -61.36 -37.87 84.92 Favored 'General case' 0 N--CA 1.47 0.563 0 CA-C-N 116.143 -0.48 . . . . 70.04 112.276 -178.854 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 59' ' ' TYR . . . . . . . . . . . . . 69.7 t80 -68.98 -44.34 73.08 Favored 'General case' 0 CA--C 1.538 0.507 0 CA-C-O 120.765 0.317 . . . . 62.23 111.523 179.069 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 60' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -65.62 -41.92 92.13 Favored 'General case' 0 CA--C 1.542 0.655 0 CA-C-O 121.596 0.712 . . . . 74.11 109.993 177.403 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 61' ' ' ASP . . . . . . . . . . . . . 21.6 t70 -60.16 -29.91 68.97 Favored 'General case' 0 CA--C 1.543 0.684 0 CA-C-N 115.486 -0.779 . . . . 75.34 112.189 -178.762 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 62' ' ' GLN . . . . . . . . . . . . . 10.9 pt20 -93.11 1.66 57.09 Favored 'General case' 0 N--CA 1.473 0.723 0 N-CA-C 112.468 0.544 . . . . 65.45 112.468 -178.33 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 63' ' ' ILE . . . . . . . . . . . . . 33.4 pt -122.73 -3.28 7.51 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.77 0 CA-C-O 121.098 0.475 . . . . 72.53 111.464 174.959 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 39.9 t -115.02 147.92 39.41 Favored Pre-proline 0 N--CA 1.472 0.655 0 CA-C-N 116.23 -0.441 . . . . 73.33 111.12 178.736 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 65' ' ' PRO . . . . . . . . . . . . . 29.1 Cg_endo -61.94 140.64 86.0 Favored 'Trans proline' 0 CA--C 1.539 0.771 0 C-N-CA 122.244 1.962 . . . . 74.01 112.743 177.827 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 66' ' ' VAL . . . . . . . . . . . . . 33.6 m -60.96 155.68 52.51 Favored Pre-proline 0 CA--C 1.544 0.732 0 CA-C-N 116.272 -0.422 . . . . 72.41 112.035 -178.397 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 67' ' ' PRO . . . . . . . . . . . . . 88.8 Cg_exo -49.1 -34.4 29.99 Favored 'Trans proline' 0 CA--C 1.543 0.95 0 C-N-CA 122.946 2.431 . . . . 64.11 113.321 177.669 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . -62.68 -20.55 61.87 Favored Glycine 0 CA--C 1.53 0.991 0 C-N-CA 121.386 -0.435 . . . . 74.31 113.491 178.421 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 69' ' ' ALA . . . . . 0.435 ' HA ' ' HD3' ' A' ' 70' ' ' PRO . . . -87.6 136.87 32.47 Favored Pre-proline 0 CA--C 1.538 0.516 0 O-C-N 122.466 -0.432 . . . . 70.41 110.929 177.232 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 70' ' ' PRO . . . . . 0.435 ' HD3' ' HA ' ' A' ' 69' ' ' ALA . 22.8 Cg_exo -65.05 92.34 0.21 Allowed 'Trans proline' 0 CA--C 1.541 0.86 0 C-N-CA 122.56 2.174 . . . . 72.03 113.282 -179.22 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 71' ' ' LYS . . . . . 0.401 ' HE3' ' N ' ' A' ' 72' ' ' ALA . 0.0 OUTLIER -81.1 111.55 17.65 Favored 'General case' 0 CA--C 1.539 0.528 0 CA-C-O 120.941 0.401 . . . . 74.41 111.132 177.768 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 72' ' ' ALA . . . . . 0.401 ' N ' ' HE3' ' A' ' 71' ' ' LYS . . . -70.72 125.31 91.98 Favored Pre-proline 0 CA--C 1.539 0.549 0 CA-C-N 116.379 -0.373 . . . . 74.33 111.49 178.857 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 73' ' ' PRO . . . . . . . . . . . . . 69.7 Cg_endo -72.17 153.96 56.93 Favored 'Trans proline' 0 CA--C 1.539 0.728 0 C-N-CA 122.621 2.214 . . . . 73.3 113.231 -178.338 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -92.46 112.56 24.55 Favored 'General case' 0 CA--C 1.537 0.474 0 CA-C-N 116.254 -0.43 . . . . 64.24 111.438 178.958 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.252 1.206 0 CA-C-O 118.739 -0.648 . . . . 73.21 111.655 179.559 . . . . . . . . 0 0 . 1 . 019 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 24.6 mmt . . . . . 0 N--CA 1.489 1.496 0 CA-C-O 120.914 0.387 . . . . 62.33 110.592 . . . . . . . . . 0 0 . 1 . 019 nuclear nobuild full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . -154.94 98.16 0.18 Allowed Glycine 0 CA--C 1.524 0.626 0 C-N-CA 121.022 -0.609 . . . . 71.2 113.208 -176.566 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 3' ' ' HIS . . . . . . . . . . . . . 49.2 t-80 -147.21 103.44 3.58 Favored 'General case' 0 CA--C 1.539 0.54 0 CA-C-O 120.752 0.311 . . . . 64.12 110.601 176.369 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 4' ' ' HIS . . . . . . . . . . . . . 92.2 m-70 -133.45 178.83 6.61 Favored 'General case' 0 N--CA 1.471 0.611 0 CA-C-O 121.387 0.613 . . . . 71.34 112.076 -176.658 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 5' ' ' HIS . . . . . . . . . . . . . 61.1 m80 -122.26 137.83 54.7 Favored 'General case' 0 CA--C 1.536 0.43 0 CA-C-N 115.839 -0.618 . . . . 71.45 110.752 178.562 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 83.4 t60 -172.08 136.24 0.85 Allowed 'General case' 0 N--CA 1.471 0.599 0 N-CA-C 111.737 0.273 . . . . 74.25 111.737 -178.398 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 22.9 p-80 -158.0 136.31 10.98 Favored 'General case' 0 N--CA 1.471 0.608 0 N-CA-C 111.967 0.358 . . . . 64.41 111.967 176.128 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 8' ' ' HIS . . . . . . . . . . . . . 60.7 t60 -173.27 115.39 0.25 Allowed 'General case' 0 N--CA 1.47 0.553 0 CA-C-O 120.825 0.345 . . . . 73.33 110.646 173.827 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 40.0 t -161.38 141.08 10.44 Favored 'General case' 0 N--CA 1.469 0.515 0 CA-C-O 121.373 0.606 . . . . 74.33 112.168 179.866 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 53.4 m80 -139.43 87.32 2.18 Favored 'General case' 0 N--CA 1.466 0.373 0 CA-C-N 115.805 -0.634 . . . . 64.41 110.076 173.378 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 11' ' ' MET . . . . . . . . . . . . . 65.8 mtt -81.23 134.15 35.56 Favored 'General case' 0 CA--C 1.536 0.418 0 CA-C-N 116.158 -0.474 . . . . 71.1 111.298 -176.52 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 38.8 t -96.81 160.87 14.12 Favored 'General case' 0 N--CA 1.471 0.606 0 CA-C-O 121.081 0.467 . . . . 74.11 112.046 -175.644 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 13' ' ' THR . . . . . . . . . . . . . 62.2 p -119.87 126.43 26.9 Favored Pre-proline 0 N--CA 1.471 0.588 0 CA-C-N 115.984 -0.553 . . . . 75.54 111.218 178.937 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 14' ' ' PRO . . . . . . . . . . . . . 16.7 Cg_exo -67.82 77.81 0.56 Allowed 'Trans proline' 0 CA--C 1.54 0.794 0 C-N-CA 122.696 2.264 . . . . 70.01 112.759 176.977 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 15' ' ' LEU . . . . . 0.417 ' H ' HD23 ' A' ' 15' ' ' LEU . 2.4 pt? -62.83 131.46 48.88 Favored 'General case' 0 CA--C 1.542 0.636 0 CA-C-N 116.443 -0.344 . . . . 70.14 111.257 177.166 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 16' ' ' THR . . . . . . . . . . . . . 71.5 p -69.32 -68.99 0.36 Allowed 'General case' 0 N--CA 1.469 0.521 0 O-C-N 122.208 -0.308 . . . . 70.5 111.361 -178.157 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . 42.74 51.45 5.74 Favored Glycine 0 CA--C 1.53 1.017 0 N-CA-C 114.268 0.467 . . . . 64.44 114.268 175.352 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 22.9 pttp -93.76 147.76 34.14 Favored Pre-proline 0 CA--C 1.541 0.618 0 CA-C-N 117.081 0.441 . . . . 73.31 111.235 -179.388 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 89.0 Cg_exo -48.18 109.83 0.28 Allowed 'Trans proline' 0 CA--C 1.541 0.84 0 C-N-CA 122.976 2.451 . . . . 64.51 113.597 -179.441 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . -93.53 -5.3 63.38 Favored Glycine 0 CA--C 1.528 0.853 0 C-N-CA 121.264 -0.493 . . . . 64.25 113.398 -177.792 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -162.39 171.26 17.45 Favored 'General case' 0 N--CA 1.469 0.476 0 CA-C-O 120.928 0.394 . . . . 42.31 111.483 178.659 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 22' ' ' LEU . . . . . 0.405 ' HA ' ' HD3' ' A' ' 23' ' ' PRO . 86.9 mt -78.96 135.63 58.71 Favored Pre-proline 0 CA--C 1.536 0.411 0 CA-C-N 116.702 -0.226 . . . . 53.31 110.957 176.579 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 23' ' ' PRO . . . . . 0.592 ' O ' ' HG ' ' A' ' 26' ' ' LEU . 28.0 Cg_exo -62.03 147.19 95.61 Favored 'Trans proline' 0 CA--C 1.537 0.67 0 C-N-CA 122.213 1.942 . . . . 74.24 112.109 176.448 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -67.18 -20.16 65.68 Favored 'General case' 0 CA--C 1.538 0.511 0 CA-C-O 121.166 0.507 . . . . 64.15 111.33 177.563 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 25' ' ' ASN . . . . . 0.45 ' O ' ' HG3' ' A' ' 29' ' ' MET . 8.1 m120 -89.33 23.3 2.57 Favored 'General case' 0 CA--C 1.547 0.85 0 N-CA-C 112.694 0.628 . . . . 71.34 112.694 -174.875 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 26' ' ' LEU . . . . . 0.592 ' HG ' ' O ' ' A' ' 23' ' ' PRO . 67.7 mt -48.04 -56.61 7.31 Favored 'General case' 0 N--CA 1.478 0.952 0 N-CA-C 112.851 0.686 . . . . 74.13 112.851 -177.151 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 8.2 p-10 -77.48 -7.91 56.95 Favored 'General case' 0 CA--C 1.541 0.614 0 N-CA-C 112.294 0.479 . . . . 54.25 112.294 -176.226 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 16.4 m-20 -90.85 -26.87 19.17 Favored 'General case' 0 CA--C 1.542 0.637 0 N-CA-C 111.75 0.278 . . . . 71.32 111.75 177.604 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 29' ' ' MET . . . . . 0.45 ' HG3' ' O ' ' A' ' 25' ' ' ASN . 59.1 mtm -70.65 169.26 14.73 Favored 'General case' 0 N--CA 1.472 0.659 0 CA-C-O 121.366 0.603 . . . . 75.03 112.194 -178.558 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 30' ' ' LYS . . . . . 0.455 ' HB2' ' HG2' ' A' ' 33' ' ' GLU . 52.1 mtpt -76.98 157.66 31.1 Favored 'General case' 0 CA--C 1.536 0.427 0 CA-C-N 115.99 -0.55 . . . . 74.41 111.441 177.118 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 87.9 t -57.58 -40.17 73.59 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.5 0 CA-C-O 121.024 0.44 . . . . 63.44 110.643 175.451 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -59.51 -36.19 75.61 Favored 'General case' 0 CA--C 1.539 0.542 0 CA-C-N 116.135 -0.484 . . . . 75.43 111.775 177.04 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 33' ' ' GLU . . . . . 0.455 ' HG2' ' HB2' ' A' ' 30' ' ' LYS . 16.8 mm-40 -70.72 -40.99 72.47 Favored 'General case' 0 N--CA 1.47 0.536 0 CA-C-O 120.995 0.426 . . . . 63.01 110.73 178.309 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 34' ' ' LEU . . . . . 0.442 HD13 ' HB2' ' A' ' 52' ' ' LEU . 94.9 mt -59.07 -47.19 86.15 Favored 'General case' 0 CA--C 1.538 0.499 0 CA-C-O 121.021 0.439 . . . . 74.44 110.578 174.471 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 35' ' ' LYS . . . . . 0.57 ' HA ' HD12 ' A' ' 38' ' ' LEU . 95.5 mttt -59.72 -33.76 72.04 Favored 'General case' 0 N--CA 1.47 0.545 0 CA-C-N 116.295 -0.411 . . . . 74.13 111.469 176.253 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 36' ' ' GLN . . . . . 0.416 ' O ' ' HG ' ' A' ' 40' ' ' LEU . 22.8 tm0? -60.93 -47.99 83.85 Favored 'General case' 0 CA--C 1.537 0.448 0 CA-C-N 116.385 -0.37 . . . . 73.32 110.936 178.261 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 37' ' ' GLU . . . . . 0.468 ' HB3' ' NH2' ' A' ' 41' ' ' ARG . 29.5 mt-10 -67.86 -39.39 83.78 Favored 'General case' 0 CA--C 1.54 0.576 0 CA-C-O 120.824 0.345 . . . . 71.31 111.904 176.616 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 38' ' ' LEU . . . . . 0.57 HD12 ' HA ' ' A' ' 35' ' ' LYS . 83.9 mt -57.42 -55.42 34.99 Favored 'General case' 0 N--CA 1.471 0.606 0 N-CA-C 111.921 0.341 . . . . 70.42 111.921 179.189 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 17.7 ptpt -57.35 -30.6 64.97 Favored 'General case' 0 CA--C 1.542 0.645 0 N-CA-C 112.251 0.463 . . . . 75.13 112.251 -176.72 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 40' ' ' LEU . . . . . 0.416 ' HG ' ' O ' ' A' ' 36' ' ' GLN . 89.3 mt -68.2 -38.98 82.55 Favored 'General case' 0 N--CA 1.469 0.524 0 CA-C-O 120.926 0.393 . . . . 55.3 111.389 177.29 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 41' ' ' ARG . . . . . 0.685 HH21 HD22 ' A' ' 56' ' ' LEU . 0.0 OUTLIER -100.32 22.2 11.93 Favored 'General case' 0 CA--C 1.543 0.696 0 N-CA-C 112.055 0.391 . . . . 74.34 112.055 -179.211 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 44.1 t 62.32 27.96 16.67 Favored 'General case' 0 N--CA 1.481 1.087 0 N-CA-C 112.462 0.542 . . . . 74.43 112.462 174.619 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 70.6 mt -93.37 143.41 26.64 Favored Pre-proline 0 CA--C 1.543 0.705 0 CA-C-N 116.385 -0.371 . . . . 44.05 111.915 -179.312 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 44' ' ' PRO . . . . . 0.489 ' HD2' ' HD3' ' A' ' 55' ' ' ARG . 41.4 Cg_exo -57.07 119.54 6.86 Favored 'Trans proline' 0 CA--C 1.542 0.901 0 C-N-CA 122.743 2.295 . . . . 62.11 112.954 177.51 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 45' ' ' VAL . . . . . 0.469 ' O ' ' HE2' ' A' ' 35' ' ' LYS . 35.6 m -86.17 -16.73 9.59 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.675 0 N-CA-C 112.574 0.583 . . . . 62.41 112.574 -178.802 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 52.0 m -77.24 36.01 0.18 Allowed 'General case' 0 N--CA 1.478 0.952 0 N-CA-C 113.628 0.973 . . . . 73.04 113.628 -173.498 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . -112.15 176.34 17.88 Favored Glycine 0 CA--C 1.528 0.89 0 C-N-CA 120.892 -0.67 . . . . 73.5 112.912 177.71 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 48' ' ' THR . . . . . 0.58 ' O ' ' HG ' ' A' ' 52' ' ' LEU . 59.3 p -82.6 169.74 15.95 Favored 'General case' 0 N--CA 1.473 0.719 0 O-C-N 122.462 -0.434 . . . . 74.23 111.727 178.039 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 49' ' ' LYS . . . . . 0.43 ' O ' HG13 ' A' ' 53' ' ' ILE . 24.0 tptm -44.21 -59.64 2.27 Favored 'General case' 0 N--CA 1.473 0.713 0 C-N-CA 122.994 0.518 . . . . 70.42 112.227 -179.583 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 50' ' ' THR . . . . . 0.525 ' HA ' HD12 ' A' ' 53' ' ' ILE . 86.6 m -65.73 -38.19 88.46 Favored 'General case' 0 CA--C 1.541 0.598 0 N-CA-C 112.328 0.492 . . . . 71.33 112.328 -177.42 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 42.5 mt-10 -58.0 -50.83 72.07 Favored 'General case' 0 N--CA 1.473 0.699 0 CA-C-O 120.82 0.343 . . . . 74.43 111.533 177.613 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 52' ' ' LEU . . . . . 0.58 ' HG ' ' O ' ' A' ' 48' ' ' THR . 26.1 mt -59.1 -38.08 78.7 Favored 'General case' 0 CA--C 1.538 0.504 0 CA-C-N 116.435 -0.348 . . . . 75.14 111.441 -177.73 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 53' ' ' ILE . . . . . 0.525 HD12 ' HA ' ' A' ' 50' ' ' THR . 71.8 mt -57.69 -58.08 7.7 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.515 0 CA-C-O 121.093 0.473 . . . . 73.43 111.11 175.899 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 54' ' ' GLU . . . . . 0.445 ' HG2' HH11 ' A' ' 57' ' ' ARG . 44.4 mt-10 -65.7 -24.53 67.01 Favored 'General case' 0 N--CA 1.469 0.504 0 CA-C-N 116.207 -0.451 . . . . 71.41 111.864 179.697 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 55' ' ' ARG . . . . . 0.489 ' HD3' ' HD2' ' A' ' 44' ' ' PRO . 38.6 ttm180 -71.77 -44.46 63.98 Favored 'General case' 0 CA--C 1.54 0.57 0 CA-C-O 120.92 0.39 . . . . 70.13 110.912 177.329 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 56' ' ' LEU . . . . . 0.685 HD22 HH21 ' A' ' 41' ' ' ARG . 85.9 mt -58.96 -46.33 88.32 Favored 'General case' 0 N--CA 1.47 0.557 0 CA-C-O 121.236 0.541 . . . . 74.45 110.396 171.367 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 57' ' ' ARG . . . . . 0.445 HH11 ' HG2' ' A' ' 54' ' ' GLU . 48.6 mtp180 -59.47 -41.56 90.02 Favored 'General case' 0 CA--C 1.535 0.376 0 CA-C-N 115.499 -0.773 . . . . 70.22 111.419 177.58 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -59.55 -43.82 93.42 Favored 'General case' 0 CA--C 1.537 0.461 0 CA-C-N 116.472 -0.331 . . . . 54.21 111.663 179.218 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 59' ' ' TYR . . . . . . . . . . . . . 57.4 t80 -65.42 -48.28 73.33 Favored 'General case' 0 CA--C 1.54 0.56 0 CA-C-O 120.994 0.426 . . . . 64.13 110.918 178.368 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 60' ' ' GLN . . . . . . . . . . . . . 54.8 tp60 -59.89 -39.44 85.37 Favored 'General case' 0 CA--C 1.539 0.545 0 CA-C-O 121.347 0.594 . . . . 63.12 110.845 178.395 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 61' ' ' ASP . . . . . . . . . . . . . 24.2 t70 -56.21 -27.63 55.46 Favored 'General case' 0 CA--C 1.542 0.636 0 CA-C-N 115.459 -0.791 . . . . 72.21 111.821 178.048 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 62' ' ' GLN . . . . . . . . . . . . . 74.0 mt-30 -90.39 -36.4 14.63 Favored 'General case' 0 CA--C 1.542 0.639 0 N-CA-C 112.41 0.522 . . . . 75.32 112.41 -177.775 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 63' ' ' ILE . . . . . . . . . . . . . 43.8 pt -92.55 -20.85 6.4 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.72 0 N-CA-C 112.749 0.648 . . . . 65.45 112.749 -176.078 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 64' ' ' SER . . . . . 0.403 ' HA ' ' HD3' ' A' ' 65' ' ' PRO . 37.6 t -69.03 141.63 92.2 Favored Pre-proline 0 N--CA 1.474 0.755 0 N-CA-C 112.4 0.519 . . . . 61.41 112.4 -176.668 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 65' ' ' PRO . . . . . 0.403 ' HD3' ' HA ' ' A' ' 64' ' ' SER . 19.2 Cg_exo -68.64 -169.38 0.27 Allowed 'Trans proline' 0 CA--C 1.544 0.985 0 C-N-CA 122.741 2.294 . . . . 63.44 112.039 171.387 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 66' ' ' VAL . . . . . . . . . . . . . 29.7 m -67.55 128.09 93.51 Favored Pre-proline 0 CA--C 1.544 0.733 0 O-C-N 122.132 -0.355 . . . . 72.24 111.724 177.906 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 67' ' ' PRO . . . . . . . . . . . . . 72.6 Cg_endo -77.56 -44.79 0.17 Allowed 'Trans proline' 0 CA--C 1.543 0.945 0 C-N-CA 122.444 2.096 . . . . 73.22 113.279 -178.731 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . -80.08 -41.72 11.78 Favored Glycine 0 CA--C 1.524 0.599 0 C-N-CA 121.164 -0.541 . . . . 63.41 112.624 179.767 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . 69.06 130.49 0.03 OUTLIER Pre-proline 0 CA--C 1.542 0.665 0 C-N-CA 123.255 0.622 . . . . 72.31 112.196 178.583 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 70' ' ' PRO . . . . . . . . . . . . . 46.9 Cg_exo -56.85 105.36 0.17 Allowed 'Trans proline' 0 CA--C 1.541 0.838 0 C-N-CA 122.585 2.19 . . . . 75.02 112.606 177.486 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 97.3 mttt -74.35 101.19 3.99 Favored 'General case' 0 CA--C 1.537 0.445 0 CA-C-O 120.782 0.325 . . . . 74.44 111.818 -177.193 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 72' ' ' ALA . . . . . 0.412 ' HA ' ' HD3' ' A' ' 73' ' ' PRO . . . 68.26 129.87 0.03 OUTLIER Pre-proline 0 CA--C 1.544 0.739 0 N-CA-C 112.667 0.617 . . . . 53.31 112.667 177.214 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 73' ' ' PRO . . . . . 0.412 ' HD3' ' HA ' ' A' ' 72' ' ' ALA . 32.4 Cg_exo -59.57 114.09 1.9 Allowed 'Trans proline' 0 C--N 1.352 0.748 0 C-N-CA 122.533 2.156 . . . . 72.13 112.484 176.668 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -63.5 132.21 50.6 Favored 'General case' 0 CA--C 1.538 0.495 0 N-CA-C 112.151 0.426 . . . . 71.52 112.151 -179.119 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.253 1.257 0 CA-C-O 118.808 -0.615 . . . . 74.51 111.635 178.51 . . . . . . . . 0 0 . 1 . 020 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 64.2 mtt . . . . . 0 N--CA 1.489 1.503 0 CA-C-O 120.897 0.379 . . . . 61.41 111.264 . . . . . . . . . 0 0 . 1 . 020 nuclear nobuild full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . 76.49 167.77 26.28 Favored Glycine 0 CA--C 1.528 0.867 0 CA-C-N 116.121 -0.49 . . . . 31.1 113.996 178.061 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 3' ' ' HIS . . . . . . . . . . . . . 94.2 m-70 -137.07 98.29 3.71 Favored 'General case' 0 N--CA 1.468 0.458 0 C-N-CA 122.776 0.43 . . . . 64.33 110.163 175.629 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 4' ' ' HIS . . . . . . . . . . . . . 34.5 m80 -69.02 123.84 22.12 Favored 'General case' 0 CA--C 1.542 0.661 0 CA-C-O 120.789 0.328 . . . . 63.43 111.279 -177.815 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 5' ' ' HIS . . . . . . . . . . . . . 40.2 m80 -108.35 111.62 23.65 Favored 'General case' 0 CA--C 1.538 0.481 0 N-CA-C 112.265 0.468 . . . . 64.44 112.265 -176.57 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 83.8 t60 -178.47 107.59 0.05 OUTLIER 'General case' 0 N--CA 1.471 0.59 0 CA-C-N 115.898 -0.592 . . . . 73.31 110.668 176.708 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 30.6 m170 -127.66 167.44 16.42 Favored 'General case' 0 N--CA 1.47 0.56 0 CA-C-O 121.06 0.457 . . . . 73.03 111.76 177.775 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 8' ' ' HIS . . . . . . . . . . . . . 17.8 p80 -157.19 114.34 3.06 Favored 'General case' 0 CA--C 1.538 0.514 0 CA-C-N 115.705 -0.68 . . . . 62.22 110.46 179.467 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 82.0 p -133.81 87.29 2.36 Favored 'General case' 0 N--CA 1.471 0.623 0 N-CA-C 112.507 0.558 . . . . 64.44 112.507 -177.902 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 32.5 p-80 -164.0 150.42 11.43 Favored 'General case' 0 N--CA 1.47 0.553 0 CA-C-N 116.479 -0.328 . . . . 65.44 110.985 173.131 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 11' ' ' MET . . . . . . . . . . . . . 26.3 ptt? -123.96 152.07 42.91 Favored 'General case' 0 N--CA 1.469 0.499 0 CA-C-O 120.931 0.396 . . . . 74.23 111.226 179.645 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 53.9 m -138.4 109.14 6.64 Favored 'General case' 0 N--CA 1.473 0.678 0 CA-C-O 120.802 0.334 . . . . 75.24 111.419 179.013 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 13' ' ' THR . . . . . 0.411 ' HA ' ' HD3' ' A' ' 14' ' ' PRO . 71.8 p -102.73 135.06 19.54 Favored Pre-proline 0 N--CA 1.473 0.686 0 N-CA-C 112.054 0.39 . . . . 54.31 112.054 -177.986 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 14' ' ' PRO . . . . . 0.411 ' HD3' ' HA ' ' A' ' 13' ' ' THR . 10.9 Cg_exo -72.77 139.19 30.22 Favored 'Trans proline' 0 CA--C 1.539 0.743 0 C-N-CA 122.729 2.286 . . . . 73.03 111.776 172.204 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 15' ' ' LEU . . . . . 0.468 HD22 ' N ' ' A' ' 15' ' ' LEU . 2.9 mm? -92.54 -47.13 7.29 Favored 'General case' 0 CA--C 1.539 0.555 0 CA-C-O 120.834 0.349 . . . . 73.03 111.805 -177.187 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 16' ' ' THR . . . . . . . . . . . . . 89.5 m -115.39 141.74 47.64 Favored 'General case' 0 N--CA 1.473 0.68 0 N-CA-C 112.304 0.483 . . . . 70.35 112.304 -175.704 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . 145.48 99.32 0.26 Allowed Glycine 0 CA--C 1.532 1.105 0 CA-C-N 116.11 -0.495 . . . . 65.24 113.047 177.784 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 22.7 pttp -148.12 125.23 5.6 Favored Pre-proline 0 CA--C 1.546 0.808 0 CA-C-N 117.185 0.493 . . . . 74.53 111.984 -179.114 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 74.5 Cg_endo -83.93 -165.7 0.32 Allowed 'Trans proline' 0 CA--C 1.542 0.915 0 C-N-CA 122.946 2.43 . . . . 75.21 113.113 178.977 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . 76.54 21.12 75.72 Favored Glycine 0 CA--C 1.527 0.781 0 C-N-CA 121.346 -0.454 . . . . 74.34 113.15 -179.344 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -164.29 -175.55 4.0 Favored 'General case' 0 CA--C 1.541 0.615 0 CA-C-O 121.396 0.617 . . . . 23.3 112.035 -177.031 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 22' ' ' LEU . . . . . 0.524 ' HG ' ' HG3' ' A' ' 60' ' ' GLN . 82.4 mt -82.52 159.34 64.36 Favored Pre-proline 0 CA--C 1.537 0.464 0 CA-C-N 115.936 -0.575 . . . . 53.33 111.713 179.978 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 23' ' ' PRO . . . . . 0.532 ' HD2' HD21 ' A' ' 26' ' ' LEU . 52.0 Cg_exo -57.77 150.52 61.92 Favored 'Trans proline' 0 CA--C 1.543 0.968 0 C-N-CA 122.403 2.069 . . . . 73.42 112.84 171.645 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -83.4 -9.45 59.02 Favored 'General case' 0 CA--C 1.539 0.54 0 N-CA-C 112.203 0.445 . . . . 42.4 112.203 -178.285 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 25' ' ' ASN . . . . . 0.524 ' HB3' ' HB3' ' A' ' 28' ' ' ASP . 15.4 m120 -112.67 24.98 11.89 Favored 'General case' 0 CA--C 1.541 0.632 0 N-CA-C 112.477 0.547 . . . . 71.44 112.477 -176.096 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 26' ' ' LEU . . . . . 0.532 HD21 ' HD2' ' A' ' 23' ' ' PRO . 95.1 mt -45.67 -47.29 15.05 Favored 'General case' 0 N--CA 1.48 1.033 0 N-CA-C 112.242 0.46 . . . . 60.23 112.242 -178.67 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 19.7 t70 -71.58 -30.9 66.36 Favored 'General case' 0 CA--C 1.539 0.526 0 CA-C-O 121.0 0.429 . . . . 75.42 111.533 -179.648 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 28' ' ' ASP . . . . . 0.524 ' HB3' ' HB3' ' A' ' 25' ' ' ASN . 20.9 t70 -78.23 -23.69 47.31 Favored 'General case' 0 CA--C 1.542 0.655 0 CA-C-O 121.193 0.52 . . . . 75.42 110.927 -179.89 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 29' ' ' MET . . . . . . . . . . . . . 71.5 mtp -73.23 -179.52 3.39 Favored 'General case' 0 CA--C 1.539 0.526 0 CA-C-N 115.823 -0.626 . . . . 72.52 111.966 -179.805 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 49.8 mtmt -95.76 153.81 17.55 Favored 'General case' 0 CA--C 1.54 0.562 0 CA-C-N 116.242 -0.435 . . . . 72.34 111.723 -176.654 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 31' ' ' VAL . . . . . 0.401 ' O ' ' HG3' ' A' ' 35' ' ' LYS . 57.7 t -51.55 -47.85 36.43 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.751 0 CA-C-N 116.196 -0.457 . . . . 74.51 111.924 -179.463 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -54.65 -45.37 73.79 Favored 'General case' 0 N--CA 1.473 0.679 0 CA-C-O 120.807 0.337 . . . . 43.45 111.752 178.687 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 13.8 mm-40 -53.58 -50.66 65.1 Favored 'General case' 0 N--CA 1.47 0.528 0 CA-C-O 121.193 0.52 . . . . 64.23 111.294 178.417 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 62.1 mt -62.63 -46.58 87.58 Favored 'General case' 0 CA--C 1.536 0.413 0 CA-C-N 115.497 -0.774 . . . . 53.23 111.422 -179.896 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 35' ' ' LYS . . . . . 0.401 ' HG3' ' O ' ' A' ' 31' ' ' VAL . 59.2 mtpt -56.22 -38.77 71.49 Favored 'General case' 0 CA--C 1.535 0.384 0 CA-C-N 116.284 -0.416 . . . . 73.51 111.549 179.834 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 16.8 mm100 -64.55 -51.34 63.37 Favored 'General case' 0 CA--C 1.537 0.468 0 CA-C-N 116.546 -0.297 . . . . 62.24 111.581 178.197 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 45.4 mt-10 -62.64 -20.75 65.11 Favored 'General case' 0 N--CA 1.473 0.71 0 CA-C-O 120.915 0.388 . . . . 75.55 111.86 179.893 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 38' ' ' LEU . . . . . 0.442 HD11 ' HA ' ' A' ' 52' ' ' LEU . 77.0 mt -76.18 -62.27 1.67 Allowed 'General case' 0 N--CA 1.47 0.527 0 CA-C-O 120.827 0.346 . . . . 72.15 111.211 170.734 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 14.1 ptmm? -62.41 -33.33 74.56 Favored 'General case' 0 CA--C 1.542 0.641 0 N-CA-C 112.31 0.485 . . . . 64.31 112.31 -173.861 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 95.2 mt -62.54 -27.28 69.05 Favored 'General case' 0 N--CA 1.473 0.707 0 CA-C-O 120.924 0.392 . . . . 65.24 111.164 174.765 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 41' ' ' ARG . . . . . 0.706 HH21 HD23 ' A' ' 56' ' ' LEU . 55.8 mtm180 -104.7 19.04 21.16 Favored 'General case' 0 CA--C 1.543 0.698 0 CA-C-N 116.418 -0.355 . . . . 75.5 111.132 179.386 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 25.7 m 68.72 13.26 8.87 Favored 'General case' 0 N--CA 1.479 1.008 0 C-N-CA 123.309 0.643 . . . . 42.44 112.715 177.154 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 80.6 mt -83.67 136.86 41.72 Favored Pre-proline 0 CA--C 1.54 0.572 0 O-C-N 122.316 -0.24 . . . . 72.41 111.085 178.33 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 44' ' ' PRO . . . . . . . . . . . . . 72.6 Cg_endo -74.94 126.83 10.26 Favored 'Trans proline' 0 CA--C 1.54 0.811 0 C-N-CA 122.55 2.167 . . . . 73.05 113.545 -178.621 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 26.1 m -85.48 20.93 0.3 Allowed 'Isoleucine or valine' 0 CA--C 1.544 0.736 0 CA-C-N 116.069 -0.514 . . . . 73.33 112.114 179.751 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 15.1 m -78.48 62.77 3.17 Favored 'General case' 0 N--CA 1.47 0.573 0 CA-C-O 120.821 0.343 . . . . 64.03 111.724 -176.308 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . -169.75 -177.34 40.13 Favored Glycine 0 CA--C 1.528 0.855 0 C-N-CA 120.598 -0.811 . . . . 72.21 113.961 -179.819 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 48' ' ' THR . . . . . 0.537 ' O ' ' HG ' ' A' ' 52' ' ' LEU . 47.6 p -82.25 171.65 14.02 Favored 'General case' 0 N--CA 1.473 0.677 0 C-N-CA 122.491 0.317 . . . . 70.21 111.38 179.705 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 79.8 tttt -48.0 -46.74 33.18 Favored 'General case' 0 N--CA 1.476 0.826 0 CA-C-O 120.999 0.428 . . . . 61.33 111.513 177.995 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 50' ' ' THR . . . . . 0.4 ' O ' ' HG3' ' A' ' 54' ' ' GLU . 13.6 m -58.77 -46.69 86.92 Favored 'General case' 0 CA--C 1.535 0.394 0 CA-C-N 116.053 -0.522 . . . . 45.45 111.229 179.726 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 74.8 mm-40 -59.09 -41.69 88.66 Favored 'General case' 0 N--CA 1.47 0.559 0 CA-C-O 120.915 0.388 . . . . 73.22 111.401 179.559 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 52' ' ' LEU . . . . . 0.537 ' HG ' ' O ' ' A' ' 48' ' ' THR . 30.1 mt -57.71 -50.39 73.37 Favored 'General case' 0 CA--C 1.538 0.486 0 CA-C-O 121.334 0.588 . . . . 74.42 110.767 179.371 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 53' ' ' ILE . . . . . . . . . . . . . 67.9 mt -60.46 -53.72 44.94 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.44 0 CA-C-N 115.607 -0.724 . . . . 65.23 111.541 178.7 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 54' ' ' GLU . . . . . 0.4 ' HG3' ' O ' ' A' ' 50' ' ' THR . 85.6 mt-10 -60.69 -37.91 83.22 Favored 'General case' 0 CA--C 1.537 0.468 0 CA-C-N 115.795 -0.639 . . . . 74.42 112.123 -177.084 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 55' ' ' ARG . . . . . 0.426 HH11 ' HD2' ' A' ' 55' ' ' ARG . 14.9 ttt180 -73.78 -37.77 64.87 Favored 'General case' 0 CA--C 1.539 0.528 0 O-C-N 122.14 -0.35 . . . . 73.41 111.21 179.863 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 56' ' ' LEU . . . . . 0.706 HD23 HH21 ' A' ' 41' ' ' ARG . 51.1 mt -53.03 -47.64 68.2 Favored 'General case' 0 N--CA 1.47 0.539 0 CA-C-O 121.028 0.442 . . . . 71.23 109.951 170.355 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 16.3 mtp180 -64.5 -57.02 10.37 Favored 'General case' 0 CA--C 1.539 0.548 0 CA-C-N 115.452 -0.794 . . . . 72.51 112.03 179.386 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -52.5 -44.85 65.93 Favored 'General case' 0 N--CA 1.472 0.666 0 CA-C-O 121.02 0.438 . . . . 21.31 112.074 -178.713 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 59' ' ' TYR . . . . . . . . . . . . . 79.4 t80 -67.28 -41.16 85.93 Favored 'General case' 0 CA--C 1.541 0.606 0 CA-C-N 116.397 -0.365 . . . . 73.42 111.793 178.952 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 60' ' ' GLN . . . . . 0.524 ' HG3' ' HG ' ' A' ' 22' ' ' LEU . 19.3 tm0? -70.56 -33.97 71.71 Favored 'General case' 0 CA--C 1.54 0.573 0 CA-C-O 121.207 0.527 . . . . 61.01 110.692 179.958 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 61' ' ' ASP . . . . . . . . . . . . . 24.8 t70 -66.92 -48.21 69.36 Favored 'General case' 0 CA--C 1.541 0.615 0 CA-C-N 115.993 -0.549 . . . . 74.35 111.801 179.304 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 62' ' ' GLN . . . . . . . . . . . . . 10.9 pt20 -62.5 -37.67 86.9 Favored 'General case' 0 N--CA 1.474 0.761 0 N-CA-C 111.829 0.307 . . . . 55.44 111.829 -179.025 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 63' ' ' ILE . . . . . . . . . . . . . 30.4 pt -78.52 -22.03 13.17 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.475 0 CA-C-O 120.8 0.333 . . . . 74.25 110.592 174.518 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 64' ' ' SER . . . . . 0.461 ' HA ' ' HD3' ' A' ' 65' ' ' PRO . 14.9 t 75.1 137.51 0.05 OUTLIER Pre-proline 0 N--CA 1.479 0.986 0 N-CA-C 113.049 0.759 . . . . 73.5 113.049 173.148 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 65' ' ' PRO . . . . . 0.461 ' HD3' ' HA ' ' A' ' 64' ' ' SER . 13.5 Cg_exo -70.59 -168.18 0.3 Allowed 'Trans proline' 0 C--N 1.355 0.873 0 C-N-CA 122.897 2.398 . . . . 74.52 112.936 176.234 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 66' ' ' VAL . . . . . 0.442 ' HA ' ' HD3' ' A' ' 67' ' ' PRO . 23.5 m -63.76 116.27 25.27 Favored Pre-proline 0 CA--C 1.548 0.873 0 CA-C-O 120.907 0.384 . . . . 72.15 111.975 178.515 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 67' ' ' PRO . . . . . 0.442 ' HD3' ' HA ' ' A' ' 66' ' ' VAL . 27.5 Cg_exo -63.89 -31.82 66.91 Favored 'Trans proline' 0 C--N 1.352 0.711 0 C-N-CA 122.863 2.375 . . . . 74.01 112.681 -179.724 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . -55.88 -56.98 21.16 Favored Glycine 0 CA--C 1.525 0.68 0 C-N-CA 121.051 -0.595 . . . . 74.33 112.012 174.788 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . 64.42 152.29 0.12 Allowed Pre-proline 0 CA--C 1.545 0.757 0 N-CA-C 113.323 0.86 . . . . 64.11 113.323 174.032 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 70' ' ' PRO . . . . . . . . . . . . . 2.7 Cg_exo -77.67 120.67 5.24 Favored 'Trans proline' 0 CA--C 1.54 0.821 0 C-N-CA 122.845 2.363 . . . . 63.11 112.025 173.327 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 87.2 tttt -72.77 140.04 47.49 Favored 'General case' 0 CA--C 1.538 0.51 0 CA-C-O 120.958 0.408 . . . . 70.32 111.256 -179.433 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 72' ' ' ALA . . . . . 0.476 ' HA ' ' HD3' ' A' ' 73' ' ' PRO . . . -66.82 133.59 94.03 Favored Pre-proline 0 CA--C 1.542 0.636 0 CA-C-N 116.361 -0.381 . . . . 45.54 111.579 179.232 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 73' ' ' PRO . . . . . 0.476 ' HD3' ' HA ' ' A' ' 72' ' ' ALA . 35.6 Cg_exo -62.24 -165.19 0.04 OUTLIER 'Trans proline' 0 CA--C 1.543 0.93 0 C-N-CA 123.006 2.471 . . . . 72.32 113.175 178.624 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -72.95 66.19 0.78 Allowed 'General case' 0 CA--C 1.542 0.658 0 N-CA-C 111.924 0.342 . . . . 72.13 111.924 178.348 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.252 1.193 0 CA-C-O 118.527 -0.749 . . . . 70.1 112.608 -178.225 . . . . . . . . 0 0 . 1 stop_ save_