data_2khd_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 2khd _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 ' 30' ' ' ASP . . . . . . . . . . . . . 83.3 m-20 . . . . . 0 N--CA 1.494 1.76 0 N-CA-C 109.005 -0.739 . . . . 0.0 109.005 . . . . . . . . . 0 0 . 1 . 001 nuclear orig core ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 51.3 t -124.8 136.1 61.83 Favored 'Isoleucine or valine' 0 N--CA 1.499 2.016 0 CA-C-O 121.728 0.775 . . . . 0.0 109.712 179.886 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -123.9 148.1 47.12 Favored 'General case' 0 N--CA 1.496 1.861 0 CA-C-O 121.86 0.838 . . . . 0.0 109.913 -179.961 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 96.7 mt-10 -104.42 142.01 35.33 Favored 'General case' 0 N--CA 1.496 1.85 0 CA-C-O 121.737 0.78 . . . . 0.0 109.984 -179.702 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 34' ' ' VAL . . . . . . . . . . . . . 55.5 t -125.89 132.84 70.24 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.769 0 CA-C-O 121.638 0.732 . . . . 0.0 109.331 -179.967 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 45.5 t -126.24 110.73 13.76 Favored 'General case' 0 N--CA 1.494 1.761 0 CA-C-O 121.678 0.752 . . . . 0.0 109.61 179.778 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 51.4 tp -121.98 146.64 46.96 Favored 'General case' 0 N--CA 1.497 1.886 0 CA-C-O 121.818 0.818 . . . . 0.0 109.512 179.827 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 37' ' ' PHE . . . . . . . . . . . . . 41.7 p90 -141.87 155.77 45.53 Favored 'General case' 0 N--CA 1.492 1.648 0 CA-C-O 121.781 0.801 . . . . 0.0 110.293 -179.714 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . -166.66 -155.41 8.94 Favored Glycine 0 N--CA 1.491 2.312 0 N-CA-C 110.482 -1.047 . . . . 0.0 110.482 -179.579 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 39' ' ' SER . . . . . 0.491 ' OG ' ' CG ' ' A' ' 43' ' ' HIS . 74.3 p -63.24 -41.88 99.13 Favored 'General case' 0 N--CA 1.496 1.862 0 O-C-N 122.027 -0.69 . . . . 0.0 110.129 -179.103 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 40' ' ' ASP . . . . . . . . . . . . . 53.3 p-10 -171.62 -168.18 0.58 Allowed 'General case' 0 N--CA 1.491 1.586 0 CA-C-O 121.788 0.804 . . . . 0.0 110.01 179.769 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 41' ' ' LYS . . . . . 0.552 ' HZ2' ' CG ' ' A' ' 45' ' ' GLU . 28.3 tptp -62.43 -45.55 92.59 Favored 'General case' 0 C--N 1.303 -1.452 0 O-C-N 121.727 -0.608 . . . . 0.0 110.09 -179.265 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -50.41 -51.57 45.23 Favored 'General case' 0 N--CA 1.494 1.773 0 O-C-N 121.68 -0.637 . . . . 0.0 110.533 -178.358 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 43' ' ' HIS . . . . . 0.491 ' CG ' ' OG ' ' A' ' 39' ' ' SER . 23.0 m-70 -67.01 -37.35 84.01 Favored 'General case' 0 N--CA 1.495 1.782 0 O-C-N 121.441 -0.787 . . . . 0.0 110.115 -179.242 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 18.0 mt -63.58 -40.3 96.6 Favored 'General case' 0 N--CA 1.493 1.702 0 O-C-N 121.358 -0.839 . . . . 0.0 109.427 -179.467 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 45' ' ' GLU . . . . . 0.552 ' CG ' ' HZ2' ' A' ' 41' ' ' LYS . 96.0 mt-10 -61.56 -42.21 98.5 Favored 'General case' 0 N--CA 1.489 1.511 0 N-CA-C 109.036 -0.727 . . . . 0.0 109.036 -179.857 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . -64.55 -48.08 77.04 Favored Glycine 0 N--CA 1.494 2.542 0 N-CA-C 109.584 -1.406 . . . . 0.0 109.584 179.931 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 63.0 mttp -66.97 -33.9 76.59 Favored 'General case' 0 N--CA 1.493 1.698 0 O-C-N 121.712 -0.876 . . . . 0.0 108.995 179.641 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 58.7 tp -59.46 -40.23 86.21 Favored 'General case' 0 C--N 1.303 -1.423 0 N-CA-C 109.503 -0.555 . . . . 0.0 109.503 -178.965 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 49' ' ' ALA . . . . . . . . . . . . . . . -55.97 -39.97 72.56 Favored 'General case' 0 N--CA 1.491 1.618 0 O-C-N 121.563 -0.71 . . . . 0.0 109.23 -179.468 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 97.8 mt-10 -68.33 -39.75 81.83 Favored 'General case' 0 N--CA 1.492 1.659 0 O-C-N 121.62 -0.675 . . . . 0.0 109.419 179.791 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 51' ' ' TYR . . . . . 0.576 ' CE2' ' CG2' ' A' ' 95' ' ' THR . 4.3 m-85 -59.13 -40.69 86.24 Favored 'General case' 0 N--CA 1.494 1.763 0 O-C-N 121.536 -0.727 . . . . 0.0 109.145 -179.432 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 52' ' ' ILE . . . . . 0.557 ' CG2' ' HZ3' ' A' ' 56' ' ' LYS . 95.5 mt -63.98 -42.52 96.01 Favored 'Isoleucine or valine' 0 C--N 1.301 -1.518 0 N-CA-C 109.134 -0.691 . . . . 0.0 109.134 -179.844 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 49.4 m -53.23 -45.99 68.94 Favored 'General case' 0 N--CA 1.493 1.695 0 O-C-N 121.714 -0.616 . . . . 0.0 109.463 -179.0 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 54' ' ' LEU . . . . . 0.407 ' N ' ' CD2' ' A' ' 54' ' ' LEU . 4.0 mm? -64.73 -39.81 94.26 Favored 'General case' 0 C--N 1.3 -1.556 0 O-C-N 121.763 -0.586 . . . . 0.0 109.453 179.168 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -59.13 -49.48 77.73 Favored 'General case' 0 N--CA 1.49 1.573 0 CA-C-O 121.202 0.525 . . . . 0.0 109.769 -179.019 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 56' ' ' LYS . . . . . 0.557 ' HZ3' ' CG2' ' A' ' 52' ' ' ILE . 62.2 mttp -64.6 -39.66 94.11 Favored 'General case' 0 N--CA 1.49 1.564 0 O-C-N 121.6 -0.688 . . . . 0.0 109.359 179.715 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 51.5 tt0 -62.15 -49.19 76.85 Favored 'General case' 0 N--CA 1.489 1.494 0 O-C-N 121.73 -0.606 . . . . 0.0 109.375 -179.433 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 58' ' ' VAL . . . . . . . . . . . . . 72.8 t -66.49 -44.45 90.34 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.587 0 O-C-N 121.761 -0.587 . . . . 0.0 109.795 -179.731 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 59' ' ' TYR . . . . . . . . . . . . . 51.3 t80 -135.75 125.19 24.96 Favored 'General case' 0 N--CA 1.498 1.946 0 CA-C-O 121.918 0.866 . . . . 0.0 110.024 -179.421 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -71.45 144.77 49.61 Favored 'General case' 0 N--CA 1.492 1.629 0 CA-C-O 121.57 0.7 . . . . 0.0 110.73 -179.588 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 61' ' ' ASN . . . . . . . . . . . . . 10.7 m120 57.29 37.44 28.18 Favored 'General case' 0 N--CA 1.493 1.702 0 CA-C-O 121.544 0.688 . . . . 0.0 109.156 179.603 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 62' ' ' VAL . . . . . . . . . . . . . 10.3 p -67.63 138.73 22.13 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.509 0 CA-C-O 121.709 0.766 . . . . 0.0 110.194 -179.643 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 97.3 mt-10 -108.91 142.74 39.09 Favored 'General case' 0 N--CA 1.495 1.813 0 CA-C-O 121.726 0.774 . . . . 0.0 109.671 -179.466 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 64' ' ' TYR . . . . . . . . . . . . . 49.9 p90 -151.22 161.91 41.86 Favored 'General case' 0 N--CA 1.492 1.639 0 CA-C-O 121.936 0.874 . . . . 0.0 110.486 -179.993 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 80.5 tt0 -144.24 145.55 32.12 Favored 'General case' 0 N--CA 1.493 1.721 0 CA-C-O 121.511 0.672 . . . . 0.0 109.426 179.959 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 66' ' ' VAL . . . . . . . . . . . . . 30.8 m -120.71 129.99 75.04 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.903 0 CA-C-O 121.999 0.904 . . . . 0.0 110.266 -179.646 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -78.57 170.74 14.82 Favored Pre-proline 0 C--N 1.301 -1.501 0 CA-C-N 115.976 -0.556 . . . . 0.0 109.506 179.925 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 68' ' ' PRO . . . . . . . . . . . . . 46.7 Cg_exo -54.58 134.11 60.29 Favored 'Trans proline' 0 N--CA 1.496 1.621 0 C-N-CA 122.578 2.186 . . . . 0.0 113.276 179.752 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 69' ' ' VAL . . . . . . . . . . . . . 64.9 t -134.76 132.85 54.21 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.939 0 CA-C-O 121.661 0.743 . . . . 0.0 109.93 179.445 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -82.37 163.7 21.54 Favored 'General case' 0 N--CA 1.49 1.569 0 CA-C-O 121.619 0.723 . . . . 0.0 109.516 179.343 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 49.8 t0 -64.92 -40.69 95.44 Favored 'General case' 0 N--CA 1.489 1.486 0 O-C-N 121.721 -0.612 . . . . 0.0 109.645 -179.53 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 72' ' ' ASN . . . . . . . . . . . . . 95.0 m-20 -97.87 21.81 10.08 Favored 'General case' 0 N--CA 1.495 1.819 0 N-CA-C 108.97 -0.752 . . . . 0.0 108.97 -179.586 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 73' ' ' ALA . . . . . 0.489 ' C ' ' H ' ' A' ' 75' ' ' GLU . . . -62.36 -36.55 82.59 Favored 'General case' 0 N--CA 1.494 1.767 0 O-C-N 121.649 -0.657 . . . . 0.0 109.411 -179.826 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 74' ' ' THR . . . . . . . . . . . . . 2.0 m 67.78 -6.37 0.71 Allowed 'General case' 0 N--CA 1.491 1.606 0 N-CA-C 109.432 -0.581 . . . . 0.0 109.432 -179.965 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 75' ' ' GLU . . . . . 0.498 ' OE1' ' CE1' ' A' ' 77' ' ' HIS . 2.9 pp20? -137.85 145.98 42.88 Favored 'General case' 0 N--CA 1.495 1.82 0 CA-C-O 121.93 0.872 . . . . 0.0 110.336 -179.873 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 2.0 tp -121.06 128.92 53.08 Favored 'General case' 0 N--CA 1.49 1.56 0 CA-C-O 121.586 0.708 . . . . 0.0 109.451 -179.928 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 77' ' ' HIS . . . . . 0.498 ' CE1' ' OE1' ' A' ' 75' ' ' GLU . 30.6 m80 -106.09 114.48 28.65 Favored 'General case' 0 N--CA 1.495 1.788 0 CA-C-O 121.672 0.749 . . . . 0.0 109.213 179.913 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -135.07 154.62 51.63 Favored 'General case' 0 N--CA 1.495 1.78 0 CA-C-O 121.899 0.857 . . . . 0.0 110.227 -179.675 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 94.6 mtt-85 -129.46 146.22 51.33 Favored 'General case' 0 N--CA 1.496 1.829 0 CA-C-O 121.536 0.684 . . . . 0.0 109.585 -179.956 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 80' ' ' PHE . . . . . . . . . . . . . 67.9 m-85 -126.34 144.49 50.79 Favored 'General case' 0 N--CA 1.498 1.942 0 CA-C-O 121.803 0.811 . . . . 0.0 109.965 -179.876 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 21.6 ttpp -115.17 121.46 43.06 Favored 'General case' 0 N--CA 1.494 1.746 0 CA-C-O 121.719 0.771 . . . . 0.0 109.565 -179.792 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 82' ' ' PHE . . . . . . . . . . . . . 83.5 m-85 -115.32 -129.42 0.3 Allowed 'General case' 0 N--CA 1.496 1.859 0 CA-C-O 121.532 0.682 . . . . 0.0 109.613 -179.876 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 78.8 tt0 -140.46 -33.29 0.56 Allowed 'General case' 0 N--CA 1.493 1.71 0 N-CA-C 108.841 -0.8 . . . . 0.0 108.841 -179.54 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 84' ' ' VAL . . . . . . . . . . . . . 27.5 m -135.79 159.8 39.49 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.894 0 CA-C-O 121.891 0.853 . . . . 0.0 109.852 179.953 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 38.0 m -63.37 -34.92 78.76 Favored 'General case' 0 N--CA 1.49 1.536 0 CA-C-O 121.319 0.58 . . . . 0.0 109.907 -179.567 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 86' ' ' ALA . . . . . . . . . . . . . . . -50.22 -45.94 54.28 Favored 'General case' 0 N--CA 1.491 1.577 0 O-C-N 121.526 -0.734 . . . . 0.0 109.676 -178.911 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 87' ' ' GLU . . . . . 0.56 ' N ' ' OE1' ' A' ' 87' ' ' GLU . 0.0 OUTLIER -52.12 -37.81 55.46 Favored 'General case' 0 N--CA 1.493 1.695 0 O-C-N 121.56 -0.712 . . . . 0.0 109.654 -179.103 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 88' ' ' LYS . . . . . . . . . . . . . 88.7 tttt -64.13 -46.1 85.61 Favored 'General case' 0 N--CA 1.49 1.527 0 O-C-N 121.675 -0.64 . . . . 0.0 109.526 -179.609 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 89' ' ' LEU . . . . . 0.496 ' CD2' ' N ' ' A' ' 89' ' ' LEU . 4.0 mm? -63.94 -45.31 89.74 Favored 'General case' 0 N--CA 1.492 1.664 0 O-C-N 121.651 -0.655 . . . . 0.0 110.427 -179.252 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 90' ' ' ILE . . . . . . . . . . . . . 37.1 mm -70.2 -45.28 76.38 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.665 0 O-C-N 121.773 -0.58 . . . . 0.0 109.684 -179.641 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 91' ' ' PHE . . . . . . . . . . . . . 83.9 t80 -64.51 -45.33 87.69 Favored 'General case' 0 N--CA 1.492 1.66 0 O-C-N 121.648 -0.658 . . . . 0.0 109.896 179.84 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 92' ' ' GLU . . . . . . . . . . . . . 46.5 tp10 -66.48 -38.0 86.33 Favored 'General case' 0 N--CA 1.491 1.595 0 O-C-N 121.726 -0.609 . . . . 0.0 109.533 -178.949 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 93' ' ' LEU . . . . . . . . . . . . . 5.5 tt -62.68 -49.17 76.17 Favored 'General case' 0 C--N 1.303 -1.44 0 O-C-N 121.572 -0.705 . . . . 0.0 109.952 -179.301 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 94' ' ' LYS . . . . . . . . . . . . . 49.6 mtmt -69.67 -40.96 76.11 Favored 'General case' 0 N--CA 1.49 1.551 0 O-C-N 121.647 -0.658 . . . . 0.0 109.746 -179.87 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 95' ' ' THR . . . . . 0.576 ' CG2' ' CE2' ' A' ' 51' ' ' TYR . 98.9 m -61.61 -46.9 87.85 Favored 'General case' 0 N--CA 1.491 1.621 0 O-C-N 121.657 -0.652 . . . . 0.0 109.594 -178.917 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 96' ' ' ARG . . . . . . . . . . . . . 78.8 mtp85 -65.8 -40.36 91.83 Favored 'General case' 0 N--CA 1.492 1.669 0 O-C-N 121.687 -0.633 . . . . 0.0 109.338 179.67 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 97' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.489 1.484 0 N-CA-C 109.023 -0.732 . . . . 0.0 109.023 -179.813 . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' A' A ' 30' ' ' ASP . . . . . 0.458 ' N ' ' OD1' ' A' ' 30' ' ' ASP . 29.3 p-10 . . . . . 0 N--CA 1.493 1.701 0 N-CA-C 108.945 -0.761 . . . . 0.0 108.945 . . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 17.2 t -117.21 161.24 16.14 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.97 0 O-C-N 121.551 -0.718 . . . . 0.0 109.658 -179.78 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -135.92 151.61 50.15 Favored 'General case' 0 N--CA 1.492 1.63 0 O-C-N 121.514 -0.741 . . . . 0.0 109.436 -179.652 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 33' ' ' GLU . . . . . 0.496 ' OE1' ' NE2' ' A' ' 77' ' ' HIS . 80.4 mm-40 -100.2 142.7 31.32 Favored 'General case' 0 N--CA 1.493 1.71 0 CA-C-O 121.877 0.846 . . . . 0.0 110.035 -179.597 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 34' ' ' VAL . . . . . . . . . . . . . 52.3 t -128.87 135.48 62.11 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.802 0 CA-C-O 121.629 0.728 . . . . 0.0 109.146 -179.915 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 79.8 p -142.4 120.87 12.43 Favored 'General case' 0 N--CA 1.492 1.638 0 O-C-N 121.258 -0.901 . . . . 0.0 109.05 179.779 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 51.0 tp -122.38 136.27 54.86 Favored 'General case' 0 N--CA 1.497 1.887 0 CA-C-O 121.449 0.642 . . . . 0.0 109.587 -179.9 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 37' ' ' PHE . . . . . . . . . . . . . 91.0 t80 -108.48 131.01 55.23 Favored 'General case' 0 N--CA 1.495 1.787 0 CA-C-O 121.61 0.719 . . . . 0.0 109.468 -179.997 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . -172.09 -159.18 17.9 Favored Glycine 0 N--CA 1.488 2.16 0 N-CA-C 109.951 -1.26 . . . . 0.0 109.951 -179.639 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 39' ' ' SER . . . . . 0.449 ' OG ' ' N ' ' A' ' 40' ' ' ASP . 39.7 t -75.78 -146.94 0.03 OUTLIER 'General case' 0 N--CA 1.494 1.771 0 O-C-N 121.645 -0.914 . . . . 0.0 111.042 -179.061 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 40' ' ' ASP . . . . . 0.449 ' N ' ' OG ' ' A' ' 39' ' ' SER . 97.9 m-20 -52.07 175.98 0.02 OUTLIER 'General case' 0 N--CA 1.493 1.706 0 CA-C-O 122.162 0.982 . . . . 0.0 111.24 -178.696 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 38.0 ttmt -62.29 -42.82 99.68 Favored 'General case' 0 N--CA 1.491 1.577 0 O-C-N 121.633 -0.667 . . . . 0.0 109.575 179.608 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -53.46 -44.7 69.13 Favored 'General case' 0 N--CA 1.492 1.63 0 O-C-N 121.337 -0.852 . . . . 0.0 109.569 -179.558 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 43' ' ' HIS . . . . . . . . . . . . . 86.6 t60 -63.17 -43.36 98.49 Favored 'General case' 0 N--CA 1.493 1.694 0 O-C-N 121.277 -0.89 . . . . 0.0 109.62 179.892 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 97.5 mt -64.43 -39.88 94.68 Favored 'General case' 0 N--CA 1.493 1.723 0 O-C-N 121.413 -0.804 . . . . 0.0 109.713 -179.871 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 96.1 mt-10 -60.73 -38.55 85.5 Favored 'General case' 0 N--CA 1.491 1.603 0 O-C-N 121.203 -0.936 . . . . 0.0 109.833 -179.719 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . -62.34 -52.06 52.03 Favored Glycine 0 N--CA 1.494 2.507 0 N-CA-C 109.698 -1.361 . . . . 0.0 109.698 179.951 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 97.3 mttt -67.59 -37.21 82.25 Favored 'General case' 0 N--CA 1.492 1.644 0 O-C-N 121.32 -1.106 . . . . 0.0 109.739 179.157 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 48' ' ' LEU . . . . . 0.5 ' O ' ' N ' ' A' ' 51' ' ' TYR . 20.7 tp -61.62 -40.13 93.74 Favored 'General case' 0 C--N 1.299 -1.595 0 O-C-N 121.532 -0.73 . . . . 0.0 109.427 -179.177 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 49' ' ' ALA . . . . . 0.426 ' C ' ' O ' ' A' ' 48' ' ' LEU . . . -40.44 -33.24 0.24 Allowed 'General case' 0 N--CA 1.497 1.91 0 CA-C-O 121.617 0.723 . . . . 0.0 109.955 -179.588 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 72.8 mm-40 -68.69 -38.53 80.38 Favored 'General case' 0 N--CA 1.491 1.608 0 O-C-N 121.32 -0.862 . . . . 0.0 109.658 179.513 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 51' ' ' TYR . . . . . 0.5 ' N ' ' O ' ' A' ' 48' ' ' LEU . 21.3 m-85 -62.04 -45.31 94.11 Favored 'General case' 0 N--CA 1.494 1.74 0 O-C-N 121.224 -0.923 . . . . 0.0 109.79 -179.761 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 52' ' ' ILE . . . . . . . . . . . . . 97.2 mt -65.24 -44.16 95.17 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.658 0 O-C-N 121.347 -0.845 . . . . 0.0 109.857 -179.658 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 68.9 m -62.52 -45.02 94.9 Favored 'General case' 0 N--CA 1.494 1.729 0 O-C-N 121.163 -0.96 . . . . 0.0 109.713 -179.642 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 54' ' ' LEU . . . . . . . . . . . . . 88.2 mt -65.87 -39.38 90.66 Favored 'General case' 0 N--CA 1.492 1.646 0 O-C-N 121.371 -0.831 . . . . 0.0 109.784 179.883 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -61.37 -38.82 88.37 Favored 'General case' 0 N--CA 1.49 1.565 0 O-C-N 121.352 -0.842 . . . . 0.0 109.666 -179.522 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 56' ' ' LYS . . . . . . . . . . . . . 56.6 mtpt -64.43 -42.53 95.96 Favored 'General case' 0 N--CA 1.491 1.599 0 O-C-N 121.246 -0.909 . . . . 0.0 109.565 179.68 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 19.3 mm100 -68.54 -41.8 79.32 Favored 'General case' 0 N--CA 1.49 1.532 0 O-C-N 121.286 -0.884 . . . . 0.0 109.521 -179.897 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 58' ' ' VAL . . . . . . . . . . . . . 75.0 t -64.76 -45.57 94.74 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.638 0 O-C-N 121.285 -0.884 . . . . 0.0 109.755 179.809 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 59' ' ' TYR . . . . . . . . . . . . . 51.2 t80 -135.09 121.69 20.7 Favored 'General case' 0 N--CA 1.497 1.909 0 O-C-N 121.339 -0.85 . . . . 0.0 109.77 -179.588 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -68.04 144.51 55.08 Favored 'General case' 0 N--CA 1.492 1.673 0 CA-C-O 121.645 0.736 . . . . 0.0 110.764 -179.585 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 61' ' ' ASN . . . . . . . . . . . . . 55.9 t-20 57.75 41.33 25.3 Favored 'General case' 0 N--CA 1.489 1.508 0 CA-C-O 121.906 0.86 . . . . 0.0 108.98 179.659 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 62' ' ' VAL . . . . . . . . . . . . . 7.4 p -70.76 138.66 21.4 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.516 0 CA-C-O 121.772 0.796 . . . . 0.0 110.321 -179.67 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 97.1 mt-10 -111.19 136.74 49.82 Favored 'General case' 0 N--CA 1.494 1.749 0 CA-C-O 121.611 0.719 . . . . 0.0 109.466 -179.849 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 64' ' ' TYR . . . . . . . . . . . . . 52.4 p90 -147.6 161.3 41.41 Favored 'General case' 0 N--CA 1.489 1.485 0 O-C-N 121.432 -0.792 . . . . 0.0 109.767 -179.549 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 83.1 tt0 -144.56 150.16 37.04 Favored 'General case' 0 N--CA 1.49 1.57 0 N-CA-C 108.935 -0.765 . . . . 0.0 108.935 -179.992 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 66' ' ' VAL . . . . . . . . . . . . . 57.3 t -111.48 129.67 66.4 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.89 0 CA-C-O 121.752 0.787 . . . . 0.0 109.83 -179.705 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -79.45 170.54 15.59 Favored Pre-proline 0 N--CA 1.486 1.369 0 O-C-N 121.698 -0.626 . . . . 0.0 109.589 -179.487 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 68' ' ' PRO . . . . . . . . . . . . . 51.3 Cg_exo -54.72 119.11 5.91 Favored 'Trans proline' 0 N--CA 1.496 1.651 0 C-N-CA 122.412 2.075 . . . . 0.0 112.448 179.64 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 69' ' ' VAL . . . . . . . . . . . . . 74.7 t -131.98 133.28 61.01 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.946 0 O-C-N 121.469 -0.769 . . . . 0.0 109.653 179.634 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -78.61 158.07 28.55 Favored 'General case' 0 N--CA 1.493 1.684 0 CA-C-O 121.757 0.789 . . . . 0.0 110.253 179.869 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 56.6 m-20 -64.09 -37.04 85.99 Favored 'General case' 0 N--CA 1.493 1.684 0 O-C-N 121.58 -0.7 . . . . 0.0 109.39 -179.807 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 72' ' ' ASN . . . . . . . . . . . . . 8.3 t-20 -103.91 28.9 6.26 Favored 'General case' 0 N--CA 1.495 1.79 0 O-C-N 121.333 -0.855 . . . . 0.0 108.925 -179.703 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 73' ' ' ALA . . . . . 0.522 ' C ' ' H ' ' A' ' 75' ' ' GLU . . . -72.96 -10.07 59.4 Favored 'General case' 0 N--CA 1.493 1.677 0 O-C-N 121.292 -0.88 . . . . 0.0 108.729 179.622 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 74' ' ' THR . . . . . 0.431 ' OG1' ' O ' ' A' ' 73' ' ' ALA . 68.4 p 49.69 10.59 0.04 OUTLIER 'General case' 0 N--CA 1.493 1.722 0 O-C-N 121.424 -0.797 . . . . 0.0 109.489 -179.726 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 75' ' ' GLU . . . . . 0.522 ' H ' ' C ' ' A' ' 73' ' ' ALA . 80.8 tt0 -153.82 153.04 31.4 Favored 'General case' 0 C--N 1.302 -1.487 0 O-C-N 121.2 -0.937 . . . . 0.0 109.165 179.618 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 5.7 tt -132.38 134.99 45.82 Favored 'General case' 0 N--CA 1.49 1.546 0 O-C-N 121.608 -0.683 . . . . 0.0 109.324 179.971 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 77' ' ' HIS . . . . . 0.496 ' NE2' ' OE1' ' A' ' 33' ' ' GLU . 74.5 t60 -118.75 126.22 51.4 Favored 'General case' 0 N--CA 1.494 1.758 0 CA-C-O 121.74 0.781 . . . . 0.0 109.46 -179.853 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -144.13 163.87 32.32 Favored 'General case' 0 N--CA 1.492 1.661 0 O-C-N 121.389 -0.82 . . . . 0.0 109.408 -179.719 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 84.5 mtt85 -126.01 144.95 50.51 Favored 'General case' 0 N--CA 1.495 1.792 0 N-CA-C 109.226 -0.657 . . . . 0.0 109.226 -179.877 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 80' ' ' PHE . . . . . . . . . . . . . 64.9 m-85 -128.93 152.0 49.04 Favored 'General case' 0 N--CA 1.495 1.798 0 CA-C-O 121.616 0.722 . . . . 0.0 109.374 -179.717 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 65.0 tttm -106.07 137.72 43.5 Favored 'General case' 0 N--CA 1.492 1.655 0 CA-C-O 121.603 0.716 . . . . 0.0 110.007 -179.507 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 82' ' ' PHE . . . . . . . . . . . . . 80.7 m-85 -133.13 -123.46 0.18 Allowed 'General case' 0 N--CA 1.494 1.768 0 N-CA-C 109.201 -0.666 . . . . 0.0 109.201 179.846 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 49.5 tp10 -153.65 -36.89 0.1 Allowed 'General case' 0 N--CA 1.488 1.442 0 O-C-N 121.225 -0.922 . . . . 0.0 108.704 179.959 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 84' ' ' VAL . . . . . . . . . . . . . 27.8 m -135.89 162.49 36.55 Favored 'Isoleucine or valine' 0 N--CA 1.499 1.991 0 O-C-N 121.329 -0.857 . . . . 0.0 110.155 -179.745 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 77.8 p -69.66 -19.95 63.59 Favored 'General case' 0 N--CA 1.492 1.635 0 O-C-N 121.496 -0.753 . . . . 0.0 109.482 179.618 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 86' ' ' ALA . . . . . . . . . . . . . . . -62.72 -37.6 87.15 Favored 'General case' 0 N--CA 1.492 1.63 0 O-C-N 121.253 -0.905 . . . . 0.0 109.521 179.983 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 80.4 mm-40 -71.8 -27.13 62.73 Favored 'General case' 0 N--CA 1.491 1.596 0 O-C-N 121.348 -0.845 . . . . 0.0 109.109 179.572 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 88' ' ' LYS . . . . . . . . . . . . . 36.8 ttmt -63.41 -50.61 69.14 Favored 'General case' 0 N--CA 1.49 1.544 0 O-C-N 121.258 -0.901 . . . . 0.0 109.726 -179.592 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 89' ' ' LEU . . . . . 0.477 ' CD2' ' N ' ' A' ' 89' ' ' LEU . 4.0 mm? -65.41 -44.22 88.09 Favored 'General case' 0 N--CA 1.493 1.72 0 O-C-N 121.349 -0.845 . . . . 0.0 109.893 -179.72 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 90' ' ' ILE . . . . . 0.4 ' O ' ' CB ' ' A' ' 94' ' ' LYS . 96.0 mt -66.63 -43.62 90.3 Favored 'Isoleucine or valine' 0 C--N 1.299 -1.616 0 O-C-N 121.296 -0.877 . . . . 0.0 109.625 -179.94 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 91' ' ' PHE . . . . . 0.459 ' O ' ' OG1' ' A' ' 95' ' ' THR . 82.5 t80 -61.67 -46.74 88.45 Favored 'General case' 0 N--CA 1.49 1.57 0 O-C-N 121.257 -0.902 . . . . 0.0 109.9 -179.619 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 92' ' ' GLU . . . . . . . . . . . . . 8.8 tm-20 -68.19 -51.77 41.87 Favored 'General case' 0 N--CA 1.491 1.611 0 O-C-N 121.345 -0.847 . . . . 0.0 109.996 -179.463 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 93' ' ' LEU . . . . . . . . . . . . . 3.1 tt -63.64 -46.67 84.6 Favored 'General case' 0 C--N 1.3 -1.586 0 O-C-N 121.173 -0.954 . . . . 0.0 109.659 -179.101 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 94' ' ' LYS . . . . . 0.4 ' CB ' ' O ' ' A' ' 90' ' ' ILE . 55.1 tttp -63.32 -47.27 82.92 Favored 'General case' 0 N--CA 1.491 1.61 0 O-C-N 121.205 -0.935 . . . . 0.0 110.09 -179.072 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 95' ' ' THR . . . . . 0.459 ' OG1' ' O ' ' A' ' 91' ' ' PHE . 60.0 p -67.68 -42.09 82.65 Favored 'General case' 0 C--N 1.299 -1.595 0 O-C-N 121.258 -0.901 . . . . 0.0 109.465 -179.854 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 96' ' ' ARG . . . . . . . . . . . . . 12.1 tpt180 -65.47 -41.54 93.23 Favored 'General case' 0 C--N 1.3 -1.553 0 O-C-N 121.313 -0.867 . . . . 0.0 109.322 -179.853 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 97' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.489 1.517 0 O-C-N 121.366 -0.834 . . . . 0.0 109.245 -179.762 . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 96.3 m-20 . . . . . 0 N--CA 1.493 1.702 0 CA-C-O 121.205 0.526 . . . . 0.0 109.688 . . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 49.9 t -120.24 135.63 59.88 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.773 0 N-CA-C 109.112 -0.699 . . . . 0.0 109.112 -179.829 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -118.48 147.91 43.13 Favored 'General case' 0 N--CA 1.492 1.63 0 N-CA-C 109.267 -0.642 . . . . 0.0 109.267 -179.79 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 97.3 mt-10 -105.49 133.92 49.46 Favored 'General case' 0 N--CA 1.492 1.67 0 O-C-N 121.593 -0.692 . . . . 0.0 109.519 -179.74 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 34' ' ' VAL . . . . . . . . . . . . . 48.6 t -123.06 133.44 69.06 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.734 0 N-CA-C 108.771 -0.826 . . . . 0.0 108.771 179.929 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 77.9 p -128.52 122.96 32.33 Favored 'General case' 0 N--CA 1.491 1.588 0 N-CA-C 108.719 -0.845 . . . . 0.0 108.719 -179.944 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 44.9 tp -117.81 132.58 56.43 Favored 'General case' 0 N--CA 1.496 1.858 0 N-CA-C 108.905 -0.776 . . . . 0.0 108.905 179.808 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 37' ' ' PHE . . . . . . . . . . . . . 91.2 t80 -112.98 132.33 55.4 Favored 'General case' 0 N--CA 1.493 1.688 0 O-C-N 121.676 -0.64 . . . . 0.0 109.287 -179.638 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . -168.45 -162.79 21.24 Favored Glycine 0 N--CA 1.487 2.074 0 C-N-CA 119.693 -1.241 . . . . 0.0 110.164 -179.667 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 39' ' ' SER . . . . . 0.515 ' OG ' ' N ' ' A' ' 40' ' ' ASP . 30.0 t -62.65 -128.33 0.0 OUTLIER 'General case' 0 N--CA 1.49 1.55 0 O-C-N 121.667 -0.902 . . . . 0.0 110.766 -179.264 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 40' ' ' ASP . . . . . 0.515 ' N ' ' OG ' ' A' ' 39' ' ' SER . 98.5 m-20 -73.52 175.77 6.74 Favored 'General case' 0 N--CA 1.488 1.467 0 O-C-N 121.398 -0.814 . . . . 0.0 110.134 -179.197 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 88.5 tttt -63.18 -39.97 96.19 Favored 'General case' 0 C--N 1.305 -1.361 0 N-CA-C 109.05 -0.722 . . . . 0.0 109.05 179.512 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -54.81 -46.02 74.47 Favored 'General case' 0 N--CA 1.488 1.468 0 O-C-N 121.352 -0.843 . . . . 0.0 109.416 -179.944 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 43' ' ' HIS . . . . . . . . . . . . . 15.3 t-80 -61.24 -41.56 97.09 Favored 'General case' 0 C--N 1.303 -1.426 0 O-C-N 121.29 -0.881 . . . . 0.0 109.263 179.653 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 96.5 mt -64.41 -39.59 94.13 Favored 'General case' 0 N--CA 1.49 1.526 0 O-C-N 121.459 -0.776 . . . . 0.0 109.656 -179.929 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 97.2 mt-10 -59.39 -41.15 88.71 Favored 'General case' 0 N--CA 1.488 1.462 0 O-C-N 121.178 -0.951 . . . . 0.0 109.847 -179.69 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . -62.81 -46.72 93.04 Favored Glycine 0 N--CA 1.49 2.285 0 N-CA-C 109.162 -1.575 . . . . 0.0 109.162 179.75 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 25.6 mtpp -67.29 -33.12 74.63 Favored 'General case' 0 N--CA 1.488 1.46 0 O-C-N 121.505 -0.997 . . . . 0.0 109.356 179.224 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 44.0 tp -57.55 -38.33 74.57 Favored 'General case' 0 N--CA 1.488 1.467 0 O-C-N 121.518 -0.739 . . . . 0.0 109.399 -179.056 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 49' ' ' ALA . . . . . . . . . . . . . . . -52.15 -40.48 61.47 Favored 'General case' 0 C--N 1.302 -1.46 0 O-C-N 121.26 -0.9 . . . . 0.0 109.998 -179.682 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 75.9 mt-10 -68.01 -40.96 82.88 Favored 'General case' 0 N--CA 1.491 1.586 0 O-C-N 121.138 -0.977 . . . . 0.0 109.629 179.955 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 8.1 m-85 -61.98 -44.9 95.78 Favored 'General case' 0 N--CA 1.49 1.525 0 O-C-N 121.441 -0.787 . . . . 0.0 109.232 179.934 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 52' ' ' ILE . . . . . . . . . . . . . 96.0 mt -63.97 -43.19 97.6 Favored 'Isoleucine or valine' 0 C--N 1.303 -1.422 0 O-C-N 121.513 -0.742 . . . . 0.0 109.771 -179.816 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 79.9 p -59.49 -39.89 85.24 Favored 'General case' 0 N--CA 1.49 1.562 0 O-C-N 121.147 -0.971 . . . . 0.0 110.028 -179.193 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 54' ' ' LEU . . . . . . . . . . . . . 95.0 mt -63.26 -41.84 99.09 Favored 'General case' 0 N--CA 1.489 1.478 0 O-C-N 121.154 -0.967 . . . . 0.0 109.122 179.8 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -64.11 -41.5 97.23 Favored 'General case' 0 N--CA 1.488 1.437 0 O-C-N 121.42 -0.8 . . . . 0.0 109.502 179.911 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 56' ' ' LYS . . . . . . . . . . . . . 56.5 mtpt -65.37 -43.7 89.95 Favored 'General case' 0 N--CA 1.489 1.514 0 O-C-N 121.377 -0.827 . . . . 0.0 109.461 179.728 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 60.7 tt0 -67.34 -43.76 80.73 Favored 'General case' 0 N--CA 1.488 1.456 0 O-C-N 121.408 -0.807 . . . . 0.0 109.377 -179.762 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 58' ' ' VAL . . . . . 0.475 ' CG1' ' OE1' ' A' ' 87' ' ' GLU . 53.6 t -64.63 -45.61 94.88 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.405 0 O-C-N 121.461 -0.774 . . . . 0.0 109.523 179.999 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 59' ' ' TYR . . . . . . . . . . . . . 56.6 t80 -131.98 123.27 27.01 Favored 'General case' 0 N--CA 1.497 1.902 0 O-C-N 121.479 -0.763 . . . . 0.0 109.619 -179.536 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -70.51 144.44 51.36 Favored 'General case' 0 N--CA 1.491 1.612 0 O-C-N 121.544 -0.722 . . . . 0.0 110.898 -179.436 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 61' ' ' ASN . . . . . . . . . . . . . 11.2 t-20 57.94 40.96 25.21 Favored 'General case' 0 N--CA 1.491 1.591 0 O-C-N 121.525 -0.734 . . . . 0.0 109.115 179.594 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 62' ' ' VAL . . . . . . . . . . . . . 11.5 p -75.98 132.32 33.32 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.501 0 O-C-N 121.595 -0.691 . . . . 0.0 110.046 -179.718 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 97.4 mt-10 -90.91 150.74 21.39 Favored 'General case' 0 N--CA 1.492 1.652 0 O-C-N 121.437 -0.789 . . . . 0.0 109.638 -179.89 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 64' ' ' TYR . . . . . 0.45 ' C ' ' OE1' ' A' ' 65' ' ' GLU . 53.9 p90 -156.4 164.07 38.72 Favored 'General case' 0 N--CA 1.49 1.544 0 O-C-N 121.175 -0.953 . . . . 0.0 110.207 -179.729 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 65' ' ' GLU . . . . . 0.602 ' CD ' ' N ' ' A' ' 65' ' ' GLU . 1.8 pm0 -152.61 156.64 39.67 Favored 'General case' 0 N--CA 1.49 1.529 0 N-CA-C 108.634 -0.876 . . . . 0.0 108.634 -179.465 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 66' ' ' VAL . . . . . . . . . . . . . 2.6 p -123.19 129.57 74.85 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.86 0 CA-C-O 121.533 0.683 . . . . 0.0 109.465 -179.82 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -75.96 160.68 77.99 Favored Pre-proline 0 N--CA 1.488 1.469 0 O-C-N 121.607 -0.683 . . . . 0.0 109.333 -179.78 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 68' ' ' PRO . . . . . . . . . . . . . 21.4 Cg_endo -59.76 111.83 1.08 Allowed 'Trans proline' 0 N--CA 1.495 1.61 0 C-N-CA 122.831 2.354 . . . . 0.0 111.738 179.905 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 69' ' ' VAL . . . . . . . . . . . . . 56.0 t -124.66 134.61 66.35 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.917 0 N-CA-C 109.136 -0.69 . . . . 0.0 109.136 179.987 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -67.02 149.83 50.08 Favored 'General case' 0 C--N 1.304 -1.41 0 O-C-N 121.527 -0.733 . . . . 0.0 110.27 -179.625 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 71' ' ' ASP . . . . . 0.547 ' OD1' ' N ' ' A' ' 72' ' ' ASN . 48.2 p-10 -64.75 -29.51 70.49 Favored 'General case' 0 N--CA 1.488 1.456 0 O-C-N 121.565 -0.709 . . . . 0.0 109.566 179.797 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 72' ' ' ASN . . . . . 0.547 ' N ' ' OD1' ' A' ' 71' ' ' ASP . 10.7 m120 -90.27 8.28 34.04 Favored 'General case' 0 N--CA 1.49 1.548 0 O-C-N 121.299 -0.876 . . . . 0.0 108.959 -179.942 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -68.76 148.75 49.88 Favored 'General case' 0 N--CA 1.49 1.564 0 O-C-N 121.506 -0.746 . . . . 0.0 110.464 -179.613 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 74' ' ' THR . . . . . 0.441 ' H ' ' HG1' ' A' ' 74' ' ' THR . 12.7 p -100.27 3.71 43.68 Favored 'General case' 0 N--CA 1.494 1.764 0 O-C-N 121.451 -0.78 . . . . 0.0 109.471 179.821 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 22.2 pt-20 -142.28 160.96 39.22 Favored 'General case' 0 N--CA 1.495 1.819 0 O-C-N 121.137 -0.977 . . . . 0.0 109.55 179.796 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 9.9 tp -127.55 135.03 49.76 Favored 'General case' 0 N--CA 1.493 1.717 0 O-C-N 121.636 -0.665 . . . . 0.0 109.285 -179.88 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 77' ' ' HIS . . . . . . . . . . . . . 75.1 m80 -108.4 128.63 54.94 Favored 'General case' 0 N--CA 1.494 1.768 0 N-CA-C 109.16 -0.681 . . . . 0.0 109.16 179.699 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -151.79 154.57 36.49 Favored 'General case' 0 N--CA 1.489 1.506 0 O-C-N 121.258 -0.901 . . . . 0.0 109.369 179.992 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 79' ' ' ARG . . . . . 0.455 ' O ' ' OE2' ' A' ' 65' ' ' GLU . 84.5 mtt85 -128.74 150.43 50.28 Favored 'General case' 0 N--CA 1.493 1.724 0 N-CA-C 109.311 -0.626 . . . . 0.0 109.311 -179.834 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 80' ' ' PHE . . . . . . . . . . . . . 83.1 m-85 -130.58 147.75 52.3 Favored 'General case' 0 N--CA 1.494 1.774 0 O-C-N 121.609 -0.682 . . . . 0.0 109.22 -179.742 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 49.5 mttm -113.67 139.05 49.38 Favored 'General case' 0 N--CA 1.495 1.819 0 N-CA-C 109.173 -0.676 . . . . 0.0 109.173 179.833 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 82' ' ' PHE . . . . . . . . . . . . . 79.2 m-85 -133.19 158.8 41.95 Favored 'General case' 0 N--CA 1.495 1.786 0 CA-C-O 121.496 0.665 . . . . 0.0 109.872 -179.582 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 81.7 tt0 -65.52 -37.66 87.42 Favored 'General case' 0 C--N 1.303 -1.423 0 O-C-N 121.543 -0.723 . . . . 0.0 109.559 179.953 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 84' ' ' VAL . . . . . . . . . . . . . 35.7 m -136.08 159.56 38.89 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.961 0 O-C-N 121.378 -0.826 . . . . 0.0 110.282 -179.549 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 85' ' ' SER . . . . . 0.509 ' O ' ' N ' ' A' ' 88' ' ' LYS . 38.6 t -64.77 -38.95 92.71 Favored 'General case' 0 N--CA 1.49 1.556 0 O-C-N 121.791 -0.568 . . . . 0.0 110.191 -179.946 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 86' ' ' ALA . . . . . . . . . . . . . . . -40.8 -39.46 1.12 Allowed 'General case' 0 N--CA 1.494 1.767 0 O-C-N 121.607 -0.683 . . . . 0.0 110.24 -179.353 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 87' ' ' GLU . . . . . 0.475 ' OE1' ' CG1' ' A' ' 58' ' ' VAL . 79.5 mm-40 -66.02 -34.03 77.16 Favored 'General case' 0 N--CA 1.488 1.432 0 O-C-N 121.508 -0.745 . . . . 0.0 109.477 179.751 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 88' ' ' LYS . . . . . 0.509 ' N ' ' O ' ' A' ' 85' ' ' SER . 88.5 tttt -62.15 -44.9 95.61 Favored 'General case' 0 N--CA 1.489 1.509 0 O-C-N 121.297 -0.877 . . . . 0.0 109.936 -179.988 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 50.7 tp -62.56 -50.35 71.68 Favored 'General case' 0 N--CA 1.489 1.483 0 O-C-N 121.271 -0.893 . . . . 0.0 110.234 -178.905 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 90' ' ' ILE . . . . . 0.52 ' CD1' ' N ' ' A' ' 90' ' ' ILE . 1.4 mp -69.27 -45.42 79.27 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.567 0 O-C-N 121.302 -0.874 . . . . 0.0 109.853 -179.684 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 91' ' ' PHE . . . . . . . . . . . . . 69.7 t80 -62.59 -44.66 95.76 Favored 'General case' 0 N--CA 1.489 1.51 0 O-C-N 121.388 -0.82 . . . . 0.0 110.168 -179.551 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 92' ' ' GLU . . . . . 0.515 ' OE2' ' NH2' ' A' ' 96' ' ' ARG . 83.0 tt0 -62.36 -38.74 90.71 Favored 'General case' 0 C--N 1.305 -1.369 0 O-C-N 121.358 -0.839 . . . . 0.0 109.95 -179.36 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 93' ' ' LEU . . . . . . . . . . . . . 39.3 mt -63.2 -44.4 95.43 Favored 'General case' 0 N--CA 1.49 1.55 0 O-C-N 121.209 -0.932 . . . . 0.0 109.97 -179.574 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 94' ' ' LYS . . . . . . . . . . . . . 60.9 mttp -66.32 -44.15 84.19 Favored 'General case' 0 N--CA 1.488 1.467 0 O-C-N 121.183 -0.948 . . . . 0.0 110.128 -179.993 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 34.3 p -68.31 -35.82 78.39 Favored 'General case' 0 N--CA 1.487 1.423 0 O-C-N 121.338 -0.851 . . . . 0.0 109.714 -179.654 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 96' ' ' ARG . . . . . 0.515 ' NH2' ' OE2' ' A' ' 92' ' ' GLU . 19.3 tpp180 -68.08 -39.53 82.91 Favored 'General case' 0 N--CA 1.488 1.467 0 O-C-N 121.197 -0.94 . . . . 0.0 108.773 179.608 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 97' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.486 1.372 0 O-C-N 121.337 -0.852 . . . . 0.0 109.097 179.935 . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 99.6 m-20 . . . . . 0 N--CA 1.49 1.543 0 CA-C-O 121.363 0.602 . . . . 0.0 109.44 . . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 9.2 p -86.16 161.34 2.98 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.635 0 O-C-N 121.34 -0.85 . . . . 0.0 109.608 -179.67 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -143.61 139.42 29.63 Favored 'General case' 0 N--CA 1.493 1.721 0 O-C-N 121.294 -0.879 . . . . 0.0 109.016 179.835 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 83.7 tt0 -101.38 142.75 32.33 Favored 'General case' 0 N--CA 1.494 1.755 0 O-C-N 121.403 -0.81 . . . . 0.0 109.132 179.989 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 34' ' ' VAL . . . . . . . . . . . . . 52.4 t -122.54 131.56 72.97 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.905 0 N-CA-C 108.905 -0.776 . . . . 0.0 108.905 179.812 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 35.3 m -111.17 123.41 50.15 Favored 'General case' 0 N--CA 1.494 1.735 0 N-CA-C 108.658 -0.867 . . . . 0.0 108.658 179.904 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 26.3 mt -119.23 149.41 41.81 Favored 'General case' 0 N--CA 1.497 1.887 0 O-C-N 121.501 -0.75 . . . . 0.0 109.649 -179.436 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 37' ' ' PHE . . . . . . . . . . . . . 97.0 m-85 -128.74 147.36 50.76 Favored 'General case' 0 N--CA 1.493 1.717 0 N-CA-C 109.083 -0.71 . . . . 0.0 109.083 -179.405 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . -177.79 -177.65 46.75 Favored Glycine 0 N--CA 1.487 2.091 0 N-CA-C 109.474 -1.45 . . . . 0.0 109.474 -179.865 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 39' ' ' SER . . . . . 0.645 ' HG ' ' H ' ' A' ' 40' ' ' ASP . 8.7 p -87.48 -81.64 0.23 Allowed 'General case' 0 N--CA 1.489 1.498 0 O-C-N 121.387 -1.066 . . . . 0.0 109.824 -179.911 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 40' ' ' ASP . . . . . 0.645 ' H ' ' HG ' ' A' ' 39' ' ' SER . 52.4 p30 -87.78 168.51 12.89 Favored 'General case' 0 N--CA 1.493 1.724 0 O-C-N 121.464 -0.772 . . . . 0.0 110.399 -179.445 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 88.6 tttt -65.93 -36.63 83.9 Favored 'General case' 0 N--CA 1.49 1.555 0 O-C-N 121.674 -0.641 . . . . 0.0 110.188 179.883 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -57.64 -41.62 81.76 Favored 'General case' 0 N--CA 1.492 1.629 0 O-C-N 121.272 -0.893 . . . . 0.0 110.155 -179.106 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 43' ' ' HIS . . . . . . . . . . . . . 80.0 t60 -63.39 -42.13 98.79 Favored 'General case' 0 N--CA 1.489 1.516 0 O-C-N 121.169 -0.957 . . . . 0.0 109.42 -179.788 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 95.3 mt -63.47 -40.54 97.39 Favored 'General case' 0 N--CA 1.489 1.514 0 O-C-N 121.399 -0.813 . . . . 0.0 109.827 -179.671 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 74.5 mt-10 -62.75 -39.68 94.9 Favored 'General case' 0 N--CA 1.488 1.437 0 O-C-N 121.239 -0.913 . . . . 0.0 109.759 -179.639 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . -65.01 -45.17 93.1 Favored Glycine 0 N--CA 1.49 2.287 0 N-CA-C 109.671 -1.372 . . . . 0.0 109.671 -179.844 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 16.9 tptm -64.95 -36.03 83.07 Favored 'General case' 0 N--CA 1.489 1.509 0 O-C-N 121.27 -1.135 . . . . 0.0 109.236 179.882 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 60.8 tp -61.73 -39.5 91.74 Favored 'General case' 0 N--CA 1.488 1.451 0 O-C-N 121.339 -0.851 . . . . 0.0 109.345 -179.707 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 49' ' ' ALA . . . . . . . . . . . . . . . -54.03 -34.01 58.81 Favored 'General case' 0 N--CA 1.488 1.468 0 O-C-N 121.336 -0.852 . . . . 0.0 109.823 -179.627 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 79.3 mm-40 -65.31 -41.04 94.46 Favored 'General case' 0 N--CA 1.491 1.599 0 O-C-N 121.226 -0.921 . . . . 0.0 109.713 -179.981 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 10.8 m-85 -60.78 -39.67 89.72 Favored 'General case' 0 N--CA 1.491 1.581 0 O-C-N 121.487 -0.758 . . . . 0.0 109.552 -179.631 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 52' ' ' ILE . . . . . . . . . . . . . 34.1 mm -63.59 -43.51 98.25 Favored 'Isoleucine or valine' 0 C--N 1.301 -1.536 0 O-C-N 121.39 -0.819 . . . . 0.0 109.491 -179.484 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 53' ' ' SER . . . . . 0.481 ' O ' ' NE2' ' A' ' 57' ' ' GLN . 71.1 m -60.32 -51.7 68.4 Favored 'General case' 0 N--CA 1.492 1.674 0 O-C-N 121.081 -1.012 . . . . 0.0 110.136 -179.488 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 54' ' ' LEU . . . . . . . . . . . . . 10.4 mp -65.07 -41.68 94.86 Favored 'General case' 0 N--CA 1.491 1.587 0 O-C-N 121.166 -0.958 . . . . 0.0 109.418 179.785 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -64.67 -39.38 93.57 Favored 'General case' 0 N--CA 1.488 1.428 0 O-C-N 121.282 -0.886 . . . . 0.0 109.731 -179.692 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 56' ' ' LYS . . . . . . . . . . . . . 50.9 tttp -64.08 -45.17 89.91 Favored 'General case' 0 C--N 1.305 -1.36 0 O-C-N 121.237 -0.915 . . . . 0.0 109.393 -179.94 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 57' ' ' GLN . . . . . 0.534 ' OE1' ' N ' ' A' ' 57' ' ' GLN . 0.8 OUTLIER -65.73 -43.78 87.99 Favored 'General case' 0 N--CA 1.488 1.439 0 O-C-N 121.418 -0.801 . . . . 0.0 109.508 -179.853 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 58' ' ' VAL . . . . . . . . . . . . . 56.0 t -63.35 -45.81 97.14 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.39 0 O-C-N 121.25 -0.906 . . . . 0.0 109.453 -179.801 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 59' ' ' TYR . . . . . . . . . . . . . 71.4 t80 -137.79 119.11 14.65 Favored 'General case' 0 N--CA 1.494 1.752 0 O-C-N 121.334 -0.854 . . . . 0.0 109.578 -179.502 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -69.75 153.53 43.24 Favored 'General case' 0 N--CA 1.493 1.682 0 O-C-N 121.563 -0.71 . . . . 0.0 110.538 -179.486 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 61' ' ' ASN . . . . . . . . . . . . . 98.2 m-20 57.73 36.44 26.57 Favored 'General case' 0 N--CA 1.494 1.746 0 O-C-N 121.752 -0.592 . . . . 0.0 109.671 179.897 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 62' ' ' VAL . . . . . . . . . . . . . 12.3 p -72.65 138.45 21.44 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.583 0 O-C-N 121.436 -0.79 . . . . 0.0 109.858 179.933 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 83.1 tt0 -115.61 142.19 47.07 Favored 'General case' 0 N--CA 1.497 1.921 0 O-C-N 121.571 -0.705 . . . . 0.0 109.313 -179.878 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 64' ' ' TYR . . . . . . . . . . . . . 51.4 p90 -148.29 161.27 41.86 Favored 'General case' 0 N--CA 1.493 1.709 0 O-C-N 121.365 -0.834 . . . . 0.0 109.539 -179.866 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 51.1 tp10 -141.0 147.76 39.21 Favored 'General case' 0 N--CA 1.495 1.799 0 N-CA-C 108.687 -0.857 . . . . 0.0 108.687 179.911 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 66' ' ' VAL . . . . . . . . . . . . . 28.8 m -117.82 129.08 74.77 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.805 0 CA-C-O 121.688 0.756 . . . . 0.0 109.953 -179.472 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -70.65 171.81 7.44 Favored Pre-proline 0 N--CA 1.49 1.558 0 O-C-N 121.657 -0.652 . . . . 0.0 109.61 -179.417 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 68' ' ' PRO . . . . . . . . . . . . . 73.2 Cg_exo -50.86 129.89 29.2 Favored 'Trans proline' 0 N--CA 1.497 1.7 0 C-N-CA 122.355 2.037 . . . . 0.0 112.399 179.891 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 69' ' ' VAL . . . . . . . . . . . . . 54.4 t -131.04 134.42 61.53 Favored 'Isoleucine or valine' 0 N--CA 1.499 2.016 0 O-C-N 121.455 -0.778 . . . . 0.0 109.247 179.814 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -83.36 159.73 21.78 Favored 'General case' 0 N--CA 1.491 1.577 0 O-C-N 121.434 -0.792 . . . . 0.0 109.897 -179.913 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 53.3 t0 -64.12 -36.08 82.85 Favored 'General case' 0 N--CA 1.491 1.604 0 O-C-N 121.5 -0.75 . . . . 0.0 109.662 179.562 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 72' ' ' ASN . . . . . . . . . . . . . 55.7 p30 -96.67 17.33 16.69 Favored 'General case' 0 N--CA 1.495 1.778 0 O-C-N 121.235 -0.916 . . . . 0.0 109.237 -179.726 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -61.88 144.23 55.23 Favored 'General case' 0 N--CA 1.492 1.64 0 O-C-N 121.414 -0.804 . . . . 0.0 110.167 -179.641 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 74' ' ' THR . . . . . . . . . . . . . 71.8 p -101.79 -3.07 28.69 Favored 'General case' 0 N--CA 1.496 1.826 0 O-C-N 121.48 -0.763 . . . . 0.0 109.467 179.703 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 17.0 pt-20 -148.62 158.69 44.31 Favored 'General case' 0 N--CA 1.494 1.744 0 O-C-N 121.145 -0.972 . . . . 0.0 109.361 179.624 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 5.7 tt -131.7 134.52 46.0 Favored 'General case' 0 N--CA 1.496 1.829 0 O-C-N 121.521 -0.737 . . . . 0.0 109.237 -179.981 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 77' ' ' HIS . . . . . . . . . . . . . 98.2 m-70 -103.28 130.59 50.58 Favored 'General case' 0 N--CA 1.494 1.738 0 N-CA-C 109.255 -0.646 . . . . 0.0 109.255 -179.642 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -142.53 155.01 44.98 Favored 'General case' 0 N--CA 1.494 1.725 0 O-C-N 121.286 -0.884 . . . . 0.0 109.517 -179.726 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 83.9 mtp180 -127.95 148.11 50.5 Favored 'General case' 0 N--CA 1.494 1.745 0 N-CA-C 108.957 -0.757 . . . . 0.0 108.957 -179.86 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 80' ' ' PHE . . . . . . . . . . . . . 62.4 m-85 -129.33 147.83 51.2 Favored 'General case' 0 N--CA 1.496 1.862 0 O-C-N 121.555 -0.716 . . . . 0.0 109.285 -179.572 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 70.9 mmtt -112.6 104.1 12.18 Favored 'General case' 0 N--CA 1.496 1.827 0 N-CA-C 108.79 -0.818 . . . . 0.0 108.79 -179.996 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 82' ' ' PHE . . . . . . . . . . . . . 68.1 m-85 -98.91 148.92 23.47 Favored 'General case' 0 N--CA 1.492 1.636 0 O-C-N 121.591 -0.693 . . . . 0.0 109.871 -179.263 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 82.9 tt0 -65.4 -36.82 85.13 Favored 'General case' 0 N--CA 1.488 1.431 0 O-C-N 121.48 -0.762 . . . . 0.0 109.904 -179.648 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 84' ' ' VAL . . . . . . . . . . . . . 27.4 m -133.49 156.86 42.13 Favored 'Isoleucine or valine' 0 N--CA 1.499 2.021 0 O-C-N 121.333 -0.854 . . . . 0.0 110.073 -179.582 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 27.1 t -70.15 -17.43 63.18 Favored 'General case' 0 N--CA 1.488 1.443 0 O-C-N 121.573 -0.704 . . . . 0.0 109.529 179.899 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 86' ' ' ALA . . . . . . . . . . . . . . . -62.43 -41.17 98.52 Favored 'General case' 0 N--CA 1.49 1.528 0 O-C-N 121.256 -0.902 . . . . 0.0 109.537 -179.722 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 98.9 mt-10 -65.59 -33.51 76.07 Favored 'General case' 0 C--N 1.302 -1.475 0 O-C-N 121.458 -0.776 . . . . 0.0 109.024 179.642 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 88' ' ' LYS . . . . . . . . . . . . . 88.2 tttt -62.98 -43.96 97.36 Favored 'General case' 0 C--N 1.303 -1.433 0 O-C-N 121.449 -0.782 . . . . 0.0 109.979 179.836 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 96.3 mt -62.42 -48.11 81.13 Favored 'General case' 0 N--CA 1.488 1.427 0 O-C-N 121.193 -0.942 . . . . 0.0 109.884 -179.04 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 90' ' ' ILE . . . . . 0.521 ' CD1' ' N ' ' A' ' 90' ' ' ILE . 1.4 mp -70.58 -44.44 76.8 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.599 0 O-C-N 121.3 -0.875 . . . . 0.0 109.312 179.639 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 91' ' ' PHE . . . . . 0.439 ' O ' ' OG1' ' A' ' 95' ' ' THR . 70.6 t80 -59.13 -44.56 92.03 Favored 'General case' 0 C--N 1.299 -1.606 0 O-C-N 121.461 -0.774 . . . . 0.0 109.883 -179.196 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 92' ' ' GLU . . . . . . . . . . . . . 42.8 tp10 -63.18 -59.09 5.22 Favored 'General case' 0 N--CA 1.49 1.527 0 O-C-N 121.26 -0.9 . . . . 0.0 110.3 -179.322 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 93' ' ' LEU . . . . . 0.428 ' N ' ' CD1' ' A' ' 93' ' ' LEU . 8.8 mp -63.1 -42.67 99.63 Favored 'General case' 0 N--CA 1.492 1.65 0 O-C-N 121.315 -0.866 . . . . 0.0 109.954 -179.347 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 94' ' ' LYS . . . . . . . . . . . . . 64.2 tttp -62.86 -45.29 93.27 Favored 'General case' 0 C--N 1.301 -1.505 0 O-C-N 121.298 -0.876 . . . . 0.0 109.834 -179.682 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 95' ' ' THR . . . . . 0.439 ' OG1' ' O ' ' A' ' 91' ' ' PHE . 22.0 p -65.97 -43.03 89.08 Favored 'General case' 0 N--CA 1.488 1.452 0 O-C-N 121.117 -0.989 . . . . 0.0 109.354 179.709 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 96' ' ' ARG . . . . . . . . . . . . . 93.0 mtt-85 -64.35 -38.51 91.29 Favored 'General case' 0 N--CA 1.487 1.381 0 O-C-N 121.278 -0.889 . . . . 0.0 109.02 179.36 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 97' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.304 -1.388 0 O-C-N 121.537 -0.727 . . . . 0.0 109.182 179.756 . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 44.2 p30 . . . . . 0 N--CA 1.493 1.7 0 N-CA-C 109.007 -0.738 . . . . 0.0 109.007 . . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' A' A ' 31' ' ' VAL . . . . . 0.422 ' CG1' HH21 ' A' ' 79' ' ' ARG . 93.3 t -118.71 134.56 61.93 Favored 'Isoleucine or valine' 0 N--CA 1.499 2.016 0 CA-C-O 121.712 0.768 . . . . 0.0 109.452 -179.822 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -98.88 157.2 16.47 Favored 'General case' 0 N--CA 1.494 1.745 0 CA-C-O 121.787 0.803 . . . . 0.0 110.409 -179.019 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 33' ' ' GLU . . . . . 0.424 ' OE1' ' CD ' ' A' ' 79' ' ' ARG . 48.9 tp10 -108.03 126.0 52.22 Favored 'General case' 0 N--CA 1.493 1.7 0 CA-C-O 121.716 0.769 . . . . 0.0 110.13 -179.186 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 34' ' ' VAL . . . . . . . . . . . . . 54.0 t -124.24 133.62 68.85 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.875 0 CA-C-O 121.629 0.728 . . . . 0.0 109.626 179.635 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 74.0 p -137.03 126.91 25.72 Favored 'General case' 0 N--CA 1.494 1.752 0 CA-C-O 121.854 0.835 . . . . 0.0 110.042 179.276 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 40.0 tp -117.41 132.41 56.58 Favored 'General case' 0 N--CA 1.49 1.527 0 CA-C-O 121.665 0.745 . . . . 0.0 109.788 179.74 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 37' ' ' PHE . . . . . . . . . . . . . 90.7 t80 -109.04 131.1 55.4 Favored 'General case' 0 N--CA 1.493 1.707 0 CA-C-O 121.868 0.842 . . . . 0.0 109.582 179.99 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . -173.14 -164.23 28.15 Favored Glycine 0 N--CA 1.487 2.061 0 N-CA-C 109.867 -1.293 . . . . 0.0 109.867 -179.689 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 39' ' ' SER . . . . . 0.653 ' HG ' ' H ' ' A' ' 40' ' ' ASP . 22.9 t -62.55 -147.56 0.0 OUTLIER 'General case' 0 N--CA 1.49 1.534 0 O-C-N 121.891 -0.77 . . . . 0.0 110.726 -179.237 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 40' ' ' ASP . . . . . 0.653 ' H ' ' HG ' ' A' ' 39' ' ' SER . 44.6 p-10 -55.94 174.77 0.11 Allowed 'General case' 0 N--CA 1.488 1.444 0 CA-C-O 121.771 0.795 . . . . 0.0 110.807 -178.812 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 88.7 tttt -62.53 -41.16 98.69 Favored 'General case' 0 N--CA 1.49 1.554 0 CA-C-O 121.225 0.536 . . . . 0.0 109.868 -179.075 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -53.67 -46.83 70.76 Favored 'General case' 0 N--CA 1.492 1.647 0 O-C-N 121.897 -0.502 . . . . 0.0 109.978 -178.965 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 43' ' ' HIS . . . . . . . . . . . . . 59.1 t-80 -62.96 -40.8 98.78 Favored 'General case' 0 C--N 1.302 -1.476 0 O-C-N 121.749 -0.595 . . . . 0.0 109.462 -179.619 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 95.1 mt -63.33 -39.99 96.08 Favored 'General case' 0 N--CA 1.491 1.592 0 O-C-N 121.805 -0.559 . . . . 0.0 109.546 -179.702 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 95.1 mt-10 -61.28 -41.02 96.24 Favored 'General case' 0 N--CA 1.49 1.555 0 N-CA-C 109.262 -0.644 . . . . 0.0 109.262 -179.756 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . -61.17 -42.5 99.8 Favored Glycine 0 N--CA 1.492 2.376 0 N-CA-C 109.65 -1.38 . . . . 0.0 109.65 -179.725 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 71.2 mmtt -81.53 -21.14 38.76 Favored 'General case' 0 N--CA 1.492 1.647 0 O-C-N 121.702 -0.881 . . . . 0.0 108.953 -179.801 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 44.9 tp -63.41 -40.15 96.42 Favored 'General case' 0 N--CA 1.489 1.504 0 CA-C-O 121.308 0.575 . . . . 0.0 109.48 -179.694 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 49' ' ' ALA . . . . . . . . . . . . . . . -49.89 -38.16 34.52 Favored 'General case' 0 N--CA 1.492 1.628 0 O-C-N 121.846 -0.534 . . . . 0.0 109.933 -178.635 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 50' ' ' GLU . . . . . 0.52 ' OE1' ' N ' ' A' ' 50' ' ' GLU . 56.5 mp0 -68.01 -43.14 79.5 Favored 'General case' 0 N--CA 1.491 1.581 0 O-C-N 121.635 -0.666 . . . . 0.0 109.777 -179.929 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 10.0 m-85 -63.07 -45.48 91.97 Favored 'General case' 0 N--CA 1.492 1.635 0 N-CA-C 109.58 -0.526 . . . . 0.0 109.58 -179.337 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 52' ' ' ILE . . . . . . . . . . . . . 92.0 mt -64.97 -42.75 95.57 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.531 0 N-CA-C 109.331 -0.618 . . . . 0.0 109.331 -179.746 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 49.6 m -57.43 -41.31 80.21 Favored 'General case' 0 N--CA 1.495 1.776 0 O-C-N 121.815 -0.553 . . . . 0.0 109.608 -179.151 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 54' ' ' LEU . . . . . . . . . . . . . 82.6 mt -63.35 -40.21 96.64 Favored 'General case' 0 N--CA 1.491 1.584 0 N-CA-C 109.336 -0.616 . . . . 0.0 109.336 179.964 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -59.26 -42.77 91.96 Favored 'General case' 0 N--CA 1.489 1.484 0 N-CA-C 109.194 -0.669 . . . . 0.0 109.194 -179.417 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 56' ' ' LYS . . . . . . . . . . . . . 64.1 tttp -65.46 -41.02 93.85 Favored 'General case' 0 N--CA 1.486 1.339 0 CA-C-O 121.265 0.555 . . . . 0.0 109.624 179.984 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 16.5 tt0 -64.07 -43.75 94.5 Favored 'General case' 0 N--CA 1.491 1.58 0 O-C-N 121.76 -0.587 . . . . 0.0 109.587 -179.274 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 58' ' ' VAL . . . . . . . . . . . . . 72.1 t -65.38 -44.89 94.45 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.563 0 N-CA-C 109.561 -0.533 . . . . 0.0 109.561 -179.708 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 59' ' ' TYR . . . . . 0.417 ' O ' ' O ' ' A' ' 60' ' ' ALA . 58.4 t80 -127.12 132.33 50.61 Favored 'General case' 0 N--CA 1.498 1.945 0 CA-C-O 121.812 0.815 . . . . 0.0 109.611 -179.595 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 60' ' ' ALA . . . . . 0.417 ' O ' ' O ' ' A' ' 59' ' ' TYR . . . -42.34 -97.0 0.0 OUTLIER 'General case' 0 N--CA 1.491 1.593 0 CA-C-O 121.378 0.608 . . . . 0.0 110.739 -179.281 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 61' ' ' ASN . . . . . . . . . . . . . 20.2 t-20 -85.05 92.62 8.4 Favored 'General case' 0 N--CA 1.491 1.581 0 CA-C-O 121.713 0.768 . . . . 0.0 109.856 -178.74 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 62' ' ' VAL . . . . . . . . . . . . . 10.9 p -99.45 133.71 41.27 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.717 0 CA-C-O 121.801 0.81 . . . . 0.0 110.037 179.995 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 81.0 tt0 -105.13 143.7 32.95 Favored 'General case' 0 N--CA 1.49 1.546 0 CA-C-O 121.702 0.763 . . . . 0.0 109.283 179.979 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 64' ' ' TYR . . . . . . . . . . . . . 51.0 p90 -151.96 161.15 43.1 Favored 'General case' 0 C--N 1.303 -1.443 0 CA-C-O 121.962 0.887 . . . . 0.0 110.493 -179.594 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 47.7 tp10 -147.18 146.95 30.04 Favored 'General case' 0 N--CA 1.49 1.57 0 CA-C-O 121.729 0.776 . . . . 0.0 109.32 179.83 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 66' ' ' VAL . . . . . . . . . . . . . 88.4 t -102.57 125.13 56.91 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.707 0 CA-C-O 121.866 0.841 . . . . 0.0 109.935 -179.926 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -76.97 171.08 13.36 Favored Pre-proline 0 C--N 1.304 -1.41 0 CA-C-O 121.227 0.536 . . . . 0.0 109.935 -179.72 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 68' ' ' PRO . . . . . . . . . . . . . 51.1 Cg_exo -54.48 137.32 72.38 Favored 'Trans proline' 0 N--CA 1.496 1.62 0 C-N-CA 122.965 2.443 . . . . 0.0 113.057 -179.923 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 69' ' ' VAL . . . . . 0.481 ' C ' ' H ' ' A' ' 71' ' ' ASP . 73.2 t -128.39 131.91 68.57 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.928 0 CA-C-O 121.848 0.832 . . . . 0.0 110.087 179.963 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 70' ' ' ALA . . . . . 0.646 ' O ' ' N ' ' A' ' 72' ' ' ASN . . . -74.8 34.25 0.1 Allowed 'General case' 0 N--CA 1.491 1.6 0 CA-C-N 116.154 -0.475 . . . . 0.0 109.963 179.811 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 71' ' ' ASP . . . . . 0.481 ' H ' ' C ' ' A' ' 69' ' ' VAL . 66.4 t0 54.78 -72.52 0.01 OUTLIER 'General case' 0 N--CA 1.493 1.708 0 CA-C-O 121.448 0.642 . . . . 0.0 109.969 179.693 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 72' ' ' ASN . . . . . 0.646 ' N ' ' O ' ' A' ' 70' ' ' ALA . 63.8 t30 -84.67 12.54 6.99 Favored 'General case' 0 C--N 1.301 -1.533 0 N-CA-C 108.626 -0.879 . . . . 0.0 108.626 179.941 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 73' ' ' ALA . . . . . 0.532 ' C ' ' H ' ' A' ' 75' ' ' GLU . . . -52.16 -6.53 0.05 OUTLIER 'General case' 0 N--CA 1.497 1.902 0 N-CA-C 109.503 -0.554 . . . . 0.0 109.503 179.95 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 74' ' ' THR . . . . . 0.56 ' H ' ' C ' ' A' ' 72' ' ' ASN . 70.4 p 51.03 11.59 0.1 Allowed 'General case' 0 C--N 1.304 -1.411 0 CA-C-O 121.469 0.652 . . . . 0.0 109.296 -179.771 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 75' ' ' GLU . . . . . 0.532 ' H ' ' C ' ' A' ' 73' ' ' ALA . 81.9 tt0 -149.63 151.98 34.66 Favored 'General case' 0 C--N 1.302 -1.457 0 CA-C-O 121.666 0.746 . . . . 0.0 109.446 179.582 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 7.2 tt -128.31 131.08 48.67 Favored 'General case' 0 N--CA 1.489 1.493 0 CA-C-O 121.796 0.807 . . . . 0.0 109.798 179.848 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 77' ' ' HIS . . . . . . . . . . . . . 98.3 m-70 -101.91 128.87 48.11 Favored 'General case' 0 N--CA 1.495 1.781 0 CA-C-O 121.906 0.86 . . . . 0.0 109.92 -180.0 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -136.0 152.2 50.69 Favored 'General case' 0 N--CA 1.491 1.595 0 CA-C-O 121.674 0.749 . . . . 0.0 109.88 179.991 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 79' ' ' ARG . . . . . 0.424 ' CD ' ' OE1' ' A' ' 33' ' ' GLU . 50.1 mmm-85 -127.7 144.53 51.07 Favored 'General case' 0 N--CA 1.494 1.74 0 CA-C-O 121.755 0.788 . . . . 0.0 109.544 -179.25 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 80' ' ' PHE . . . . . . . . . . . . . 82.1 m-85 -130.6 150.78 51.64 Favored 'General case' 0 N--CA 1.494 1.741 0 CA-C-O 121.571 0.7 . . . . 0.0 109.819 -179.385 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 63.1 tttm -114.96 127.9 55.96 Favored 'General case' 0 N--CA 1.495 1.793 0 CA-C-O 121.722 0.772 . . . . 0.0 110.041 -179.514 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 82' ' ' PHE . . . . . . . . . . . . . 81.1 m-85 -129.37 143.9 51.03 Favored 'General case' 0 N--CA 1.496 1.852 0 CA-C-O 121.732 0.777 . . . . 0.0 109.904 179.579 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 6.8 pt-20 -69.39 -34.27 74.27 Favored 'General case' 0 N--CA 1.489 1.491 0 N-CA-C 109.487 -0.56 . . . . 0.0 109.487 -179.672 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 84' ' ' VAL . . . . . . . . . . . . . 26.8 m -131.37 161.03 41.86 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.924 0 CA-C-O 121.885 0.85 . . . . 0.0 110.29 -179.629 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 33.6 m -76.54 -17.48 59.22 Favored 'General case' 0 N--CA 1.492 1.653 0 CA-C-N 116.055 -0.521 . . . . 0.0 109.91 -179.209 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 86' ' ' ALA . . . . . . . . . . . . . . . -62.71 -40.83 98.38 Favored 'General case' 0 N--CA 1.491 1.61 0 N-CA-C 109.129 -0.693 . . . . 0.0 109.129 -179.435 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 97.4 mt-10 -71.69 -32.16 67.54 Favored 'General case' 0 N--CA 1.49 1.541 0 N-CA-C 109.112 -0.699 . . . . 0.0 109.112 179.889 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 88' ' ' LYS . . . . . . . . . . . . . 88.0 tttt -62.84 -47.58 82.76 Favored 'General case' 0 N--CA 1.489 1.506 0 O-C-N 121.789 -0.569 . . . . 0.0 109.51 -179.711 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 96.9 mt -63.76 -45.54 89.33 Favored 'General case' 0 N--CA 1.491 1.587 0 O-C-N 121.745 -0.597 . . . . 0.0 110.151 -179.1 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 90' ' ' ILE . . . . . . . . . . . . . 96.9 mt -68.32 -43.96 84.07 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.636 0 CA-C-O 121.399 0.619 . . . . 0.0 109.41 -179.717 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 91' ' ' PHE . . . . . . . . . . . . . 40.3 t80 -61.78 -46.95 87.37 Favored 'General case' 0 N--CA 1.489 1.486 0 N-CA-C 109.28 -0.637 . . . . 0.0 109.28 -179.512 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 92' ' ' GLU . . . . . . . . . . . . . 95.4 mt-10 -67.32 -33.76 75.94 Favored 'General case' 0 N--CA 1.489 1.477 0 N-CA-C 109.142 -0.688 . . . . 0.0 109.142 179.751 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 93' ' ' LEU . . . . . . . . . . . . . 49.4 tp -63.75 -45.68 88.74 Favored 'General case' 0 N--CA 1.487 1.379 0 CA-C-O 121.373 0.606 . . . . 0.0 109.42 -179.559 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 94' ' ' LYS . . . . . . . . . . . . . 7.9 mtpm? -66.98 -44.02 81.51 Favored 'General case' 0 N--CA 1.489 1.515 0 O-C-N 121.749 -0.595 . . . . 0.0 109.812 -179.446 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 67.0 p -67.53 -33.8 75.81 Favored 'General case' 0 N--CA 1.491 1.622 0 O-C-N 121.783 -0.573 . . . . 0.0 109.773 -179.262 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 96' ' ' ARG . . . . . . . . . . . . . 61.3 ttm-85 -62.62 -43.47 98.73 Favored 'General case' 0 N--CA 1.492 1.656 0 O-C-N 121.676 -0.64 . . . . 0.0 109.508 -179.563 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 97' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.492 1.647 0 N-CA-C 109.522 -0.547 . . . . 0.0 109.522 -179.661 . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 96.0 m-20 . . . . . 0 N--CA 1.494 1.77 0 N-CA-C 109.13 -0.693 . . . . 0.0 109.13 . . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 3.8 p -129.22 154.04 39.52 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.861 0 CA-C-O 121.641 0.734 . . . . 0.0 109.799 -179.69 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -122.51 142.02 51.03 Favored 'General case' 0 N--CA 1.496 1.853 0 CA-C-O 121.937 0.875 . . . . 0.0 109.819 -179.896 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 21.9 pt-20 -94.36 138.01 32.83 Favored 'General case' 0 N--CA 1.492 1.669 0 CA-C-O 121.782 0.801 . . . . 0.0 110.444 -179.154 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 34' ' ' VAL . . . . . . . . . . . . . 55.0 t -127.01 130.83 71.32 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.834 0 CA-C-O 121.844 0.83 . . . . 0.0 109.263 179.371 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 51.1 m -133.53 128.73 35.91 Favored 'General case' 0 N--CA 1.495 1.809 0 CA-C-O 121.522 0.677 . . . . 0.0 109.315 179.355 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 74.1 mt -119.43 151.37 38.64 Favored 'General case' 0 N--CA 1.499 1.996 0 CA-C-O 121.863 0.84 . . . . 0.0 110.223 -179.39 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 37' ' ' PHE . . . . . . . . . . . . . 96.1 m-85 -124.56 137.92 54.36 Favored 'General case' 0 N--CA 1.497 1.881 0 CA-C-O 121.866 0.841 . . . . 0.0 109.702 -179.669 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . 177.2 179.89 47.73 Favored Glycine 0 N--CA 1.491 2.339 0 N-CA-C 110.296 -1.122 . . . . 0.0 110.296 -179.984 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 36.0 p -88.48 -76.69 0.39 Allowed 'General case' 0 N--CA 1.491 1.605 0 O-C-N 121.718 -0.871 . . . . 0.0 109.877 -179.705 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 40' ' ' ASP . . . . . . . . . . . . . 32.9 t70 -80.36 155.46 27.17 Favored 'General case' 0 N--CA 1.497 1.884 0 O-C-N 121.318 -0.864 . . . . 0.0 110.666 -179.2 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 88.8 tttt -63.37 -39.84 95.63 Favored 'General case' 0 N--CA 1.489 1.48 0 CA-C-O 121.107 0.479 . . . . 0.0 110.117 -179.645 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -54.93 -38.9 68.25 Favored 'General case' 0 N--CA 1.492 1.668 0 O-C-N 121.551 -0.718 . . . . 0.0 109.45 -178.951 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 43' ' ' HIS . . . . . 0.636 ' CE1' ' NZ ' ' A' ' 47' ' ' LYS . 11.5 t-160 -67.54 -42.27 82.97 Favored 'General case' 0 N--CA 1.495 1.778 0 O-C-N 121.751 -0.593 . . . . 0.0 109.409 -179.999 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 96.0 mt -63.02 -40.54 98.07 Favored 'General case' 0 N--CA 1.487 1.385 0 N-CA-C 106.527 -1.657 . . . . 0.0 106.527 178.72 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 77.0 mm-40 -64.36 -32.04 73.49 Favored 'General case' 0 N--CA 1.487 1.409 0 CA-C-N 115.726 -0.67 . . . . 0.0 109.446 179.241 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . -61.33 -50.0 71.5 Favored Glycine 0 N--CA 1.495 2.589 0 N-CA-C 109.507 -1.437 . . . . 0.0 109.507 -179.756 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 47' ' ' LYS . . . . . 0.636 ' NZ ' ' CE1' ' A' ' 43' ' ' HIS . 62.2 mttp -65.99 -38.62 88.98 Favored 'General case' 0 N--CA 1.49 1.536 0 O-C-N 121.678 -0.895 . . . . 0.0 109.039 179.561 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 61.8 tp -56.07 -34.19 65.73 Favored 'General case' 0 C--N 1.302 -1.471 0 N-CA-C 109.348 -0.612 . . . . 0.0 109.348 -179.167 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 49' ' ' ALA . . . . . . . . . . . . . . . -60.05 -38.07 81.72 Favored 'General case' 0 N--CA 1.492 1.655 0 O-C-N 121.614 -0.679 . . . . 0.0 109.183 -179.601 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 97.0 mt-10 -67.8 -38.51 83.42 Favored 'General case' 0 N--CA 1.491 1.617 0 O-C-N 121.638 -0.664 . . . . 0.0 109.308 179.786 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 8.3 m-85 -60.97 -45.5 94.5 Favored 'General case' 0 N--CA 1.493 1.676 0 N-CA-C 108.808 -0.812 . . . . 0.0 108.808 179.889 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 52' ' ' ILE . . . . . . . . . . . . . 92.0 mt -65.11 -44.63 95.55 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.557 0 N-CA-C 109.596 -0.52 . . . . 0.0 109.596 -179.828 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 66.9 m -62.9 -46.58 87.14 Favored 'General case' 0 N--CA 1.494 1.738 0 O-C-N 121.415 -0.803 . . . . 0.0 109.862 -179.459 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 54' ' ' LEU . . . . . . . . . . . . . 93.2 mt -65.94 -42.62 89.78 Favored 'General case' 0 N--CA 1.494 1.737 0 O-C-N 121.648 -0.657 . . . . 0.0 109.858 179.999 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -65.57 -38.82 90.64 Favored 'General case' 0 N--CA 1.491 1.589 0 O-C-N 121.81 -0.556 . . . . 0.0 110.015 -178.913 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 56' ' ' LYS . . . . . . . . . . . . . 66.1 tttm -64.82 -45.47 86.06 Favored 'General case' 0 N--CA 1.487 1.414 0 O-C-N 121.42 -0.8 . . . . 0.0 109.729 -179.426 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 29.0 mt-30 -66.38 -44.23 83.7 Favored 'General case' 0 N--CA 1.493 1.69 0 O-C-N 121.594 -0.692 . . . . 0.0 109.675 -179.606 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 58' ' ' VAL . . . . . . . . . . . . . 74.8 t -65.05 -44.65 95.79 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.536 0 N-CA-C 109.116 -0.698 . . . . 0.0 109.116 -179.637 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 59' ' ' TYR . . . . . . . . . . . . . 9.2 t80 -106.97 -143.5 0.38 Allowed 'General case' 0 N--CA 1.496 1.866 0 CA-C-O 121.498 0.666 . . . . 0.0 109.585 -179.676 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -164.79 125.01 1.96 Allowed 'General case' 0 N--CA 1.491 1.622 0 CA-C-O 121.851 0.834 . . . . 0.0 110.255 179.998 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 61' ' ' ASN . . . . . . . . . . . . . 30.8 t-20 57.92 36.24 26.06 Favored 'General case' 0 N--CA 1.493 1.682 0 CA-C-O 121.816 0.817 . . . . 0.0 109.127 179.738 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 62' ' ' VAL . . . . . . . . . . . . . 5.4 p -67.77 139.28 21.1 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.606 0 CA-C-O 121.776 0.798 . . . . 0.0 110.552 -179.653 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 49.9 tp10 -116.94 147.47 42.22 Favored 'General case' 0 N--CA 1.494 1.736 0 CA-C-O 121.65 0.738 . . . . 0.0 109.241 179.957 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 64' ' ' TYR . . . . . . . . . . . . . 48.3 p90 -149.39 166.18 29.83 Favored 'General case' 0 N--CA 1.49 1.556 0 CA-C-O 122.008 0.909 . . . . 0.0 110.798 -179.323 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 75.5 mm-40 -132.16 147.23 52.41 Favored 'General case' 0 N--CA 1.495 1.791 0 CA-C-O 121.496 0.665 . . . . 0.0 109.475 -179.711 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 66' ' ' VAL . . . . . . . . . . . . . 57.7 t -120.74 130.88 74.1 Favored 'Isoleucine or valine' 0 N--CA 1.5 2.058 0 CA-C-O 121.975 0.893 . . . . 0.0 109.968 -179.571 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -79.22 155.94 76.7 Favored Pre-proline 0 C--N 1.306 -1.299 0 N-CA-C 109.348 -0.612 . . . . 0.0 109.348 -179.484 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 68' ' ' PRO . . . . . . . . . . . . . 89.2 Cg_exo -45.71 127.94 10.39 Favored 'Trans proline' 0 N--CA 1.492 1.409 0 C-N-CA 122.612 2.208 . . . . 0.0 113.075 179.765 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 69' ' ' VAL . . . . . . . . . . . . . 47.9 t -130.89 132.46 63.88 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.898 0 CA-C-O 121.822 0.82 . . . . 0.0 110.057 179.807 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -73.29 151.96 41.14 Favored 'General case' 0 N--CA 1.49 1.527 0 CA-C-O 121.749 0.785 . . . . 0.0 110.146 179.328 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 71' ' ' ASP . . . . . 0.526 ' OD1' ' N ' ' A' ' 72' ' ' ASN . 41.5 p-10 -63.73 -35.11 79.5 Favored 'General case' 0 N--CA 1.489 1.505 0 O-C-N 121.769 -0.582 . . . . 0.0 109.607 -179.825 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 72' ' ' ASN . . . . . 0.526 ' N ' ' OD1' ' A' ' 71' ' ' ASP . 99.2 m-20 -95.59 15.3 20.23 Favored 'General case' 0 N--CA 1.494 1.742 0 N-CA-C 108.972 -0.751 . . . . 0.0 108.972 -179.556 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -61.09 146.93 45.6 Favored 'General case' 0 N--CA 1.498 1.954 0 CA-C-O 121.774 0.797 . . . . 0.0 110.704 -179.645 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 74' ' ' THR . . . . . . . . . . . . . 50.6 p -98.63 -1.68 40.28 Favored 'General case' 0 N--CA 1.498 1.943 0 O-C-N 121.751 -0.593 . . . . 0.0 109.467 -179.758 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 2.9 pp20? -156.13 160.1 39.61 Favored 'General case' 0 N--CA 1.495 1.78 0 O-C-N 121.243 -0.911 . . . . 0.0 110.395 179.695 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 5.4 tt -128.06 135.27 49.61 Favored 'General case' 0 N--CA 1.493 1.707 0 CA-C-O 121.565 0.697 . . . . 0.0 109.876 -179.869 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 77' ' ' HIS . . . . . . . . . . . . . 82.2 t60 -117.22 124.3 48.74 Favored 'General case' 0 N--CA 1.497 1.909 0 CA-C-O 122.143 0.973 . . . . 0.0 109.937 -179.883 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -152.62 159.65 43.22 Favored 'General case' 0 N--CA 1.49 1.565 0 CA-C-O 121.506 0.67 . . . . 0.0 109.591 179.708 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 96.5 mtt-85 -127.07 149.82 49.75 Favored 'General case' 0 N--CA 1.497 1.917 0 CA-C-O 121.553 0.692 . . . . 0.0 109.841 -179.528 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 80' ' ' PHE . . . . . . . . . . . . . 35.8 m-85 -122.9 149.68 43.91 Favored 'General case' 0 N--CA 1.497 1.902 0 CA-C-O 121.736 0.779 . . . . 0.0 109.62 -179.653 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 49.7 mtmt -108.56 115.12 29.51 Favored 'General case' 0 N--CA 1.494 1.749 0 CA-C-O 121.62 0.724 . . . . 0.0 109.437 -179.505 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 82' ' ' PHE . . . . . 0.681 ' C ' ' H ' ' A' ' 84' ' ' VAL . 53.6 m-85 -110.56 -0.7 17.21 Favored 'General case' 0 N--CA 1.497 1.889 0 N-CA-C 108.567 -0.901 . . . . 0.0 108.567 179.643 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 41.7 mm-40 63.62 -20.99 0.06 Allowed 'General case' 0 N--CA 1.492 1.657 0 N-CA-C 109.277 -0.638 . . . . 0.0 109.277 179.936 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 84' ' ' VAL . . . . . 0.681 ' H ' ' C ' ' A' ' 82' ' ' PHE . 3.3 m -133.83 133.58 56.49 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.519 0 CA-C-O 121.822 0.82 . . . . 0.0 109.674 -179.621 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 85' ' ' SER . . . . . 0.52 ' O ' ' N ' ' A' ' 88' ' ' LYS . 14.2 t -64.97 -41.0 95.82 Favored 'General case' 0 C--N 1.3 -1.581 0 CA-C-O 121.214 0.531 . . . . 0.0 110.156 179.919 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 86' ' ' ALA . . . . . 0.423 ' C ' ' O ' ' A' ' 85' ' ' SER . . . -41.15 -38.13 1.02 Allowed 'General case' 0 N--CA 1.496 1.854 0 O-C-N 121.514 -0.742 . . . . 0.0 110.121 -178.802 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -69.95 -32.88 71.36 Favored 'General case' 0 N--CA 1.489 1.5 0 O-C-N 121.481 -0.762 . . . . 0.0 109.517 -179.886 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 88' ' ' LYS . . . . . 0.52 ' N ' ' O ' ' A' ' 85' ' ' SER . 64.3 tttm -61.67 -47.19 86.49 Favored 'General case' 0 C--N 1.3 -1.569 0 O-C-N 121.845 -0.534 . . . . 0.0 109.88 -178.937 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 96.0 mt -64.76 -47.92 76.4 Favored 'General case' 0 N--CA 1.493 1.703 0 O-C-N 121.67 -0.644 . . . . 0.0 110.464 -178.94 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 90' ' ' ILE . . . . . . . . . . . . . 96.3 mt -69.6 -43.97 79.95 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.647 0 O-C-N 121.637 -0.665 . . . . 0.0 109.64 -179.887 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 91' ' ' PHE . . . . . . . . . . . . . 82.6 t80 -62.26 -44.74 95.85 Favored 'General case' 0 N--CA 1.493 1.717 0 O-C-N 121.59 -0.694 . . . . 0.0 109.354 -179.979 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 92' ' ' GLU . . . . . . . . . . . . . 81.4 tt0 -63.55 -43.12 97.99 Favored 'General case' 0 N--CA 1.489 1.507 0 N-CA-C 109.309 -0.626 . . . . 0.0 109.309 -179.576 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 93' ' ' LEU . . . . . . . . . . . . . 2.8 tt -63.26 -47.26 83.14 Favored 'General case' 0 N--CA 1.489 1.498 0 CA-C-O 121.667 0.746 . . . . 0.0 109.624 -179.119 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 94' ' ' LYS . . . . . . . . . . . . . 55.2 mtpt -63.9 -44.97 91.4 Favored 'General case' 0 N--CA 1.49 1.559 0 O-C-N 121.492 -0.755 . . . . 0.0 109.792 -179.177 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 14.4 p -66.48 -39.86 89.0 Favored 'General case' 0 N--CA 1.492 1.625 0 O-C-N 121.794 -0.566 . . . . 0.0 110.037 -179.539 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 96' ' ' ARG . . . . . . . . . . . . . 16.1 tpt85 -70.77 -17.99 62.77 Favored 'General case' 0 C--N 1.3 -1.555 0 O-C-N 121.562 -0.711 . . . . 0.0 109.788 -179.484 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 97' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.491 1.604 0 O-C-N 121.624 -0.673 . . . . 0.0 109.761 -179.25 . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 38.3 p30 . . . . . 0 N--CA 1.495 1.78 0 N-CA-C 108.822 -0.807 . . . . 0.0 108.822 . . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 53.3 t -115.99 133.59 61.97 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.9 0 CA-C-O 121.795 0.807 . . . . 0.0 109.41 179.934 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -97.98 154.18 17.86 Favored 'General case' 0 N--CA 1.494 1.744 0 CA-C-O 121.871 0.843 . . . . 0.0 110.135 -179.47 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 33' ' ' GLU . . . . . 0.508 ' OE2' ' NE2' ' A' ' 77' ' ' HIS . 49.7 tp10 -101.58 124.21 46.87 Favored 'General case' 0 N--CA 1.492 1.645 0 CA-C-O 121.515 0.674 . . . . 0.0 109.528 -179.667 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 34' ' ' VAL . . . . . . . . . . . . . 55.7 t -124.24 131.99 72.02 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.791 0 CA-C-O 121.889 0.852 . . . . 0.0 109.689 179.774 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 38.1 t -136.11 138.78 42.41 Favored 'General case' 0 N--CA 1.492 1.637 0 CA-C-O 121.545 0.688 . . . . 0.0 109.35 179.498 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 47.2 tp -126.89 139.33 53.16 Favored 'General case' 0 N--CA 1.493 1.719 0 CA-C-O 121.795 0.807 . . . . 0.0 110.076 -179.664 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 37' ' ' PHE . . . . . . . . . . . . . 96.9 m-85 -112.36 144.77 41.23 Favored 'General case' 0 N--CA 1.496 1.828 0 CA-C-O 121.797 0.808 . . . . 0.0 109.694 179.917 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . -171.0 176.35 44.41 Favored Glycine 0 N--CA 1.489 2.226 0 N-CA-C 110.23 -1.148 . . . . 0.0 110.23 -179.909 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 1.7 m -83.55 -71.59 0.5 Allowed 'General case' 0 N--CA 1.489 1.482 0 O-C-N 121.854 -0.792 . . . . 0.0 109.751 -179.758 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 40' ' ' ASP . . . . . . . . . . . . . 37.0 t70 -98.78 159.06 15.22 Favored 'General case' 0 N--CA 1.498 1.96 0 CA-C-O 121.952 0.882 . . . . 0.0 110.65 -179.223 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 41' ' ' LYS . . . . . 0.43 ' O ' ' OE1' ' A' ' 45' ' ' GLU . 64.5 tttm -62.79 -42.26 99.63 Favored 'General case' 0 N--CA 1.491 1.587 0 CA-C-N 116.091 -0.504 . . . . 0.0 110.213 -179.971 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -49.88 -43.08 49.15 Favored 'General case' 0 N--CA 1.493 1.71 0 O-C-N 121.591 -0.693 . . . . 0.0 109.747 -178.828 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 43' ' ' HIS . . . . . . . . . . . . . 79.7 m-70 -67.47 -42.42 83.04 Favored 'General case' 0 N--CA 1.49 1.527 0 O-C-N 121.701 -0.624 . . . . 0.0 109.506 -179.933 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 81.8 mt -64.27 -44.0 93.07 Favored 'General case' 0 N--CA 1.494 1.737 0 O-C-N 121.742 -0.599 . . . . 0.0 109.792 -179.633 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 45' ' ' GLU . . . . . 0.503 ' N ' ' OE1' ' A' ' 45' ' ' GLU . 2.7 mp0 -66.7 -40.51 88.51 Favored 'General case' 0 N--CA 1.488 1.474 0 O-C-N 121.69 -0.631 . . . . 0.0 109.352 -179.799 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . -60.72 -44.73 97.59 Favored Glycine 0 N--CA 1.492 2.397 0 N-CA-C 109.699 -1.36 . . . . 0.0 109.699 -179.189 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 54.9 mtpt -71.16 -25.6 62.62 Favored 'General case' 0 N--CA 1.49 1.532 0 O-C-N 121.781 -0.835 . . . . 0.0 109.102 179.843 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -61.52 -44.86 96.29 Favored 'General case' 0 C--N 1.303 -1.434 0 O-C-N 121.572 -0.705 . . . . 0.0 109.353 -179.102 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 49' ' ' ALA . . . . . . . . . . . . . . . -53.83 -35.85 61.9 Favored 'General case' 0 N--CA 1.493 1.721 0 O-C-N 121.442 -0.786 . . . . 0.0 109.488 -179.328 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 72.9 mm-40 -69.16 -37.28 78.13 Favored 'General case' 0 N--CA 1.491 1.597 0 N-CA-C 109.258 -0.645 . . . . 0.0 109.258 -179.983 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 4.4 m-85 -63.46 -39.37 94.28 Favored 'General case' 0 N--CA 1.496 1.859 0 O-C-N 121.669 -0.644 . . . . 0.0 109.496 -179.458 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 52' ' ' ILE . . . . . . . . . . . . . 31.9 mm -64.07 -44.28 97.68 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.611 0 O-C-N 121.634 -0.666 . . . . 0.0 109.626 -179.424 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 66.9 m -60.55 -41.62 94.91 Favored 'General case' 0 N--CA 1.493 1.7 0 O-C-N 121.815 -0.553 . . . . 0.0 109.574 -179.696 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 54' ' ' LEU . . . . . . . . . . . . . 95.4 mt -64.04 -40.49 96.42 Favored 'General case' 0 N--CA 1.492 1.634 0 O-C-N 121.658 -0.651 . . . . 0.0 109.315 -179.926 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -57.92 -46.47 84.95 Favored 'General case' 0 N--CA 1.491 1.619 0 CA-C-O 121.148 0.499 . . . . 0.0 110.147 -178.984 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 56' ' ' LYS . . . . . . . . . . . . . 62.7 mttp -64.59 -41.53 96.18 Favored 'General case' 0 N--CA 1.491 1.584 0 O-C-N 121.631 -0.668 . . . . 0.0 109.955 -179.742 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 88.2 mt-30 -64.66 -43.65 92.93 Favored 'General case' 0 N--CA 1.491 1.598 0 O-C-N 121.499 -0.751 . . . . 0.0 109.287 -179.726 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 58' ' ' VAL . . . . . . . . . . . . . 77.9 t -65.92 -44.54 92.47 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.619 0 O-C-N 121.742 -0.599 . . . . 0.0 109.419 -179.881 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 59' ' ' TYR . . . . . 0.404 ' O ' ' O ' ' A' ' 60' ' ' ALA . 75.8 t80 -137.47 151.56 48.6 Favored 'General case' 0 N--CA 1.496 1.861 0 CA-C-O 121.913 0.863 . . . . 0.0 110.318 -179.521 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 60' ' ' ALA . . . . . 0.538 ' O ' ' N ' ' A' ' 62' ' ' VAL . . . -59.85 -143.3 0.0 OUTLIER 'General case' 0 N--CA 1.491 1.587 0 CA-C-O 121.449 0.642 . . . . 0.0 110.693 -179.298 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 61' ' ' ASN . . . . . . . . . . . . . 99.3 m-20 -43.67 91.6 0.0 OUTLIER 'General case' 0 N--CA 1.495 1.802 0 CA-C-O 121.85 0.834 . . . . 0.0 109.879 -178.836 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 62' ' ' VAL . . . . . 0.538 ' N ' ' O ' ' A' ' 60' ' ' ALA . 13.2 p -99.42 132.58 44.58 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.503 0 CA-C-O 121.897 0.856 . . . . 0.0 110.279 -179.438 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 63' ' ' GLU . . . . . 0.533 ' OE1' ' N ' ' A' ' 63' ' ' GLU . 57.1 mp0 -105.42 136.51 44.84 Favored 'General case' 0 N--CA 1.492 1.637 0 CA-C-O 121.726 0.774 . . . . 0.0 109.44 -179.764 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 64' ' ' TYR . . . . . . . . . . . . . 53.5 p90 -149.6 161.84 41.38 Favored 'General case' 0 N--CA 1.491 1.584 0 CA-C-O 121.778 0.799 . . . . 0.0 110.246 -179.516 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 48.7 tp10 -143.39 144.76 32.18 Favored 'General case' 0 N--CA 1.493 1.703 0 CA-C-O 121.736 0.779 . . . . 0.0 109.266 179.412 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 66' ' ' VAL . . . . . . . . . . . . . 14.7 p -121.27 129.95 75.13 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.713 0 CA-C-O 121.866 0.841 . . . . 0.0 109.893 -179.852 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -77.76 159.85 75.63 Favored Pre-proline 0 N--CA 1.49 1.55 0 N-CA-C 109.398 -0.593 . . . . 0.0 109.398 -179.699 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 68' ' ' PRO . . . . . . . . . . . . . 17.9 Cg_endo -59.58 140.28 93.07 Favored 'Trans proline' 0 C--N 1.309 -1.545 0 C-N-CA 122.579 2.186 . . . . 0.0 112.57 179.41 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 69' ' ' VAL . . . . . . . . . . . . . 49.6 t -133.8 136.21 54.3 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.787 0 CA-C-O 121.835 0.826 . . . . 0.0 110.074 -179.723 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -76.69 165.52 24.63 Favored 'General case' 0 N--CA 1.492 1.654 0 CA-C-O 121.875 0.845 . . . . 0.0 110.504 -179.953 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 62.0 t0 -63.14 -44.45 95.51 Favored 'General case' 0 N--CA 1.489 1.487 0 CA-C-O 121.224 0.535 . . . . 0.0 109.926 -179.614 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 72' ' ' ASN . . . . . . . . . . . . . 98.5 m-20 -99.75 24.91 7.75 Favored 'General case' 0 N--CA 1.494 1.768 0 N-CA-C 109.347 -0.612 . . . . 0.0 109.347 -179.146 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 73' ' ' ALA . . . . . 0.589 ' C ' ' H ' ' A' ' 75' ' ' GLU . . . -64.47 -26.11 68.3 Favored 'General case' 0 N--CA 1.492 1.666 0 O-C-N 121.607 -0.683 . . . . 0.0 109.228 179.825 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 74' ' ' THR . . . . . 0.48 ' OG1' ' O ' ' A' ' 73' ' ' ALA . 63.0 p 53.35 4.04 0.04 OUTLIER 'General case' 0 N--CA 1.493 1.683 0 CA-C-O 121.256 0.55 . . . . 0.0 109.625 -179.347 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 75' ' ' GLU . . . . . 0.589 ' H ' ' C ' ' A' ' 73' ' ' ALA . 96.5 mt-10 -144.69 156.83 44.28 Favored 'General case' 0 N--CA 1.491 1.605 0 CA-C-O 121.975 0.893 . . . . 0.0 110.135 179.85 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 4.1 tt -141.24 141.09 34.03 Favored 'General case' 0 C--N 1.304 -1.405 0 CA-C-O 121.622 0.725 . . . . 0.0 109.857 -179.907 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 77' ' ' HIS . . . . . 0.508 ' NE2' ' OE2' ' A' ' 33' ' ' GLU . 63.1 t-80 -120.38 128.48 53.26 Favored 'General case' 0 N--CA 1.494 1.735 0 CA-C-O 121.928 0.87 . . . . 0.0 109.763 -179.978 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -150.16 155.21 39.37 Favored 'General case' 0 N--CA 1.49 1.536 0 CA-C-O 121.688 0.756 . . . . 0.0 109.696 179.937 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 33.2 ptt-85 -135.03 153.16 52.16 Favored 'General case' 0 N--CA 1.495 1.778 0 CA-C-O 121.814 0.816 . . . . 0.0 109.845 -179.778 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 80' ' ' PHE . . . . . . . . . . . . . 45.5 m-85 -133.16 153.38 51.58 Favored 'General case' 0 N--CA 1.495 1.821 0 CA-C-O 121.694 0.759 . . . . 0.0 110.175 -179.265 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 64.2 tttm -107.4 125.66 51.5 Favored 'General case' 0 N--CA 1.496 1.841 0 CA-C-O 121.595 0.712 . . . . 0.0 109.366 179.968 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 82' ' ' PHE . . . . . . . . . . . . . 63.1 m-85 -123.21 146.51 47.76 Favored 'General case' 0 N--CA 1.495 1.821 0 CA-C-O 121.615 0.721 . . . . 0.0 109.936 -179.896 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 81.3 tt0 -69.04 -37.88 78.83 Favored 'General case' 0 N--CA 1.491 1.595 0 N-CA-C 109.222 -0.658 . . . . 0.0 109.222 -179.579 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 84' ' ' VAL . . . . . . . . . . . . . 35.1 m -135.79 159.11 39.72 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.926 0 CA-C-O 121.889 0.852 . . . . 0.0 109.984 -179.933 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 85' ' ' SER . . . . . 0.481 ' O ' ' N ' ' A' ' 88' ' ' LYS . 11.2 t -63.62 -42.61 98.19 Favored 'General case' 0 N--CA 1.49 1.563 0 CA-C-O 121.193 0.521 . . . . 0.0 110.08 -179.775 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 86' ' ' ALA . . . . . . . . . . . . . . . -41.23 -40.95 1.73 Allowed 'General case' 0 N--CA 1.494 1.752 0 CA-C-O 121.278 0.561 . . . . 0.0 110.07 -178.976 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 96.6 mt-10 -67.52 -33.17 74.53 Favored 'General case' 0 N--CA 1.491 1.577 0 O-C-N 121.677 -0.64 . . . . 0.0 109.64 -179.829 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 88' ' ' LYS . . . . . 0.481 ' N ' ' O ' ' A' ' 85' ' ' SER . 64.4 tttm -62.37 -45.61 92.38 Favored 'General case' 0 N--CA 1.493 1.677 0 O-C-N 121.645 -0.659 . . . . 0.0 109.673 -179.627 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 89' ' ' LEU . . . . . 0.489 ' CD2' ' N ' ' A' ' 89' ' ' LEU . 3.8 mm? -64.3 -42.05 96.56 Favored 'General case' 0 N--CA 1.492 1.633 0 O-C-N 121.519 -0.738 . . . . 0.0 109.796 -179.447 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 90' ' ' ILE . . . . . . . . . . . . . 95.3 mt -65.99 -44.23 92.36 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.669 0 CA-C-O 121.325 0.583 . . . . 0.0 109.934 -179.398 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 91' ' ' PHE . . . . . . . . . . . . . 71.3 t80 -61.97 -45.58 93.01 Favored 'General case' 0 N--CA 1.493 1.707 0 O-C-N 121.689 -0.632 . . . . 0.0 109.993 -179.18 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 92' ' ' GLU . . . . . 0.555 ' N ' ' OE1' ' A' ' 92' ' ' GLU . 1.9 mp0 -64.8 -37.98 89.44 Favored 'General case' 0 N--CA 1.491 1.592 0 O-C-N 121.555 -0.716 . . . . 0.0 110.175 -178.976 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 93' ' ' LEU . . . . . . . . . . . . . 5.1 tt -62.11 -45.17 94.66 Favored 'General case' 0 C--N 1.299 -1.599 0 O-C-N 121.472 -0.767 . . . . 0.0 109.958 -178.845 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 94' ' ' LYS . . . . . . . . . . . . . 98.8 mttt -66.14 -43.13 87.95 Favored 'General case' 0 N--CA 1.493 1.694 0 O-C-N 121.826 -0.546 . . . . 0.0 110.045 -179.508 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 21.2 p -67.94 -38.08 82.41 Favored 'General case' 0 N--CA 1.493 1.708 0 O-C-N 121.557 -0.714 . . . . 0.0 109.629 -179.217 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 96' ' ' ARG . . . . . . . . . . . . . 73.6 mmt-85 -64.47 -40.86 96.49 Favored 'General case' 0 C--N 1.301 -1.502 0 O-C-N 121.592 -0.692 . . . . 0.0 109.639 -179.891 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 97' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.302 -1.472 0 N-CA-C 108.994 -0.743 . . . . 0.0 108.994 -179.93 . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 34.8 t0 . . . . . 0 N--CA 1.491 1.608 0 CA-C-O 121.505 0.669 . . . . 0.0 109.513 . . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 53.6 t -117.79 133.93 63.01 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.802 0 CA-C-O 121.854 0.835 . . . . 0.0 109.276 179.989 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 32' ' ' ALA . . . . . 0.62 ' CB ' ' HZ3' ' A' ' 88' ' ' LYS . . . -99.22 151.67 20.76 Favored 'General case' 0 N--CA 1.49 1.528 0 CA-C-O 121.698 0.761 . . . . 0.0 109.838 -179.637 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 33' ' ' GLU . . . . . 0.552 ' H ' ' HZ2' ' A' ' 88' ' ' LYS . 57.4 mp0 -110.17 120.04 41.2 Favored 'General case' 0 N--CA 1.492 1.675 0 CA-C-O 121.619 0.723 . . . . 0.0 109.442 -179.853 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 34' ' ' VAL . . . . . . . . . . . . . 55.0 t -125.42 133.8 68.37 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.73 0 CA-C-O 121.88 0.848 . . . . 0.0 109.605 179.996 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 15.6 m -153.87 138.94 17.33 Favored 'General case' 0 N--CA 1.49 1.532 0 CA-C-O 121.768 0.794 . . . . 0.0 109.425 179.412 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 8.2 mp -107.73 152.95 23.65 Favored 'General case' 0 N--CA 1.495 1.797 0 CA-C-O 121.823 0.821 . . . . 0.0 109.833 -179.628 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 37' ' ' PHE . . . . . . . . . . . . . 91.8 m-85 -127.67 149.14 50.34 Favored 'General case' 0 N--CA 1.491 1.58 0 CA-C-O 121.929 0.871 . . . . 0.0 109.962 -179.518 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 38' ' ' GLY . . . . . 0.426 ' O ' ' O ' ' A' ' 39' ' ' SER . . . 84.63 178.17 51.23 Favored Glycine 0 N--CA 1.487 2.084 0 N-CA-C 110.396 -1.082 . . . . 0.0 110.396 179.442 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 39' ' ' SER . . . . . 0.433 ' OG ' ' ND1' ' A' ' 43' ' ' HIS . 0.3 OUTLIER 55.66 159.78 0.01 OUTLIER 'General case' 0 N--CA 1.488 1.467 0 CA-C-O 121.659 0.743 . . . . 0.0 110.483 179.819 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 40' ' ' ASP . . . . . . . . . . . . . 54.9 p-10 -79.94 174.26 11.77 Favored 'General case' 0 N--CA 1.489 1.492 0 CA-C-O 121.906 0.86 . . . . 0.0 110.785 -179.11 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 41' ' ' LYS . . . . . 0.424 ' O ' ' OE1' ' A' ' 45' ' ' GLU . 21.1 tptm -59.48 -45.54 91.36 Favored 'General case' 0 C--N 1.306 -1.306 0 CA-C-N 116.022 -0.536 . . . . 0.0 110.105 -179.362 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -57.65 -47.32 82.6 Favored 'General case' 0 N--CA 1.492 1.645 0 O-C-N 121.735 -0.603 . . . . 0.0 109.886 -178.828 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 43' ' ' HIS . . . . . 0.433 ' ND1' ' OG ' ' A' ' 39' ' ' SER . 58.7 t-80 -68.33 -35.77 78.26 Favored 'General case' 0 N--CA 1.49 1.572 0 O-C-N 121.628 -0.67 . . . . 0.0 109.683 -179.736 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 13.9 mt -61.94 -42.53 99.21 Favored 'General case' 0 N--CA 1.492 1.67 0 O-C-N 121.625 -0.672 . . . . 0.0 109.386 -179.013 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 45' ' ' GLU . . . . . 0.512 ' OE1' ' N ' ' A' ' 45' ' ' GLU . 1.2 mp0 -63.32 -46.57 86.06 Favored 'General case' 0 N--CA 1.485 1.323 0 O-C-N 121.681 -0.637 . . . . 0.0 109.389 -179.587 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . -61.81 -44.22 98.17 Favored Glycine 0 N--CA 1.49 2.279 0 N-CA-C 109.044 -1.622 . . . . 0.0 109.044 -179.602 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 41.3 tptt -67.22 -35.41 79.54 Favored 'General case' 0 N--CA 1.485 1.315 0 O-C-N 121.834 -0.804 . . . . 0.0 109.039 179.887 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 27.1 tp -58.17 -29.99 66.05 Favored 'General case' 0 N--CA 1.492 1.638 0 N-CA-C 108.805 -0.813 . . . . 0.0 108.805 -179.394 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 49' ' ' ALA . . . . . . . . . . . . . . . -49.62 -27.93 5.18 Favored 'General case' 0 N--CA 1.492 1.651 0 CA-C-O 121.154 0.502 . . . . 0.0 109.988 -179.33 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 50' ' ' GLU . . . . . 0.507 ' CG ' ' N ' ' A' ' 51' ' ' TYR . 16.4 pt-20 -69.41 -42.36 75.15 Favored 'General case' 0 N--CA 1.489 1.514 0 CA-C-O 121.647 0.737 . . . . 0.0 109.281 -179.875 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 51' ' ' TYR . . . . . 0.507 ' N ' ' CG ' ' A' ' 50' ' ' GLU . 22.4 m-85 -60.91 -48.89 79.75 Favored 'General case' 0 N--CA 1.488 1.468 0 O-C-N 121.733 -0.605 . . . . 0.0 109.787 -178.638 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 52' ' ' ILE . . . . . . . . . . . . . 94.6 mt -66.5 -43.39 90.87 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.637 0 CA-C-O 121.201 0.525 . . . . 0.0 109.817 -179.479 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 68.3 m -59.78 -58.18 9.67 Favored 'General case' 0 N--CA 1.493 1.714 0 O-C-N 121.762 -0.587 . . . . 0.0 110.047 -178.567 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 54' ' ' LEU . . . . . 0.425 ' N ' ' CD2' ' A' ' 54' ' ' LEU . 4.1 mm? -64.03 -40.84 97.21 Favored 'General case' 0 C--N 1.301 -1.512 0 O-C-N 121.717 -0.614 . . . . 0.0 109.943 -179.724 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -60.05 -43.07 95.62 Favored 'General case' 0 N--CA 1.489 1.523 0 N-CA-C 109.508 -0.553 . . . . 0.0 109.508 -179.126 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 56' ' ' LYS . . . . . . . . . . . . . 65.8 tttm -65.36 -43.4 90.93 Favored 'General case' 0 C--N 1.307 -1.276 0 O-C-N 121.713 -0.617 . . . . 0.0 109.534 -179.981 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 87.7 mt-30 -65.21 -44.24 88.99 Favored 'General case' 0 N--CA 1.491 1.62 0 O-C-N 121.841 -0.537 . . . . 0.0 109.693 -179.393 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 58' ' ' VAL . . . . . . . . . . . . . 77.3 t -64.47 -44.8 97.0 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.536 0 N-CA-C 109.143 -0.688 . . . . 0.0 109.143 -179.667 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 59' ' ' TYR . . . . . 0.434 ' CE1' ' O ' ' A' ' 60' ' ' ALA . 54.5 t80 -130.58 120.25 23.74 Favored 'General case' 0 N--CA 1.495 1.806 0 CA-C-O 121.829 0.823 . . . . 0.0 109.727 -179.874 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 60' ' ' ALA . . . . . 0.434 ' O ' ' CE1' ' A' ' 59' ' ' TYR . . . -69.2 145.71 52.98 Favored 'General case' 0 N--CA 1.489 1.487 0 CA-C-O 121.623 0.725 . . . . 0.0 110.55 -179.771 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 61' ' ' ASN . . . . . . . . . . . . . 32.2 t-20 57.82 42.24 23.62 Favored 'General case' 0 N--CA 1.494 1.765 0 CA-C-O 121.325 0.583 . . . . 0.0 109.745 179.643 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 62' ' ' VAL . . . . . . . . . . . . . 12.6 p -68.87 137.85 23.52 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.628 0 CA-C-O 121.551 0.691 . . . . 0.0 110.179 179.959 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 63' ' ' GLU . . . . . 0.541 ' OE1' ' N ' ' A' ' 63' ' ' GLU . 57.1 mp0 -112.06 137.71 49.71 Favored 'General case' 0 N--CA 1.494 1.769 0 CA-C-O 121.81 0.814 . . . . 0.0 109.587 -179.752 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 64' ' ' TYR . . . . . . . . . . . . . 55.5 p90 -155.8 164.84 38.03 Favored 'General case' 0 N--CA 1.487 1.417 0 CA-C-O 121.931 0.872 . . . . 0.0 110.413 -179.693 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 83.0 tt0 -142.5 153.69 43.84 Favored 'General case' 0 N--CA 1.491 1.622 0 CA-C-O 121.56 0.695 . . . . 0.0 109.318 179.832 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 66' ' ' VAL . . . . . . . . . . . . . 2.9 p -123.53 132.32 71.58 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.794 0 CA-C-O 122.085 0.945 . . . . 0.0 109.887 -179.744 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -85.89 160.23 53.05 Favored Pre-proline 0 N--CA 1.491 1.585 0 N-CA-C 109.221 -0.659 . . . . 0.0 109.221 179.945 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 68' ' ' PRO . . . . . . . . . . . . . 28.4 Cg_endo -59.83 134.67 58.56 Favored 'Trans proline' 0 C--N 1.307 -1.631 0 C-N-CA 122.728 2.286 . . . . 0.0 112.593 179.666 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 69' ' ' VAL . . . . . . . . . . . . . 99.5 t -138.63 139.15 41.67 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.8 0 CA-C-O 121.766 0.793 . . . . 0.0 110.442 179.82 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -67.08 154.64 40.7 Favored 'General case' 0 N--CA 1.488 1.47 0 CA-C-O 121.794 0.807 . . . . 0.0 110.018 179.787 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 71' ' ' ASP . . . . . 0.545 ' OD1' ' N ' ' A' ' 72' ' ' ASN . 42.3 p-10 -63.92 -34.44 77.96 Favored 'General case' 0 C--N 1.302 -1.465 0 CA-C-O 121.424 0.631 . . . . 0.0 109.45 -179.597 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 72' ' ' ASN . . . . . 0.545 ' N ' ' OD1' ' A' ' 71' ' ' ASP . 8.1 m120 -104.28 28.32 6.97 Favored 'General case' 0 N--CA 1.494 1.773 0 N-CA-C 109.114 -0.699 . . . . 0.0 109.114 -179.474 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 73' ' ' ALA . . . . . 0.487 ' C ' ' H ' ' A' ' 75' ' ' GLU . . . -70.43 -11.54 60.99 Favored 'General case' 0 N--CA 1.493 1.695 0 N-CA-C 109.135 -0.691 . . . . 0.0 109.135 -179.88 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 74' ' ' THR . . . . . 0.453 ' OG1' ' O ' ' A' ' 73' ' ' ALA . 47.5 p 52.4 10.31 0.13 Allowed 'General case' 0 N--CA 1.493 1.697 0 CA-C-O 121.27 0.557 . . . . 0.0 109.513 179.854 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 75' ' ' GLU . . . . . 0.487 ' H ' ' C ' ' A' ' 73' ' ' ALA . 15.3 pt-20 -153.01 179.91 8.26 Favored 'General case' 0 N--CA 1.49 1.571 0 CA-C-O 121.806 0.812 . . . . 0.0 110.095 179.834 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 7.3 tp -146.06 133.48 20.75 Favored 'General case' 0 C--N 1.303 -1.422 0 CA-C-O 121.708 0.766 . . . . 0.0 109.988 179.878 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 77' ' ' HIS . . . . . . . . . . . . . 97.8 m-70 -116.53 118.32 32.32 Favored 'General case' 0 N--CA 1.493 1.717 0 CA-C-O 121.854 0.835 . . . . 0.0 109.438 179.533 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -151.25 161.53 42.54 Favored 'General case' 0 N--CA 1.49 1.547 0 CA-C-O 121.657 0.742 . . . . 0.0 109.871 -179.885 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 81.0 mtp85 -130.31 150.61 51.47 Favored 'General case' 0 N--CA 1.495 1.789 0 CA-C-O 121.695 0.759 . . . . 0.0 109.803 -179.631 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 80' ' ' PHE . . . . . . . . . . . . . 28.9 m-85 -126.17 150.77 48.07 Favored 'General case' 0 N--CA 1.496 1.847 0 CA-C-O 121.574 0.702 . . . . 0.0 109.852 -179.711 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 88.4 tttt -113.66 126.8 55.66 Favored 'General case' 0 N--CA 1.494 1.755 0 CA-C-O 121.738 0.78 . . . . 0.0 109.593 -179.835 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 82' ' ' PHE . . . . . 0.524 ' CG ' ' OE2' ' A' ' 87' ' ' GLU . 73.0 m-85 -125.41 148.77 48.67 Favored 'General case' 0 N--CA 1.495 1.813 0 CA-C-O 121.796 0.808 . . . . 0.0 109.996 179.907 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 45.6 tp10 -70.51 -33.75 71.54 Favored 'General case' 0 N--CA 1.488 1.462 0 N-CA-C 109.346 -0.613 . . . . 0.0 109.346 -179.586 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 84' ' ' VAL . . . . . . . . . . . . . 33.1 m -131.68 162.52 39.33 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.936 0 CA-C-O 121.965 0.888 . . . . 0.0 110.411 -179.12 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 69.3 m -88.25 -15.65 35.29 Favored 'General case' 0 N--CA 1.492 1.672 0 N-CA-C 109.578 -0.527 . . . . 0.0 109.578 -179.643 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 86' ' ' ALA . . . . . . . . . . . . . . . -60.11 -46.23 90.3 Favored 'General case' 0 N--CA 1.492 1.642 0 O-C-N 121.444 -0.785 . . . . 0.0 109.475 -179.234 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 87' ' ' GLU . . . . . 0.524 ' OE2' ' CG ' ' A' ' 82' ' ' PHE . 2.9 pp20? -67.33 -30.68 70.58 Favored 'General case' 0 N--CA 1.488 1.45 0 O-C-N 121.738 -0.601 . . . . 0.0 109.411 -179.715 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 88' ' ' LYS . . . . . 0.62 ' HZ3' ' CB ' ' A' ' 32' ' ' ALA . 56.8 tttp -62.79 -45.54 92.17 Favored 'General case' 0 N--CA 1.491 1.582 0 O-C-N 121.73 -0.606 . . . . 0.0 109.379 -179.58 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 96.0 mt -62.89 -50.46 70.79 Favored 'General case' 0 N--CA 1.492 1.641 0 O-C-N 121.852 -0.53 . . . . 0.0 110.025 -179.036 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 90' ' ' ILE . . . . . 0.416 HD12 HG23 ' A' ' 90' ' ' ILE . 93.5 mt -69.77 -43.79 79.63 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.591 0 O-C-N 121.731 -0.605 . . . . 0.0 110.013 -179.971 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 91' ' ' PHE . . . . . . . . . . . . . 74.6 t80 -62.6 -45.81 91.15 Favored 'General case' 0 N--CA 1.491 1.614 0 O-C-N 121.57 -0.707 . . . . 0.0 109.799 -179.052 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 92' ' ' GLU . . . . . 0.54 ' CG ' ' NH1' ' A' ' 96' ' ' ARG . 82.1 tt0 -66.12 -40.65 90.83 Favored 'General case' 0 N--CA 1.491 1.599 0 O-C-N 121.662 -0.649 . . . . 0.0 109.332 -179.64 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 93' ' ' LEU . . . . . . . . . . . . . 4.7 tp -65.45 -43.35 90.63 Favored 'General case' 0 N--CA 1.489 1.495 0 O-C-N 121.584 -0.697 . . . . 0.0 109.749 -179.868 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 94' ' ' LYS . . . . . . . . . . . . . 6.9 ttpm? -68.58 -36.61 78.98 Favored 'General case' 0 N--CA 1.491 1.62 0 CA-C-O 121.24 0.543 . . . . 0.0 110.099 -179.073 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 7.0 p -62.02 -50.5 71.8 Favored 'General case' 0 N--CA 1.491 1.606 0 O-C-N 121.64 -0.663 . . . . 0.0 109.824 -178.802 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 96' ' ' ARG . . . . . 0.54 ' NH1' ' CG ' ' A' ' 92' ' ' GLU . 72.5 mtt85 -64.62 -39.61 94.02 Favored 'General case' 0 N--CA 1.488 1.449 0 N-CA-C 108.864 -0.791 . . . . 0.0 108.864 179.39 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 97' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.488 1.444 0 N-CA-C 108.995 -0.743 . . . . 0.0 108.995 179.995 . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 90.1 m-20 . . . . . 0 N--CA 1.489 1.481 0 N-CA-C 108.414 -0.958 . . . . 0.0 108.414 . . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 52.2 t -126.64 135.38 63.9 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.9 0 N-CA-C 109.109 -0.7 . . . . 0.0 109.109 179.827 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -112.25 155.83 23.39 Favored 'General case' 0 N--CA 1.495 1.777 0 CA-C-O 121.629 0.728 . . . . 0.0 109.906 -179.378 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 83.6 tt0 -107.07 123.05 47.66 Favored 'General case' 0 N--CA 1.494 1.757 0 O-C-N 121.647 -0.658 . . . . 0.0 109.614 -179.578 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 34' ' ' VAL . . . . . . . . . . . . . 55.0 t -127.51 132.92 68.81 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.727 0 CA-C-O 121.681 0.753 . . . . 0.0 109.436 179.757 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 37.3 t -148.71 141.0 24.11 Favored 'General case' 0 N--CA 1.49 1.529 0 N-CA-C 109.143 -0.688 . . . . 0.0 109.143 179.61 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 4.9 mp -130.74 151.12 51.52 Favored 'General case' 0 N--CA 1.494 1.766 0 CA-C-O 121.76 0.79 . . . . 0.0 109.928 -179.683 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 37' ' ' PHE . . . . . . . . . . . . . 32.4 p90 -143.69 159.73 41.95 Favored 'General case' 0 C--N 1.301 -1.501 0 CA-C-O 121.551 0.691 . . . . 0.0 109.656 -179.733 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . 114.33 152.96 10.66 Favored Glycine 0 N--CA 1.493 2.475 0 N-CA-C 110.263 -1.135 . . . . 0.0 110.263 179.6 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 39' ' ' SER . . . . . 0.561 ' OG ' ' N ' ' A' ' 40' ' ' ASP . 16.8 t 52.59 -169.24 0.04 OUTLIER 'General case' 0 N--CA 1.491 1.598 0 CA-C-O 122.019 0.914 . . . . 0.0 110.883 179.622 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 40' ' ' ASP . . . . . 0.561 ' N ' ' OG ' ' A' ' 39' ' ' SER . 54.5 p-10 -85.42 178.48 7.43 Favored 'General case' 0 C--N 1.306 -1.318 0 CA-C-O 121.654 0.74 . . . . 0.0 110.178 -179.606 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 88.5 tttt -62.35 -39.0 91.69 Favored 'General case' 0 N--CA 1.49 1.559 0 CA-C-O 121.393 0.616 . . . . 0.0 110.32 -179.577 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -53.31 -41.91 66.13 Favored 'General case' 0 N--CA 1.493 1.714 0 O-C-N 121.286 -0.884 . . . . 0.0 109.825 -179.437 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 43' ' ' HIS . . . . . . . . . . . . . 86.5 t60 -66.76 -41.25 88.05 Favored 'General case' 0 N--CA 1.493 1.712 0 O-C-N 121.242 -0.911 . . . . 0.0 109.488 179.513 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 96.7 mt -63.18 -40.07 96.47 Favored 'General case' 0 N--CA 1.495 1.78 0 O-C-N 121.327 -0.858 . . . . 0.0 109.216 -180.0 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 97.1 mt-10 -61.23 -39.41 90.2 Favored 'General case' 0 N--CA 1.493 1.714 0 O-C-N 121.439 -0.788 . . . . 0.0 109.724 -179.921 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . -60.43 -49.12 82.06 Favored Glycine 0 N--CA 1.492 2.394 0 N-CA-C 109.814 -1.314 . . . . 0.0 109.814 179.96 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 52.1 mtpt -65.9 -37.91 87.35 Favored 'General case' 0 C--N 1.301 -1.526 0 O-C-N 121.429 -1.042 . . . . 0.0 109.565 179.62 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -62.58 -44.39 96.44 Favored 'General case' 0 C--N 1.302 -1.486 0 O-C-N 121.324 -0.86 . . . . 0.0 109.596 -178.805 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 49' ' ' ALA . . . . . . . . . . . . . . . -62.23 -41.76 98.69 Favored 'General case' 0 C--N 1.299 -1.601 0 O-C-N 121.069 -1.019 . . . . 0.0 109.471 -179.617 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 77.1 tt0 -69.47 -36.83 76.93 Favored 'General case' 0 C--N 1.306 -1.316 0 O-C-N 121.419 -0.8 . . . . 0.0 109.199 179.718 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 3.1 m-85 -61.98 -43.49 98.73 Favored 'General case' 0 N--CA 1.496 1.828 0 O-C-N 121.579 -0.701 . . . . 0.0 109.361 -179.996 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 52' ' ' ILE . . . . . . . . . . . . . 76.7 mt -63.66 -43.19 98.02 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.606 0 O-C-N 121.539 -0.726 . . . . 0.0 109.726 -179.883 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 78.1 p -61.13 -41.71 97.21 Favored 'General case' 0 N--CA 1.493 1.687 0 O-C-N 121.423 -0.798 . . . . 0.0 110.19 -179.253 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 54' ' ' LEU . . . . . . . . . . . . . 93.6 mt -64.98 -42.48 94.51 Favored 'General case' 0 N--CA 1.494 1.737 0 O-C-N 121.264 -0.897 . . . . 0.0 109.4 179.822 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -67.07 -37.06 83.34 Favored 'General case' 0 N--CA 1.491 1.596 0 O-C-N 121.504 -0.748 . . . . 0.0 109.568 179.799 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 56' ' ' LYS . . . . . . . . . . . . . 56.4 tttp -63.27 -43.97 96.43 Favored 'General case' 0 N--CA 1.487 1.377 0 O-C-N 121.491 -0.756 . . . . 0.0 109.568 -179.718 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 77.5 mt-30 -66.13 -44.4 84.35 Favored 'General case' 0 N--CA 1.493 1.687 0 O-C-N 121.324 -0.86 . . . . 0.0 109.433 179.898 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 58' ' ' VAL . . . . . . . . . . . . . 72.3 t -65.18 -45.09 94.98 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.554 0 O-C-N 121.498 -0.751 . . . . 0.0 109.47 179.627 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 59' ' ' TYR . . . . . . . . . . . . . 87.1 t80 -125.05 127.45 46.96 Favored 'General case' 0 N--CA 1.497 1.901 0 CA-C-O 121.748 0.785 . . . . 0.0 109.666 -179.653 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -66.17 148.74 51.38 Favored 'General case' 0 N--CA 1.49 1.554 0 CA-C-O 121.829 0.824 . . . . 0.0 110.848 -179.182 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 61' ' ' ASN . . . . . . . . . . . . . 6.3 p-10 42.93 66.72 0.73 Allowed 'General case' 0 N--CA 1.493 1.71 0 CA-C-O 121.844 0.83 . . . . 0.0 109.966 179.904 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 62' ' ' VAL . . . . . . . . . . . . . 11.7 p -85.55 136.29 23.14 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.616 0 O-C-N 121.549 -0.719 . . . . 0.0 109.794 179.824 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 96.1 mt-10 -111.97 145.24 39.95 Favored 'General case' 0 N--CA 1.496 1.872 0 CA-C-O 121.734 0.778 . . . . 0.0 109.971 -179.517 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 64' ' ' TYR . . . . . . . . . . . . . 46.9 p90 -149.52 161.54 41.93 Favored 'General case' 0 N--CA 1.49 1.552 0 CA-C-O 121.798 0.809 . . . . 0.0 110.212 -179.424 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 78.4 mm-40 -141.19 146.18 36.6 Favored 'General case' 0 N--CA 1.494 1.734 0 N-CA-C 109.034 -0.728 . . . . 0.0 109.034 179.851 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 66' ' ' VAL . . . . . . . . . . . . . 8.8 p -127.2 131.45 70.64 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.967 0 CA-C-O 121.608 0.718 . . . . 0.0 110.184 -179.744 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -78.95 167.18 36.95 Favored Pre-proline 0 C--N 1.305 -1.356 0 N-CA-C 109.155 -0.683 . . . . 0.0 109.155 -179.95 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 68' ' ' PRO . . . . . . . . . . . . . 53.0 Cg_exo -52.27 127.49 23.96 Favored 'Trans proline' 0 N--CA 1.495 1.57 0 C-N-CA 122.383 2.055 . . . . 0.0 112.905 179.573 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 69' ' ' VAL . . . . . . . . . . . . . 70.9 t -132.5 133.27 59.9 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.845 0 O-C-N 121.541 -0.724 . . . . 0.0 109.621 179.482 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -82.04 157.86 24.0 Favored 'General case' 0 C--N 1.302 -1.495 0 O-C-N 121.607 -0.683 . . . . 0.0 109.951 179.637 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 43.4 t0 -64.01 -37.98 89.42 Favored 'General case' 0 N--CA 1.493 1.696 0 CA-C-O 121.606 0.717 . . . . 0.0 109.697 179.552 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 72' ' ' ASN . . . . . . . . . . . . . 11.4 m120 -92.45 12.9 21.24 Favored 'General case' 0 N--CA 1.494 1.743 0 O-C-N 121.422 -0.799 . . . . 0.0 109.467 -179.567 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -64.25 146.51 54.22 Favored 'General case' 0 N--CA 1.496 1.83 0 O-C-N 121.19 -0.944 . . . . 0.0 110.406 -179.551 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 74' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -101.08 -4.35 27.53 Favored 'General case' 0 N--CA 1.494 1.748 0 O-C-N 121.515 -0.741 . . . . 0.0 109.69 179.819 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 82.9 tt0 -144.13 148.02 34.5 Favored 'General case' 0 N--CA 1.497 1.91 0 O-C-N 120.901 -1.125 . . . . 0.0 109.748 179.898 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 3.5 tt -126.17 135.31 51.49 Favored 'General case' 0 N--CA 1.49 1.573 0 CA-C-O 121.502 0.668 . . . . 0.0 109.549 -179.925 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 77' ' ' HIS . . . . . . . . . . . . . 99.1 m-70 -107.78 129.63 55.04 Favored 'General case' 0 N--CA 1.494 1.727 0 CA-C-O 121.578 0.704 . . . . 0.0 109.705 -179.519 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -148.03 153.99 39.67 Favored 'General case' 0 N--CA 1.49 1.529 0 O-C-N 121.587 -0.696 . . . . 0.0 109.438 -179.866 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 79.7 mtp85 -132.74 149.36 52.29 Favored 'General case' 0 N--CA 1.494 1.726 0 CA-C-O 121.393 0.616 . . . . 0.0 109.387 -179.817 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 80' ' ' PHE . . . . . . . . . . . . . 61.8 m-85 -127.53 150.63 49.6 Favored 'General case' 0 N--CA 1.495 1.802 0 CA-C-O 121.536 0.684 . . . . 0.0 109.455 -179.872 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 53.7 tttp -110.5 112.85 25.05 Favored 'General case' 0 N--CA 1.493 1.678 0 CA-C-O 121.569 0.7 . . . . 0.0 109.35 179.874 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 82' ' ' PHE . . . . . . . . . . . . . 59.1 m-85 -111.24 145.22 39.12 Favored 'General case' 0 N--CA 1.495 1.788 0 CA-C-O 121.598 0.713 . . . . 0.0 109.71 179.915 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 46.2 tp10 -66.46 -38.65 87.81 Favored 'General case' 0 C--N 1.301 -1.505 0 O-C-N 121.692 -0.63 . . . . 0.0 109.904 -179.818 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 84' ' ' VAL . . . . . 0.431 ' CG2' ' OE2' ' A' ' 87' ' ' GLU . 16.6 m -136.17 161.24 37.88 Favored 'Isoleucine or valine' 0 N--CA 1.499 1.994 0 O-C-N 121.322 -0.861 . . . . 0.0 110.52 -179.421 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 33.9 m -70.57 -16.54 62.87 Favored 'General case' 0 N--CA 1.49 1.556 0 CA-C-O 121.367 0.604 . . . . 0.0 109.883 -179.902 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 86' ' ' ALA . . . . . . . . . . . . . . . -60.78 -42.37 97.38 Favored 'General case' 0 N--CA 1.493 1.724 0 O-C-N 121.188 -0.945 . . . . 0.0 109.567 -179.876 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 87' ' ' GLU . . . . . 0.551 ' N ' ' OE1' ' A' ' 87' ' ' GLU . 0.4 OUTLIER -70.36 -34.06 72.16 Favored 'General case' 0 N--CA 1.491 1.605 0 O-C-N 121.33 -0.856 . . . . 0.0 109.224 179.858 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 88' ' ' LYS . . . . . . . . . . . . . 88.5 tttt -61.79 -47.07 86.79 Favored 'General case' 0 N--CA 1.49 1.53 0 O-C-N 121.293 -0.88 . . . . 0.0 109.77 -179.921 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 56.6 tp -63.38 -45.77 89.57 Favored 'General case' 0 N--CA 1.489 1.515 0 O-C-N 121.288 -0.883 . . . . 0.0 109.715 -179.489 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 90' ' ' ILE . . . . . . . . . . . . . 96.5 mt -66.04 -44.54 92.03 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.611 0 O-C-N 121.508 -0.745 . . . . 0.0 109.839 -179.832 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 91' ' ' PHE . . . . . . . . . . . . . 54.1 t80 -62.98 -43.95 97.38 Favored 'General case' 0 N--CA 1.492 1.629 0 CA-C-O 121.64 0.733 . . . . 0.0 109.799 -179.636 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 92' ' ' GLU . . . . . . . . . . . . . 40.6 tp10 -56.28 -58.98 5.66 Favored 'General case' 0 N--CA 1.493 1.682 0 O-C-N 121.461 -0.775 . . . . 0.0 110.444 -178.897 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 93' ' ' LEU . . . . . . . . . . . . . 10.8 mp -64.53 -39.27 93.46 Favored 'General case' 0 N--CA 1.495 1.778 0 O-C-N 121.266 -0.896 . . . . 0.0 110.553 -179.444 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 94' ' ' LYS . . . . . . . . . . . . . 38.6 ttmt -61.73 -46.96 87.41 Favored 'General case' 0 N--CA 1.493 1.719 0 O-C-N 120.997 -1.064 . . . . 0.0 110.639 -178.764 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 21.0 p -69.0 -40.6 78.61 Favored 'General case' 0 N--CA 1.493 1.719 0 O-C-N 120.887 -1.133 . . . . 0.0 109.686 -179.667 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 96' ' ' ARG . . . . . . . . . . . . . 82.6 mtp180 -64.89 -40.61 95.37 Favored 'General case' 0 N--CA 1.491 1.603 0 O-C-N 121.395 -0.816 . . . . 0.0 109.337 179.52 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 97' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 1.559 0 O-C-N 121.448 -0.783 . . . . 0.0 109.518 179.907 . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' A' A ' 30' ' ' ASP . . . . . 0.429 ' OD1' ' N ' ' A' ' 30' ' ' ASP . 9.0 p-10 . . . . . 0 N--CA 1.487 1.384 0 CA-C-O 121.485 0.659 . . . . 0.0 109.777 . . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 31' ' ' VAL . . . . . 0.583 ' CG1' HH11 ' A' ' 79' ' ' ARG . 53.5 t -124.96 135.33 64.42 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.881 0 CA-C-O 121.426 0.632 . . . . 0.0 109.433 179.858 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -130.56 140.98 50.46 Favored 'General case' 0 N--CA 1.494 1.759 0 CA-C-O 121.585 0.707 . . . . 0.0 109.471 -179.915 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 22.2 pt-20 -96.01 140.36 30.86 Favored 'General case' 0 N--CA 1.493 1.686 0 CA-C-O 121.501 0.667 . . . . 0.0 110.055 -179.495 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 34' ' ' VAL . . . . . . . . . . . . . 55.4 t -127.0 132.8 69.58 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.763 0 CA-C-O 121.513 0.673 . . . . 0.0 109.304 179.885 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 39.4 t -140.35 128.27 21.99 Favored 'General case' 0 N--CA 1.493 1.701 0 CA-C-O 121.506 0.669 . . . . 0.0 109.724 -179.968 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 11.0 mp -111.25 154.06 24.99 Favored 'General case' 0 N--CA 1.499 2.0 0 CA-C-O 121.509 0.671 . . . . 0.0 109.434 179.977 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 37' ' ' PHE . . . . . . . . . . . . . 92.3 t80 -124.58 130.24 52.07 Favored 'General case' 0 N--CA 1.493 1.679 0 CA-C-O 121.644 0.735 . . . . 0.0 109.508 -179.794 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . -164.95 -171.34 31.07 Favored Glycine 0 N--CA 1.491 2.314 0 N-CA-C 110.182 -1.167 . . . . 0.0 110.182 -179.697 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 39' ' ' SER . . . . . 0.511 ' HG ' ' H ' ' A' ' 40' ' ' ASP . 14.0 p -85.99 -90.06 0.11 Allowed 'General case' 0 N--CA 1.497 1.903 0 O-C-N 121.909 -0.759 . . . . 0.0 110.738 -179.312 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 40' ' ' ASP . . . . . 0.511 ' H ' ' HG ' ' A' ' 39' ' ' SER . 52.6 p-10 -84.67 168.65 15.08 Favored 'General case' 0 N--CA 1.494 1.742 0 CA-C-O 121.777 0.799 . . . . 0.0 110.525 -178.944 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 88.9 tttt -65.2 -38.08 89.33 Favored 'General case' 0 N--CA 1.496 1.874 0 CA-C-O 121.311 0.577 . . . . 0.0 110.584 -179.506 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -55.1 -41.7 71.97 Favored 'General case' 0 N--CA 1.498 1.933 0 O-C-N 121.358 -0.839 . . . . 0.0 110.413 -178.974 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 43' ' ' HIS . . . . . . . . . . . . . 54.8 t-80 -66.63 -42.09 87.31 Favored 'General case' 0 N--CA 1.496 1.854 0 O-C-N 121.473 -0.767 . . . . 0.0 110.258 -179.555 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 74.1 mt -63.94 -40.34 96.24 Favored 'General case' 0 N--CA 1.497 1.897 0 O-C-N 121.469 -0.769 . . . . 0.0 109.767 -179.412 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 71.7 mm-40 -61.44 -43.46 98.83 Favored 'General case' 0 N--CA 1.492 1.655 0 CA-C-O 121.54 0.686 . . . . 0.0 109.794 -179.451 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . -62.2 -48.33 83.59 Favored Glycine 0 N--CA 1.494 2.534 0 N-CA-C 110.226 -1.15 . . . . 0.0 110.226 -179.648 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 61.5 tttp -66.82 -30.2 70.33 Favored 'General case' 0 N--CA 1.495 1.786 0 O-C-N 121.527 -0.984 . . . . 0.0 109.536 179.936 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 45.3 tp -62.23 -38.24 88.45 Favored 'General case' 0 N--CA 1.491 1.624 0 CA-C-O 121.492 0.663 . . . . 0.0 109.574 -179.509 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 49' ' ' ALA . . . . . . . . . . . . . . . -51.53 -33.47 32.16 Favored 'General case' 0 N--CA 1.493 1.687 0 O-C-N 121.565 -0.71 . . . . 0.0 109.559 -179.588 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 97.8 mt-10 -63.65 -43.2 97.44 Favored 'General case' 0 N--CA 1.493 1.695 0 O-C-N 121.585 -0.697 . . . . 0.0 109.622 -179.906 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 32.8 m-85 -62.13 -46.39 89.23 Favored 'General case' 0 N--CA 1.494 1.764 0 O-C-N 121.466 -0.771 . . . . 0.0 109.706 -179.975 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 52' ' ' ILE . . . . . . . . . . . . . 96.5 mt -65.08 -43.99 95.79 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.652 0 O-C-N 121.649 -0.657 . . . . 0.0 109.871 -179.444 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 9.7 t -63.01 -46.63 86.72 Favored 'General case' 0 N--CA 1.495 1.807 0 O-C-N 121.48 -0.762 . . . . 0.0 109.656 -179.701 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 54' ' ' LEU . . . . . . . . . . . . . 91.0 mt -67.32 -40.0 85.92 Favored 'General case' 0 N--CA 1.494 1.732 0 CA-C-O 121.743 0.782 . . . . 0.0 109.181 179.54 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -58.83 -46.33 87.91 Favored 'General case' 0 N--CA 1.494 1.735 0 CA-C-O 121.46 0.648 . . . . 0.0 109.858 -179.447 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 56' ' ' LYS . . . . . . . . . . . . . 68.0 mttm -64.2 -41.21 97.16 Favored 'General case' 0 N--CA 1.492 1.668 0 O-C-N 121.537 -0.727 . . . . 0.0 109.647 179.834 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 67.2 tp60 -65.41 -46.1 81.32 Favored 'General case' 0 N--CA 1.491 1.608 0 O-C-N 121.591 -0.693 . . . . 0.0 109.506 -179.739 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 58' ' ' VAL . . . . . . . . . . . . . 71.5 t -65.89 -44.08 92.78 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.568 0 O-C-N 121.622 -0.673 . . . . 0.0 109.441 -179.98 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 59' ' ' TYR . . . . . 0.412 ' O ' ' O ' ' A' ' 60' ' ' ALA . 52.8 t80 -125.37 133.1 52.66 Favored 'General case' 0 N--CA 1.498 1.964 0 CA-C-O 121.799 0.809 . . . . 0.0 109.758 -179.874 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 60' ' ' ALA . . . . . 0.412 ' O ' ' O ' ' A' ' 59' ' ' TYR . . . -46.45 -100.04 0.0 OUTLIER 'General case' 0 N--CA 1.494 1.733 0 CA-C-O 121.562 0.696 . . . . 0.0 111.042 -179.471 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 61' ' ' ASN . . . . . . . . . . . . . 10.7 m120 -86.01 90.09 8.0 Favored 'General case' 0 N--CA 1.491 1.612 0 CA-C-O 121.805 0.812 . . . . 0.0 109.79 -178.676 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 62' ' ' VAL . . . . . . . . . . . . . 9.6 p -90.89 140.45 15.96 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.587 0 CA-C-O 121.488 0.661 . . . . 0.0 109.952 179.947 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 76.1 mm-40 -112.67 134.44 54.19 Favored 'General case' 0 N--CA 1.494 1.741 0 CA-C-O 121.589 0.709 . . . . 0.0 109.445 -179.809 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 64' ' ' TYR . . . . . . . . . . . . . 47.0 p90 -148.9 162.5 39.73 Favored 'General case' 0 N--CA 1.492 1.661 0 CA-C-O 121.718 0.771 . . . . 0.0 110.078 -179.333 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 15.7 pt-20 -143.18 154.37 43.8 Favored 'General case' 0 N--CA 1.494 1.732 0 N-CA-C 109.2 -0.667 . . . . 0.0 109.2 179.905 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 66' ' ' VAL . . . . . . . . . . . . . 77.3 t -119.83 130.42 74.2 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.878 0 CA-C-O 121.686 0.755 . . . . 0.0 109.856 -179.569 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -84.36 170.99 12.12 Favored Pre-proline 0 N--CA 1.49 1.559 0 N-CA-C 109.423 -0.584 . . . . 0.0 109.423 -179.932 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 68' ' ' PRO . . . . . . . . . . . . . 62.9 Cg_exo -52.01 131.47 38.97 Favored 'Trans proline' 0 N--CA 1.496 1.659 0 C-N-CA 122.699 2.266 . . . . 0.0 112.971 -179.806 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 69' ' ' VAL . . . . . . . . . . . . . 53.3 t -132.33 131.99 60.6 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.897 0 CA-C-O 121.651 0.738 . . . . 0.0 109.896 179.838 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -74.9 152.72 38.84 Favored 'General case' 0 N--CA 1.491 1.59 0 CA-C-O 121.731 0.776 . . . . 0.0 110.021 179.625 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 53.3 m-20 -64.11 -36.0 82.6 Favored 'General case' 0 N--CA 1.493 1.677 0 CA-C-O 121.541 0.686 . . . . 0.0 109.267 179.969 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 72' ' ' ASN . . . . . . . . . . . . . 63.2 t30 -94.58 13.37 24.35 Favored 'General case' 0 N--CA 1.494 1.745 0 O-C-N 121.279 -0.888 . . . . 0.0 109.279 179.977 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -58.05 145.38 36.58 Favored 'General case' 0 N--CA 1.497 1.889 0 CA-C-O 121.74 0.781 . . . . 0.0 110.806 -179.273 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 74' ' ' THR . . . . . . . . . . . . . 41.0 p -98.45 -1.03 42.34 Favored 'General case' 0 N--CA 1.493 1.717 0 N-CA-C 109.309 -0.626 . . . . 0.0 109.309 179.6 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 18.9 pt-20 -154.3 163.04 40.76 Favored 'General case' 0 N--CA 1.494 1.747 0 O-C-N 121.259 -0.9 . . . . 0.0 109.912 179.887 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 5.3 tt -126.41 127.81 46.02 Favored 'General case' 0 N--CA 1.494 1.738 0 CA-C-O 121.574 0.702 . . . . 0.0 109.728 -179.855 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 77' ' ' HIS . . . . . . . . . . . . . 60.6 t-80 -97.83 124.01 42.04 Favored 'General case' 0 N--CA 1.491 1.606 0 CA-C-O 121.775 0.798 . . . . 0.0 109.88 -179.765 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -142.75 158.03 44.05 Favored 'General case' 0 N--CA 1.491 1.618 0 N-CA-C 108.881 -0.785 . . . . 0.0 108.881 179.693 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 79' ' ' ARG . . . . . 0.583 HH11 ' CG1' ' A' ' 31' ' ' VAL . 63.2 ttm-85 -128.83 137.67 51.62 Favored 'General case' 0 N--CA 1.493 1.693 0 CA-C-O 121.536 0.684 . . . . 0.0 109.551 -179.685 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 80' ' ' PHE . . . . . . . . . . . . . 59.3 m-85 -123.78 146.67 48.16 Favored 'General case' 0 N--CA 1.496 1.844 0 CA-C-O 121.521 0.677 . . . . 0.0 109.524 -179.803 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 81' ' ' LYS . . . . . 0.413 ' HZ1' ' CG ' ' A' ' 30' ' ' ASP . 63.6 tttp -115.76 128.91 56.21 Favored 'General case' 0 N--CA 1.496 1.845 0 N-CA-C 109.115 -0.698 . . . . 0.0 109.115 -179.859 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 82' ' ' PHE . . . . . 0.402 ' O ' ' OD2' ' A' ' 30' ' ' ASP . 94.4 m-85 -122.55 -122.01 0.28 Allowed 'General case' 0 N--CA 1.499 1.979 0 CA-C-O 121.346 0.593 . . . . 0.0 109.902 -179.413 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 52.8 tp10 -150.71 -39.84 0.13 Allowed 'General case' 0 N--CA 1.489 1.521 0 N-CA-C 108.747 -0.834 . . . . 0.0 108.747 -179.544 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 84' ' ' VAL . . . . . . . . . . . . . 25.6 m -137.12 157.7 35.48 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.888 0 O-C-N 121.469 -0.77 . . . . 0.0 109.686 179.928 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 85' ' ' SER . . . . . 0.482 ' O ' ' N ' ' A' ' 88' ' ' LYS . 11.3 t -64.08 -42.03 97.11 Favored 'General case' 0 N--CA 1.494 1.726 0 CA-C-O 121.33 0.586 . . . . 0.0 110.329 -179.979 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 86' ' ' ALA . . . . . 0.42 ' C ' ' O ' ' A' ' 85' ' ' SER . . . -39.22 -46.06 1.45 Allowed 'General case' 0 N--CA 1.5 2.026 0 CA-C-O 121.45 0.643 . . . . 0.0 110.587 -179.01 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 96.1 mt-10 -62.73 -33.94 76.16 Favored 'General case' 0 N--CA 1.494 1.73 0 O-C-N 121.469 -0.769 . . . . 0.0 110.008 -179.779 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 88' ' ' LYS . . . . . 0.482 ' N ' ' O ' ' A' ' 85' ' ' SER . 88.2 tttt -63.02 -43.11 99.62 Favored 'General case' 0 N--CA 1.492 1.664 0 O-C-N 121.414 -0.804 . . . . 0.0 109.648 -179.802 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 89' ' ' LEU . . . . . 0.447 ' CD1' ' N ' ' A' ' 89' ' ' LEU . 10.6 mp -63.47 -48.47 77.53 Favored 'General case' 0 N--CA 1.495 1.788 0 O-C-N 121.604 -0.685 . . . . 0.0 110.371 -179.093 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 90' ' ' ILE . . . . . 0.506 ' CD1' ' N ' ' A' ' 90' ' ' ILE . 1.4 mp -69.67 -43.65 80.03 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.756 0 O-C-N 121.355 -0.84 . . . . 0.0 108.972 179.962 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 91' ' ' PHE . . . . . . . . . . . . . 88.3 t80 -59.2 -47.6 84.74 Favored 'General case' 0 C--N 1.302 -1.478 0 CA-C-O 121.725 0.774 . . . . 0.0 109.184 -179.585 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 92' ' ' GLU . . . . . . . . . . . . . 84.2 tt0 -69.97 -31.83 69.74 Favored 'General case' 0 N--CA 1.49 1.56 0 CA-C-O 121.533 0.682 . . . . 0.0 109.431 179.681 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 93' ' ' LEU . . . . . . . . . . . . . 61.6 tp -62.99 -45.46 92.3 Favored 'General case' 0 N--CA 1.492 1.651 0 O-C-N 121.328 -0.857 . . . . 0.0 109.754 -179.455 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 94' ' ' LYS . . . . . . . . . . . . . 52.4 mtmt -65.24 -42.38 93.43 Favored 'General case' 0 N--CA 1.491 1.6 0 CA-C-O 121.467 0.651 . . . . 0.0 110.088 -179.386 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 34.2 p -67.02 -38.35 85.79 Favored 'General case' 0 N--CA 1.492 1.669 0 O-C-N 121.514 -0.741 . . . . 0.0 110.193 -179.325 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 96' ' ' ARG . . . . . . . . . . . . . 77.8 mmt-85 -66.19 -39.02 89.38 Favored 'General case' 0 N--CA 1.493 1.686 0 O-C-N 121.302 -0.874 . . . . 0.0 109.563 -179.954 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 97' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.301 -1.535 0 CA-C-O 121.635 0.731 . . . . 0.0 109.187 179.997 . . . . . . . . 0 0 . 1 . 011 nuclear orig core ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 39.1 p-10 . . . . . 0 N--CA 1.494 1.743 0 N-CA-C 109.366 -0.605 . . . . 0.0 109.366 . . . . . . . . . 0 0 . 1 . 011 nuclear orig core ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 50.3 t -123.64 133.6 68.76 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.955 0 CA-C-O 121.602 0.715 . . . . 0.0 109.985 179.519 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 32' ' ' ALA . . . . . 0.588 ' CB ' ' HZ1' ' A' ' 88' ' ' LYS . . . -116.96 150.6 38.28 Favored 'General case' 0 N--CA 1.497 1.919 0 CA-C-O 121.977 0.894 . . . . 0.0 110.113 179.825 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 16.4 pt-20 -98.34 142.23 30.24 Favored 'General case' 0 N--CA 1.494 1.727 0 CA-C-O 121.615 0.722 . . . . 0.0 110.118 -179.821 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 34' ' ' VAL . . . . . . . . . . . . . 53.0 t -125.96 134.5 66.4 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.833 0 CA-C-O 121.789 0.804 . . . . 0.0 109.459 179.881 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 34.7 p -137.87 129.51 28.22 Favored 'General case' 0 N--CA 1.494 1.742 0 CA-C-O 121.726 0.774 . . . . 0.0 110.15 179.825 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 25.6 tp -127.99 139.83 52.34 Favored 'General case' 0 N--CA 1.492 1.64 0 CA-C-O 121.725 0.774 . . . . 0.0 109.574 179.656 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 37' ' ' PHE . . . . . . . . . . . . . 46.8 p90 -139.7 148.23 42.05 Favored 'General case' 0 N--CA 1.492 1.663 0 CA-C-O 121.902 0.858 . . . . 0.0 110.109 179.934 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . 155.31 128.52 1.15 Allowed Glycine 0 N--CA 1.49 2.234 0 N-CA-C 109.831 -1.308 . . . . 0.0 109.831 179.796 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 14.7 m 47.84 -146.6 0.25 Allowed 'General case' 0 N--CA 1.488 1.45 0 O-C-N 121.75 -0.853 . . . . 0.0 110.205 179.625 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 40' ' ' ASP . . . . . . . . . . . . . 56.1 p30 -86.94 -177.74 6.13 Favored 'General case' 0 N--CA 1.492 1.666 0 CA-C-O 121.606 0.717 . . . . 0.0 110.451 -178.903 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 88.8 tttt -62.66 -42.03 99.39 Favored 'General case' 0 N--CA 1.494 1.733 0 O-C-N 121.93 -0.481 . . . . 0.0 110.085 -179.091 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -49.86 -41.76 46.07 Favored 'General case' 0 N--CA 1.495 1.825 0 O-C-N 121.662 -0.648 . . . . 0.0 109.738 -178.645 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 43' ' ' HIS . . . . . . . . . . . . . 50.4 t-80 -64.01 -41.55 97.42 Favored 'General case' 0 N--CA 1.491 1.614 0 CA-C-O 121.353 0.597 . . . . 0.0 109.619 -179.809 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 49.8 mt -64.11 -40.11 95.5 Favored 'General case' 0 N--CA 1.492 1.64 0 O-C-N 121.628 -0.67 . . . . 0.0 109.627 -179.467 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 79.6 mm-40 -62.93 -39.59 95.05 Favored 'General case' 0 N--CA 1.493 1.68 0 O-C-N 121.769 -0.582 . . . . 0.0 109.474 -179.263 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . -62.34 -42.4 99.71 Favored Glycine 0 N--CA 1.492 2.383 0 N-CA-C 109.604 -1.398 . . . . 0.0 109.604 -179.646 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 55.1 mtpt -83.19 -18.24 39.99 Favored 'General case' 0 N--CA 1.491 1.594 0 O-C-N 121.661 -0.905 . . . . 0.0 109.255 -179.634 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 58.2 tp -64.13 -39.83 94.88 Favored 'General case' 0 N--CA 1.488 1.45 0 N-CA-C 108.901 -0.777 . . . . 0.0 108.901 179.719 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 49' ' ' ALA . . . . . . . . . . . . . . . -58.02 -41.2 82.65 Favored 'General case' 0 N--CA 1.494 1.758 0 N-CA-C 109.588 -0.523 . . . . 0.0 109.588 -179.018 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 79.5 mm-40 -68.92 -37.16 78.76 Favored 'General case' 0 N--CA 1.494 1.753 0 O-C-N 121.648 -0.657 . . . . 0.0 109.244 179.966 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 3.6 m-85 -61.54 -43.88 98.06 Favored 'General case' 0 N--CA 1.496 1.836 0 O-C-N 121.615 -0.678 . . . . 0.0 109.505 -179.326 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 52' ' ' ILE . . . . . . . . . . . . . 90.8 mt -64.22 -42.38 95.3 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.653 0 N-CA-C 109.0 -0.741 . . . . 0.0 109.0 -179.973 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 11.5 t -59.01 -42.69 90.73 Favored 'General case' 0 N--CA 1.489 1.523 0 N-CA-C 109.092 -0.707 . . . . 0.0 109.092 -179.017 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 54' ' ' LEU . . . . . . . . . . . . . 88.8 mt -63.15 -40.95 99.05 Favored 'General case' 0 C--N 1.301 -1.541 0 N-CA-C 109.231 -0.655 . . . . 0.0 109.231 -179.962 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -65.93 -38.86 89.75 Favored 'General case' 0 N--CA 1.494 1.758 0 O-C-N 121.939 -0.476 . . . . 0.0 110.002 -179.253 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 56' ' ' LYS . . . . . . . . . . . . . 64.7 mttm -64.81 -41.46 95.76 Favored 'General case' 0 N--CA 1.493 1.717 0 O-C-N 121.528 -0.732 . . . . 0.0 109.79 -179.821 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 87.8 mt-30 -61.66 -46.23 90.64 Favored 'General case' 0 N--CA 1.488 1.474 0 N-CA-C 109.074 -0.713 . . . . 0.0 109.074 -179.502 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 58' ' ' VAL . . . . . . . . . . . . . 76.0 t -66.41 -44.27 90.75 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.591 0 N-CA-C 109.235 -0.654 . . . . 0.0 109.235 179.794 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 59' ' ' TYR . . . . . . . . . . . . . 87.7 t80 -140.42 118.53 11.95 Favored 'General case' 0 N--CA 1.498 1.929 0 CA-C-O 121.813 0.816 . . . . 0.0 110.046 -179.844 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -70.79 149.15 47.15 Favored 'General case' 0 N--CA 1.495 1.797 0 CA-C-O 121.572 0.701 . . . . 0.0 110.895 -179.854 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 61' ' ' ASN . . . . . . . . . . . . . 50.2 t-20 61.42 42.47 11.54 Favored 'General case' 0 N--CA 1.493 1.687 0 CA-C-O 121.602 0.715 . . . . 0.0 109.089 179.671 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 62' ' ' VAL . . . . . . . . . . . . . 9.4 p -80.37 137.27 21.78 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.531 0 CA-C-O 121.636 0.731 . . . . 0.0 110.383 -179.811 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 96.6 mt-10 -111.39 146.17 37.62 Favored 'General case' 0 N--CA 1.495 1.793 0 CA-C-O 121.967 0.889 . . . . 0.0 109.932 -179.844 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 64' ' ' TYR . . . . . . . . . . . . . 55.1 p90 -151.47 161.03 43.4 Favored 'General case' 0 N--CA 1.489 1.516 0 CA-C-O 121.503 0.668 . . . . 0.0 110.023 -179.667 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 74.6 mm-40 -138.13 151.02 47.37 Favored 'General case' 0 N--CA 1.5 2.049 0 CA-C-O 121.707 0.765 . . . . 0.0 110.406 -179.481 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 66' ' ' VAL . . . . . . . . . . . . . 53.4 t -122.62 130.84 74.21 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.969 0 CA-C-O 121.923 0.868 . . . . 0.0 110.163 -179.549 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -81.41 170.28 15.88 Favored Pre-proline 0 N--CA 1.487 1.38 0 CA-C-O 121.167 0.508 . . . . 0.0 109.739 179.812 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 68' ' ' PRO . . . . . . . . . . . . . 31.5 Cg_exo -56.55 122.86 12.54 Favored 'Trans proline' 0 N--CA 1.494 1.557 0 C-N-CA 122.537 2.158 . . . . 0.0 112.601 179.922 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 69' ' ' VAL . . . . . . . . . . . . . 67.8 t -135.45 134.1 52.16 Favored 'Isoleucine or valine' 0 N--CA 1.499 1.975 0 CA-C-O 121.789 0.804 . . . . 0.0 110.379 179.903 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -71.55 151.64 43.67 Favored 'General case' 0 N--CA 1.497 1.877 0 CA-C-O 121.578 0.704 . . . . 0.0 110.583 179.934 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 98.4 m-20 -62.43 -35.93 80.81 Favored 'General case' 0 N--CA 1.493 1.722 0 N-CA-C 109.531 -0.544 . . . . 0.0 109.531 -179.537 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 72' ' ' ASN . . . . . . . . . . . . . 56.6 p30 -92.04 11.54 24.92 Favored 'General case' 0 N--CA 1.495 1.775 0 O-C-N 121.555 -0.716 . . . . 0.0 109.363 -179.288 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -66.14 144.03 56.92 Favored 'General case' 0 N--CA 1.493 1.723 0 O-C-N 121.496 -0.752 . . . . 0.0 109.736 179.833 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 74' ' ' THR . . . . . . . . . . . . . 3.8 m -99.18 -3.54 34.17 Favored 'General case' 0 N--CA 1.493 1.681 0 N-CA-C 108.697 -0.853 . . . . 0.0 108.697 -179.873 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 84.0 tt0 -135.88 150.49 49.38 Favored 'General case' 0 N--CA 1.492 1.656 0 CA-C-O 121.792 0.806 . . . . 0.0 109.522 179.977 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 4.7 tt -131.21 128.29 39.66 Favored 'General case' 0 N--CA 1.489 1.52 0 CA-C-O 121.806 0.812 . . . . 0.0 109.841 -179.725 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 77' ' ' HIS . . . . . . . . . . . . . 80.5 m80 -96.92 131.41 43.72 Favored 'General case' 0 N--CA 1.493 1.686 0 CA-C-O 121.857 0.836 . . . . 0.0 109.435 -179.805 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -147.64 155.78 42.12 Favored 'General case' 0 N--CA 1.49 1.551 0 CA-C-O 121.716 0.77 . . . . 0.0 109.995 -179.85 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 95.2 mtt180 -128.54 137.66 51.86 Favored 'General case' 0 N--CA 1.496 1.849 0 CA-C-O 121.794 0.807 . . . . 0.0 109.728 -179.881 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 80' ' ' PHE . . . . . . . . . . . . . 30.0 m-85 -129.44 147.78 51.29 Favored 'General case' 0 N--CA 1.495 1.809 0 CA-C-O 121.723 0.773 . . . . 0.0 109.629 179.885 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -124.96 146.24 49.48 Favored 'General case' 0 N--CA 1.495 1.813 0 CA-C-O 121.622 0.725 . . . . 0.0 109.774 179.902 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 82' ' ' PHE . . . . . . . . . . . . . 97.7 m-85 -132.67 -97.6 0.3 Allowed 'General case' 0 N--CA 1.496 1.873 0 CA-C-O 121.351 0.596 . . . . 0.0 109.701 -179.869 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 6.1 pt-20 -177.32 -28.87 0.01 OUTLIER 'General case' 0 N--CA 1.494 1.757 0 O-C-N 121.341 -0.85 . . . . 0.0 108.812 -179.82 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 84' ' ' VAL . . . . . . . . . . . . . 33.7 m -134.27 160.11 41.79 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.903 0 CA-C-O 121.814 0.816 . . . . 0.0 110.208 -179.918 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 35.6 m -79.61 -18.06 52.43 Favored 'General case' 0 N--CA 1.493 1.706 0 CA-C-O 121.348 0.595 . . . . 0.0 109.679 -179.711 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 86' ' ' ALA . . . . . . . . . . . . . . . -63.27 -42.93 99.19 Favored 'General case' 0 N--CA 1.493 1.712 0 O-C-N 121.519 -0.738 . . . . 0.0 109.515 -179.337 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 92.5 mt-10 -67.31 -29.64 69.27 Favored 'General case' 0 N--CA 1.493 1.708 0 O-C-N 121.523 -0.736 . . . . 0.0 109.471 -179.701 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 88' ' ' LYS . . . . . 0.588 ' HZ1' ' CB ' ' A' ' 32' ' ' ALA . 64.6 tttp -63.22 -46.06 88.74 Favored 'General case' 0 N--CA 1.489 1.498 0 O-C-N 121.681 -0.637 . . . . 0.0 109.531 -179.413 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 96.6 mt -64.14 -48.87 74.36 Favored 'General case' 0 N--CA 1.491 1.606 0 O-C-N 121.685 -0.634 . . . . 0.0 110.095 -178.965 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 90' ' ' ILE . . . . . 0.514 ' CD1' ' N ' ' A' ' 90' ' ' ILE . 1.3 mp -68.68 -44.21 82.6 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.612 0 O-C-N 121.766 -0.584 . . . . 0.0 109.735 179.904 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 91' ' ' PHE . . . . . . . . . . . . . 85.7 t80 -61.81 -44.73 96.28 Favored 'General case' 0 C--N 1.301 -1.542 0 N-CA-C 108.723 -0.843 . . . . 0.0 108.723 -178.972 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 92' ' ' GLU . . . . . . . . . . . . . 50.8 tp10 -63.16 -37.52 87.54 Favored 'General case' 0 C--N 1.302 -1.463 0 N-CA-C 109.28 -0.637 . . . . 0.0 109.28 -179.628 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 93' ' ' LEU . . . . . . . . . . . . . 6.3 tt -63.27 -46.6 86.06 Favored 'General case' 0 N--CA 1.489 1.511 0 CA-C-O 121.426 0.631 . . . . 0.0 109.677 -179.43 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 94' ' ' LYS . . . . . . . . . . . . . 67.8 mttm -66.5 -44.84 81.46 Favored 'General case' 0 N--CA 1.491 1.589 0 O-C-N 121.792 -0.568 . . . . 0.0 110.262 -179.408 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 22.3 p -69.13 -41.77 76.91 Favored 'General case' 0 N--CA 1.494 1.765 0 O-C-N 121.518 -0.738 . . . . 0.0 109.847 -179.188 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 96' ' ' ARG . . . . . . . . . . . . . 64.0 ttm-85 -68.23 -42.3 79.97 Favored 'General case' 0 N--CA 1.491 1.623 0 O-C-N 121.536 -0.727 . . . . 0.0 109.042 -179.818 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 97' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 1.526 0 N-CA-C 109.217 -0.661 . . . . 0.0 109.217 -179.499 . . . . . . . . 0 0 . 1 . 012 nuclear orig core ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 62.3 t0 . . . . . 0 N--CA 1.492 1.662 0 N-CA-C 108.674 -0.861 . . . . 0.0 108.674 . . . . . . . . . 0 0 . 1 . 012 nuclear orig core ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 4.2 p -129.25 153.98 39.45 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.804 0 CA-C-O 121.349 0.595 . . . . 0.0 109.851 -179.58 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -133.18 148.12 52.06 Favored 'General case' 0 N--CA 1.493 1.71 0 CA-C-O 121.661 0.744 . . . . 0.0 109.575 -179.953 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 33' ' ' GLU . . . . . 0.426 ' O ' ' NZ ' ' A' ' 88' ' ' LYS . 98.2 mt-10 -92.17 148.06 22.45 Favored 'General case' 0 N--CA 1.49 1.557 0 CA-C-O 121.559 0.695 . . . . 0.0 110.084 -179.877 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 34' ' ' VAL . . . . . . . . . . . . . 51.6 t -127.01 132.64 69.73 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.671 0 CA-C-O 121.556 0.693 . . . . 0.0 109.385 -179.962 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 70.7 m -125.48 122.75 37.53 Favored 'General case' 0 N--CA 1.492 1.65 0 N-CA-C 109.342 -0.614 . . . . 0.0 109.342 179.918 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 39.8 tp -120.85 133.07 55.31 Favored 'General case' 0 N--CA 1.496 1.841 0 CA-C-O 121.602 0.715 . . . . 0.0 109.336 179.741 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 37' ' ' PHE . . . . . . . . . . . . . 83.4 m-85 -93.94 147.79 22.77 Favored 'General case' 0 N--CA 1.49 1.557 0 CA-C-O 121.646 0.736 . . . . 0.0 110.083 -179.526 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . 179.96 -179.29 48.81 Favored Glycine 0 N--CA 1.487 2.045 0 N-CA-C 110.05 -1.22 . . . . 0.0 110.05 179.877 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 39' ' ' SER . . . . . 0.629 ' HG ' ' H ' ' A' ' 40' ' ' ASP . 13.3 p -82.7 -102.85 0.04 OUTLIER 'General case' 0 N--CA 1.49 1.54 0 O-C-N 121.692 -0.887 . . . . 0.0 110.325 -179.715 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 40' ' ' ASP . . . . . 0.629 ' H ' ' HG ' ' A' ' 39' ' ' SER . 52.4 p-10 -83.8 174.97 9.98 Favored 'General case' 0 N--CA 1.492 1.629 0 O-C-N 121.371 -0.83 . . . . 0.0 110.777 -179.037 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 37.5 ttmt -62.95 -39.91 96.06 Favored 'General case' 0 N--CA 1.49 1.54 0 O-C-N 121.712 -0.617 . . . . 0.0 110.63 -179.353 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -56.17 -43.32 78.26 Favored 'General case' 0 N--CA 1.495 1.815 0 O-C-N 121.223 -0.923 . . . . 0.0 109.893 -179.166 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 43' ' ' HIS . . . . . . . . . . . . . 83.2 t60 -66.9 -43.11 84.27 Favored 'General case' 0 N--CA 1.494 1.773 0 O-C-N 121.408 -0.808 . . . . 0.0 109.878 -179.853 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 47.5 mt -63.86 -40.58 96.9 Favored 'General case' 0 N--CA 1.494 1.774 0 O-C-N 121.302 -0.874 . . . . 0.0 109.939 -179.642 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 97.1 mt-10 -65.09 -36.12 83.29 Favored 'General case' 0 N--CA 1.494 1.765 0 O-C-N 121.315 -0.865 . . . . 0.0 109.662 -179.708 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . -61.02 -42.47 99.81 Favored Glycine 0 N--CA 1.492 2.395 0 N-CA-C 109.407 -1.477 . . . . 0.0 109.407 179.993 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 97.4 mttt -83.19 -17.11 44.0 Favored 'General case' 0 N--CA 1.492 1.633 0 O-C-N 121.533 -0.98 . . . . 0.0 109.308 179.548 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 51.5 tp -65.18 -39.44 92.91 Favored 'General case' 0 N--CA 1.491 1.611 0 O-C-N 121.536 -0.728 . . . . 0.0 109.697 179.954 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 49' ' ' ALA . . . . . . . . . . . . . . . -54.25 -28.59 42.52 Favored 'General case' 0 N--CA 1.491 1.618 0 O-C-N 121.591 -0.693 . . . . 0.0 109.571 -179.131 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 80.5 mm-40 -66.72 -42.75 85.83 Favored 'General case' 0 N--CA 1.492 1.638 0 O-C-N 121.384 -0.822 . . . . 0.0 109.335 179.78 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 32.0 m-85 -61.2 -44.62 96.99 Favored 'General case' 0 N--CA 1.495 1.811 0 O-C-N 121.551 -0.718 . . . . 0.0 109.891 -179.969 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 52' ' ' ILE . . . . . 0.472 ' CG2' ' HZ2' ' A' ' 56' ' ' LYS . 96.6 mt -65.28 -43.75 95.09 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.59 0 O-C-N 121.676 -0.64 . . . . 0.0 110.58 -179.208 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 5.2 t -61.06 -51.62 68.39 Favored 'General case' 0 N--CA 1.494 1.741 0 O-C-N 121.271 -0.893 . . . . 0.0 110.316 -179.037 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 54' ' ' LEU . . . . . . . . . . . . . 4.0 mm? -66.0 -38.07 87.53 Favored 'General case' 0 N--CA 1.492 1.657 0 O-C-N 121.525 -0.734 . . . . 0.0 109.886 179.716 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -55.39 -48.12 74.82 Favored 'General case' 0 N--CA 1.49 1.572 0 O-C-N 121.513 -0.742 . . . . 0.0 110.332 -179.029 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 56' ' ' LYS . . . . . 0.472 ' HZ2' ' CG2' ' A' ' 52' ' ' ILE . 61.4 mttp -65.65 -42.68 91.12 Favored 'General case' 0 N--CA 1.493 1.683 0 O-C-N 121.299 -0.876 . . . . 0.0 110.121 -179.921 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 27.4 mt-30 -65.62 -45.69 82.14 Favored 'General case' 0 N--CA 1.493 1.7 0 O-C-N 121.402 -0.811 . . . . 0.0 109.488 -179.656 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 58' ' ' VAL . . . . . . . . . . . . . 71.7 t -65.15 -45.86 92.76 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.478 0 O-C-N 121.589 -0.695 . . . . 0.0 109.343 179.783 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 59' ' ' TYR . . . . . . . . . . . . . 52.4 t80 -132.33 119.52 20.85 Favored 'General case' 0 N--CA 1.496 1.853 0 CA-C-O 121.616 0.722 . . . . 0.0 109.108 -179.979 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -70.51 144.39 51.36 Favored 'General case' 0 N--CA 1.491 1.592 0 CA-C-O 121.813 0.816 . . . . 0.0 110.913 -179.236 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 61' ' ' ASN . . . . . . . . . . . . . 40.3 t-20 57.79 41.81 24.4 Favored 'General case' 0 N--CA 1.492 1.63 0 CA-C-O 121.851 0.834 . . . . 0.0 109.349 179.926 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 62' ' ' VAL . . . . . . . . . . . . . 8.2 p -74.09 138.84 20.35 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.48 0 CA-C-O 121.631 0.729 . . . . 0.0 110.452 -179.776 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 71.7 mm-40 -112.64 137.59 50.68 Favored 'General case' 0 N--CA 1.494 1.751 0 CA-C-O 121.609 0.719 . . . . 0.0 109.402 179.968 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 64' ' ' TYR . . . . . . . . . . . . . 50.9 p90 -149.64 161.08 42.88 Favored 'General case' 0 N--CA 1.489 1.493 0 CA-C-O 121.721 0.772 . . . . 0.0 110.337 -179.585 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 50.8 tp10 -142.4 148.72 38.29 Favored 'General case' 0 N--CA 1.49 1.573 0 N-CA-C 108.997 -0.742 . . . . 0.0 108.997 179.782 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 66' ' ' VAL . . . . . . . . . . . . . 54.9 t -111.62 130.87 64.41 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.791 0 CA-C-O 121.79 0.805 . . . . 0.0 109.839 -179.59 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -82.18 158.91 66.22 Favored Pre-proline 0 N--CA 1.488 1.425 0 N-CA-C 109.605 -0.517 . . . . 0.0 109.605 -179.759 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 68' ' ' PRO . . . . . . . . . . . . . 48.6 Cg_exo -51.26 128.8 26.58 Favored 'Trans proline' 0 N--CA 1.493 1.45 0 C-N-CA 122.233 1.955 . . . . 0.0 112.178 179.039 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 69' ' ' VAL . . . . . . . . . . . . . 54.0 t -131.27 135.31 59.83 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.754 0 CA-C-O 121.649 0.738 . . . . 0.0 110.02 -179.827 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -69.71 152.47 44.62 Favored 'General case' 0 C--N 1.303 -1.451 0 CA-C-O 121.75 0.786 . . . . 0.0 110.006 179.554 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 12.9 m-20 -64.27 -34.49 78.24 Favored 'General case' 0 N--CA 1.491 1.586 0 O-C-N 121.629 -0.67 . . . . 0.0 109.424 179.886 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 72' ' ' ASN . . . . . . . . . . . . . 57.1 p30 -94.8 16.32 16.18 Favored 'General case' 0 N--CA 1.493 1.704 0 O-C-N 121.348 -0.845 . . . . 0.0 109.435 -179.445 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 73' ' ' ALA . . . . . 0.43 ' O ' ' O ' ' A' ' 39' ' ' SER . . . -66.6 144.95 56.11 Favored 'General case' 0 N--CA 1.491 1.594 0 O-C-N 121.525 -0.734 . . . . 0.0 110.059 179.964 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 74' ' ' THR . . . . . . . . . . . . . 61.4 p -101.13 -0.96 35.2 Favored 'General case' 0 N--CA 1.493 1.688 0 O-C-N 121.551 -0.718 . . . . 0.0 109.299 179.857 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 95.3 mt-10 -139.58 160.05 40.76 Favored 'General case' 0 N--CA 1.496 1.856 0 O-C-N 121.256 -0.903 . . . . 0.0 109.835 -179.856 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 6.5 tp -123.8 131.15 53.53 Favored 'General case' 0 N--CA 1.491 1.617 0 CA-C-O 121.524 0.678 . . . . 0.0 109.37 -179.95 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 77' ' ' HIS . . . . . . . . . . . . . 97.2 m-70 -106.35 126.77 52.65 Favored 'General case' 0 N--CA 1.493 1.681 0 CA-C-O 121.541 0.686 . . . . 0.0 109.689 -179.767 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -149.4 159.75 44.03 Favored 'General case' 0 N--CA 1.49 1.529 0 CA-C-O 121.507 0.67 . . . . 0.0 109.848 -179.763 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 86.4 mtm-85 -127.47 142.37 51.42 Favored 'General case' 0 N--CA 1.495 1.8 0 CA-C-O 121.508 0.671 . . . . 0.0 109.433 -179.847 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 80' ' ' PHE . . . . . . . . . . . . . 44.1 m-85 -127.87 149.47 50.28 Favored 'General case' 0 N--CA 1.498 1.931 0 CA-C-O 121.401 0.619 . . . . 0.0 109.741 -179.482 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 82.8 tttt -111.73 133.36 54.01 Favored 'General case' 0 N--CA 1.493 1.698 0 CA-C-O 121.554 0.692 . . . . 0.0 109.685 -179.861 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 82' ' ' PHE . . . . . . . . . . . . . 71.8 m-85 -137.54 -128.53 0.13 Allowed 'General case' 0 N--CA 1.494 1.73 0 CA-C-O 121.442 0.639 . . . . 0.0 109.711 -179.665 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 81.3 tt0 -149.8 -34.14 0.18 Allowed 'General case' 0 N--CA 1.489 1.489 0 O-C-N 121.519 -0.738 . . . . 0.0 109.132 -179.765 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 84' ' ' VAL . . . . . . . . . . . . . 34.8 m -135.08 158.28 41.05 Favored 'Isoleucine or valine' 0 N--CA 1.499 1.98 0 O-C-N 121.31 -0.869 . . . . 0.0 110.348 -179.971 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 82.8 p -74.07 -16.77 61.02 Favored 'General case' 0 N--CA 1.491 1.582 0 CA-C-O 121.327 0.584 . . . . 0.0 109.823 -179.952 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 86' ' ' ALA . . . . . . . . . . . . . . . -63.89 -38.2 90.22 Favored 'General case' 0 N--CA 1.492 1.667 0 O-C-N 121.367 -0.833 . . . . 0.0 109.457 -179.761 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 94.4 mt-10 -68.08 -35.05 77.56 Favored 'General case' 0 N--CA 1.491 1.624 0 O-C-N 121.499 -0.75 . . . . 0.0 109.302 179.683 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 88' ' ' LYS . . . . . 0.426 ' NZ ' ' O ' ' A' ' 33' ' ' GLU . 49.1 tptt -61.95 -44.48 96.67 Favored 'General case' 0 C--N 1.302 -1.491 0 O-C-N 121.436 -0.79 . . . . 0.0 109.211 179.82 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 42.5 tp -62.07 -50.16 73.08 Favored 'General case' 0 C--N 1.303 -1.431 0 O-C-N 121.651 -0.655 . . . . 0.0 109.817 -179.029 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 90' ' ' ILE . . . . . . . . . . . . . 96.6 mt -66.66 -43.03 90.5 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.773 0 O-C-N 121.529 -0.732 . . . . 0.0 109.878 179.929 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 91' ' ' PHE . . . . . . . . . . . . . 71.1 t80 -59.35 -46.09 89.59 Favored 'General case' 0 N--CA 1.493 1.679 0 O-C-N 121.468 -0.77 . . . . 0.0 109.649 -179.186 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 92' ' ' GLU . . . . . . . . . . . . . 9.5 tm-20 -66.98 -41.18 87.22 Favored 'General case' 0 N--CA 1.49 1.536 0 CA-C-O 121.691 0.758 . . . . 0.0 109.191 179.881 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 93' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -63.87 -47.71 79.61 Favored 'General case' 0 C--N 1.303 -1.437 0 CA-C-O 121.932 0.873 . . . . 0.0 109.651 -179.226 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 94' ' ' LYS . . . . . . . . . . . . . 54.9 mtpt -65.04 -43.52 92.05 Favored 'General case' 0 C--N 1.3 -1.567 0 O-C-N 121.411 -0.806 . . . . 0.0 109.786 -179.252 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 40.9 p -69.06 -35.56 76.69 Favored 'General case' 0 N--CA 1.491 1.6 0 O-C-N 121.608 -0.683 . . . . 0.0 109.847 -179.867 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 96' ' ' ARG . . . . . . . . . . . . . 74.1 ttt180 -64.63 -42.9 95.16 Favored 'General case' 0 N--CA 1.491 1.587 0 O-C-N 121.487 -0.758 . . . . 0.0 109.267 179.798 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 97' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.493 1.704 0 CA-C-O 121.477 0.656 . . . . 0.0 109.482 -179.946 . . . . . . . . 0 0 . 1 . 013 nuclear orig core ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 97.3 m-20 . . . . . 0 N--CA 1.488 1.472 0 CA-C-O 121.515 0.674 . . . . 0.0 109.846 . . . . . . . . . 0 0 . 1 . 013 nuclear orig core ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 8.6 p -123.13 144.62 32.06 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.708 0 CA-C-O 121.354 0.597 . . . . 0.0 109.487 179.955 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -116.71 155.46 28.82 Favored 'General case' 0 N--CA 1.495 1.781 0 CA-C-O 121.473 0.654 . . . . 0.0 109.383 -179.404 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 77.7 mm-40 -108.26 136.06 48.55 Favored 'General case' 0 N--CA 1.494 1.729 0 CA-C-O 121.598 0.713 . . . . 0.0 109.61 179.858 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 34' ' ' VAL . . . . . . . . . . . . . 56.0 t -127.26 134.38 66.02 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.874 0 CA-C-O 121.592 0.711 . . . . 0.0 109.937 -179.579 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 45.8 p -136.68 122.42 19.86 Favored 'General case' 0 N--CA 1.493 1.704 0 N-CA-C 108.73 -0.841 . . . . 0.0 108.73 179.299 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 51.0 tp -117.7 143.59 46.05 Favored 'General case' 0 N--CA 1.497 1.882 0 CA-C-O 121.645 0.736 . . . . 0.0 110.109 -179.443 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 37' ' ' PHE . . . . . . . . . . . . . 82.9 m-85 -105.84 145.62 30.98 Favored 'General case' 0 N--CA 1.494 1.752 0 CA-C-O 121.657 0.741 . . . . 0.0 109.998 -179.858 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . -173.55 175.28 46.27 Favored Glycine 0 N--CA 1.487 2.081 0 N-CA-C 109.77 -1.332 . . . . 0.0 109.77 -179.972 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 52.5 p -81.85 -92.28 0.06 Allowed 'General case' 0 N--CA 1.492 1.633 0 O-C-N 121.582 -0.952 . . . . 0.0 109.989 -179.819 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 40' ' ' ASP . . . . . . . . . . . . . 99.8 m-20 -82.24 168.82 17.25 Favored 'General case' 0 N--CA 1.495 1.779 0 O-C-N 121.225 -0.922 . . . . 0.0 110.631 -179.387 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 65.8 tttm -64.04 -38.82 92.46 Favored 'General case' 0 N--CA 1.497 1.908 0 O-C-N 121.652 -0.655 . . . . 0.0 110.514 -179.933 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -56.01 -39.21 71.55 Favored 'General case' 0 N--CA 1.494 1.766 0 O-C-N 121.314 -0.866 . . . . 0.0 109.935 -179.246 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 43' ' ' HIS . . . . . 0.624 ' CE1' ' NZ ' ' A' ' 47' ' ' LYS . 78.1 t60 -66.79 -45.2 79.16 Favored 'General case' 0 N--CA 1.494 1.743 0 O-C-N 121.315 -0.866 . . . . 0.0 109.861 -179.928 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 81.8 mt -64.69 -41.67 95.87 Favored 'General case' 0 N--CA 1.497 1.91 0 O-C-N 121.382 -0.823 . . . . 0.0 109.955 -179.69 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 71.1 mm-40 -63.91 -38.4 90.93 Favored 'General case' 0 N--CA 1.491 1.593 0 CA-C-O 121.66 0.743 . . . . 0.0 109.573 -179.81 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . -57.86 -54.81 34.45 Favored Glycine 0 N--CA 1.492 2.394 0 N-CA-C 109.823 -1.311 . . . . 0.0 109.823 -179.589 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 47' ' ' LYS . . . . . 0.624 ' NZ ' ' CE1' ' A' ' 43' ' ' HIS . 50.5 mttp -66.29 -37.8 86.27 Favored 'General case' 0 N--CA 1.494 1.755 0 O-C-N 121.497 -1.002 . . . . 0.0 109.761 179.45 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 50.5 tp -49.45 -36.17 21.71 Favored 'General case' 0 N--CA 1.492 1.632 0 O-C-N 121.497 -0.752 . . . . 0.0 109.394 -179.525 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 49' ' ' ALA . . . . . . . . . . . . . . . -55.03 -40.1 69.87 Favored 'General case' 0 N--CA 1.493 1.718 0 O-C-N 121.407 -0.808 . . . . 0.0 109.715 -179.918 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 96.8 mt-10 -67.21 -39.43 86.28 Favored 'General case' 0 N--CA 1.497 1.887 0 O-C-N 121.355 -0.84 . . . . 0.0 109.939 -179.888 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 12.4 m-85 -61.6 -47.41 85.61 Favored 'General case' 0 N--CA 1.496 1.856 0 O-C-N 121.36 -0.837 . . . . 0.0 109.918 -179.556 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 52' ' ' ILE . . . . . . . . . . . . . 96.8 mt -66.17 -43.13 92.15 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.629 0 O-C-N 121.524 -0.735 . . . . 0.0 109.884 -179.619 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 80.5 p -58.93 -43.21 91.14 Favored 'General case' 0 N--CA 1.494 1.769 0 O-C-N 121.371 -0.831 . . . . 0.0 109.498 -179.328 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 54' ' ' LEU . . . . . . . . . . . . . 79.7 mt -64.95 -39.88 94.17 Favored 'General case' 0 N--CA 1.494 1.734 0 O-C-N 121.461 -0.774 . . . . 0.0 109.366 179.358 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -58.56 -42.68 88.48 Favored 'General case' 0 N--CA 1.49 1.546 0 CA-C-O 121.535 0.683 . . . . 0.0 109.595 -179.774 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 56' ' ' LYS . . . . . . . . . . . . . 54.0 mtmt -64.9 -45.31 86.44 Favored 'General case' 0 N--CA 1.492 1.672 0 O-C-N 121.326 -0.859 . . . . 0.0 109.554 179.658 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 99.3 mm-40 -63.47 -44.13 95.33 Favored 'General case' 0 N--CA 1.494 1.736 0 O-C-N 121.589 -0.694 . . . . 0.0 109.64 -179.866 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 58' ' ' VAL . . . . . . . . . . . . . 79.4 t -65.17 -45.43 93.98 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.691 0 O-C-N 121.283 -0.885 . . . . 0.0 109.443 179.823 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 59' ' ' TYR . . . . . . . . . . . . . 82.8 t80 -140.25 120.06 13.45 Favored 'General case' 0 N--CA 1.497 1.881 0 O-C-N 121.272 -0.893 . . . . 0.0 109.589 -179.975 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -68.09 148.1 51.42 Favored 'General case' 0 N--CA 1.491 1.586 0 CA-C-O 121.819 0.818 . . . . 0.0 110.631 -179.717 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 61' ' ' ASN . . . . . . . . . . . . . 8.5 t-20 59.44 40.73 20.42 Favored 'General case' 0 N--CA 1.493 1.68 0 CA-C-O 121.689 0.757 . . . . 0.0 109.693 -179.879 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 62' ' ' VAL . . . . . . . . . . . . . 14.9 p -74.84 139.62 18.85 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.618 0 O-C-N 121.52 -0.737 . . . . 0.0 110.056 179.782 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 63' ' ' GLU . . . . . 0.548 ' OE1' ' N ' ' A' ' 63' ' ' GLU . 56.6 mp0 -109.84 137.15 48.04 Favored 'General case' 0 N--CA 1.495 1.785 0 CA-C-O 121.583 0.706 . . . . 0.0 109.474 -179.656 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 64' ' ' TYR . . . . . . . . . . . . . 53.4 p90 -148.68 163.37 37.51 Favored 'General case' 0 N--CA 1.492 1.643 0 CA-C-O 121.718 0.771 . . . . 0.0 110.252 -179.22 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 44.9 tt0 -141.96 147.81 37.59 Favored 'General case' 0 N--CA 1.494 1.762 0 N-CA-C 108.979 -0.749 . . . . 0.0 108.979 179.711 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 66' ' ' VAL . . . . . . . . . . . . . 92.1 t -120.13 130.19 74.6 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.965 0 CA-C-O 121.654 0.74 . . . . 0.0 110.204 -179.825 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -75.72 152.35 85.01 Favored Pre-proline 0 N--CA 1.485 1.319 0 N-CA-C 109.349 -0.611 . . . . 0.0 109.349 -179.888 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 68' ' ' PRO . . . . . . . . . . . . . 80.4 Cg_exo -42.44 131.39 5.09 Favored 'Trans proline' 0 C--N 1.31 -1.449 0 C-N-CA 122.637 2.224 . . . . 0.0 112.89 179.672 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 69' ' ' VAL . . . . . . . . . . . . . 88.3 t -125.32 131.21 72.58 Favored 'Isoleucine or valine' 0 N--CA 1.499 1.985 0 CA-C-O 121.722 0.772 . . . . 0.0 109.978 -179.955 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -76.98 156.33 31.98 Favored 'General case' 0 C--N 1.302 -1.495 0 CA-C-O 121.619 0.723 . . . . 0.0 110.016 179.863 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 71' ' ' ASP . . . . . 0.404 ' O ' ' OD1' ' A' ' 71' ' ' ASP . 62.9 t0 -63.13 -37.77 88.55 Favored 'General case' 0 N--CA 1.493 1.692 0 O-C-N 121.542 -0.724 . . . . 0.0 109.694 179.727 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 72' ' ' ASN . . . . . . . . . . . . . 8.5 m120 -94.23 13.05 24.62 Favored 'General case' 0 N--CA 1.496 1.846 0 O-C-N 121.226 -0.922 . . . . 0.0 109.171 -179.948 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -60.03 141.82 55.04 Favored 'General case' 0 N--CA 1.493 1.723 0 O-C-N 121.34 -0.85 . . . . 0.0 109.972 -179.696 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 74' ' ' THR . . . . . . . . . . . . . 16.4 p -104.83 0.23 27.86 Favored 'General case' 0 N--CA 1.494 1.73 0 N-CA-C 109.013 -0.736 . . . . 0.0 109.013 179.585 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 84.3 tt0 -144.46 149.84 36.65 Favored 'General case' 0 N--CA 1.494 1.772 0 O-C-N 121.143 -0.973 . . . . 0.0 109.614 179.766 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 6.3 tt -124.47 130.35 52.31 Favored 'General case' 0 N--CA 1.494 1.726 0 CA-C-O 121.325 0.583 . . . . 0.0 109.512 179.885 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 77' ' ' HIS . . . . . . . . . . . . . 96.4 m-70 -107.59 130.76 54.86 Favored 'General case' 0 N--CA 1.495 1.808 0 CA-C-O 121.655 0.74 . . . . 0.0 109.679 -179.711 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -146.15 156.82 43.69 Favored 'General case' 0 N--CA 1.49 1.561 0 O-C-N 121.6 -0.687 . . . . 0.0 109.318 -179.697 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 84.6 mtt85 -129.67 145.91 51.49 Favored 'General case' 0 N--CA 1.495 1.82 0 O-C-N 121.646 -0.659 . . . . 0.0 109.629 -179.62 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 80' ' ' PHE . . . . . . . . . . . . . 92.8 m-85 -129.64 145.92 51.47 Favored 'General case' 0 N--CA 1.495 1.816 0 O-C-N 121.637 -0.664 . . . . 0.0 109.353 -179.862 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 27.6 ttpt -117.04 121.53 41.6 Favored 'General case' 0 N--CA 1.494 1.752 0 CA-C-O 121.507 0.67 . . . . 0.0 109.721 -179.785 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 82' ' ' PHE . . . . . . . . . . . . . 68.8 m-85 -111.42 148.81 32.29 Favored 'General case' 0 N--CA 1.495 1.816 0 CA-C-O 121.637 0.732 . . . . 0.0 109.756 179.784 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 80.6 tt0 -64.16 -31.79 73.12 Favored 'General case' 0 N--CA 1.49 1.555 0 O-C-N 121.733 -0.604 . . . . 0.0 109.521 179.957 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 84' ' ' VAL . . . . . . . . . . . . . 27.6 m -134.11 156.48 40.88 Favored 'Isoleucine or valine' 0 N--CA 1.5 2.044 0 O-C-N 121.359 -0.838 . . . . 0.0 110.139 -179.853 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 78.3 p -70.26 -24.02 62.99 Favored 'General case' 0 N--CA 1.492 1.64 0 CA-C-O 121.51 0.672 . . . . 0.0 109.962 179.802 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 86' ' ' ALA . . . . . . . . . . . . . . . -59.21 -46.08 89.4 Favored 'General case' 0 N--CA 1.494 1.736 0 O-C-N 121.316 -0.865 . . . . 0.0 109.663 -179.712 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 98.4 mt-10 -70.52 -32.43 69.9 Favored 'General case' 0 N--CA 1.495 1.799 0 CA-C-O 121.742 0.782 . . . . 0.0 109.36 179.593 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 88' ' ' LYS . . . . . . . . . . . . . 14.1 tmtt? -61.98 -47.22 85.81 Favored 'General case' 0 C--N 1.301 -1.539 0 O-C-N 121.52 -0.737 . . . . 0.0 110.081 -179.713 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 95.8 mt -64.34 -43.26 95.15 Favored 'General case' 0 N--CA 1.494 1.766 0 O-C-N 121.419 -0.801 . . . . 0.0 109.639 -179.988 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 90' ' ' ILE . . . . . 0.432 HD11 HG22 ' A' ' 90' ' ' ILE . 96.9 mt -65.64 -43.54 93.86 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.667 0 CA-C-O 121.569 0.7 . . . . 0.0 109.793 -179.631 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 91' ' ' PHE . . . . . . . . . . . . . 76.5 t80 -61.4 -45.48 94.14 Favored 'General case' 0 N--CA 1.493 1.717 0 O-C-N 121.573 -0.704 . . . . 0.0 110.05 -179.465 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 92' ' ' GLU . . . . . . . . . . . . . 48.2 tp10 -66.01 -45.79 80.25 Favored 'General case' 0 N--CA 1.492 1.659 0 O-C-N 121.334 -0.854 . . . . 0.0 109.595 -179.691 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 93' ' ' LEU . . . . . . . . . . . . . 82.8 mt -64.44 -43.22 94.99 Favored 'General case' 0 N--CA 1.497 1.881 0 O-C-N 121.327 -0.858 . . . . 0.0 109.934 -179.917 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 94' ' ' LYS . . . . . . . . . . . . . 38.0 ttmt -66.57 -44.41 82.32 Favored 'General case' 0 N--CA 1.494 1.75 0 O-C-N 121.356 -0.84 . . . . 0.0 109.956 -179.824 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 20.9 p -66.35 -43.74 85.22 Favored 'General case' 0 N--CA 1.494 1.747 0 O-C-N 121.407 -0.808 . . . . 0.0 109.632 -179.716 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 96' ' ' ARG . . . . . . . . . . . . . 41.6 mmm-85 -65.94 -38.92 89.9 Favored 'General case' 0 N--CA 1.493 1.693 0 O-C-N 121.485 -0.759 . . . . 0.0 109.547 179.97 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 97' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.493 1.712 0 O-C-N 121.525 -0.734 . . . . 0.0 109.581 -179.957 . . . . . . . . 0 0 . 1 . 014 nuclear orig core ' A' A ' 30' ' ' ASP . . . . . 0.431 ' OD2' ' O ' ' A' ' 83' ' ' GLU . 98.1 m-20 . . . . . 0 N--CA 1.493 1.683 0 CA-C-O 121.56 0.695 . . . . 0.0 110.262 . . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 9.8 p -128.23 139.24 52.43 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.904 0 N-CA-C 108.717 -0.846 . . . . 0.0 108.717 179.544 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -114.93 153.6 30.26 Favored 'General case' 0 N--CA 1.498 1.958 0 O-C-N 121.633 -0.667 . . . . 0.0 109.353 -179.515 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 33' ' ' GLU . . . . . 0.547 ' N ' ' OE1' ' A' ' 33' ' ' GLU . 55.7 mp0 -103.13 145.56 29.73 Favored 'General case' 0 N--CA 1.495 1.777 0 O-C-N 121.619 -0.676 . . . . 0.0 109.381 -179.438 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 34' ' ' VAL . . . . . . . . . . . . . 46.3 t -126.14 133.75 68.11 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.936 0 N-CA-C 108.85 -0.796 . . . . 0.0 108.85 179.879 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 40.8 t -129.88 131.56 46.1 Favored 'General case' 0 N--CA 1.495 1.806 0 N-CA-C 108.86 -0.793 . . . . 0.0 108.86 179.756 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 44.5 tp -126.01 131.38 52.22 Favored 'General case' 0 N--CA 1.499 2.014 0 O-C-N 121.418 -0.801 . . . . 0.0 108.967 179.717 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 37' ' ' PHE . . . . . . . . . . . . . 93.7 m-85 -115.74 144.99 43.19 Favored 'General case' 0 N--CA 1.497 1.911 0 N-CA-C 109.294 -0.632 . . . . 0.0 109.294 -179.614 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . -174.07 176.94 46.49 Favored Glycine 0 N--CA 1.491 2.301 0 N-CA-C 109.585 -1.406 . . . . 0.0 109.585 179.907 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 34.6 p -61.36 -98.98 0.0 OUTLIER 'General case' 0 C--N 1.301 -1.528 0 O-C-N 121.267 -1.137 . . . . 0.0 110.776 -179.268 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 40' ' ' ASP . . . . . 0.418 ' OD1' ' N ' ' A' ' 41' ' ' LYS . 51.4 t0 -76.84 153.43 34.83 Favored 'General case' 0 N--CA 1.494 1.727 0 CA-C-O 121.71 0.766 . . . . 0.0 110.938 -178.67 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 41' ' ' LYS . . . . . 0.418 ' N ' ' OD1' ' A' ' 40' ' ' ASP . 65.5 tttm -64.97 -35.64 81.84 Favored 'General case' 0 N--CA 1.491 1.597 0 O-C-N 121.614 -0.679 . . . . 0.0 109.978 -179.974 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -55.94 -39.53 71.83 Favored 'General case' 0 N--CA 1.492 1.659 0 O-C-N 121.276 -0.89 . . . . 0.0 109.496 -179.382 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 43' ' ' HIS . . . . . . . . . . . . . 11.7 t-160 -62.97 -38.56 91.6 Favored 'General case' 0 N--CA 1.489 1.494 0 O-C-N 121.307 -0.871 . . . . 0.0 109.127 179.865 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 46.2 mt -61.3 -40.71 95.18 Favored 'General case' 0 N--CA 1.489 1.497 0 O-C-N 121.23 -0.919 . . . . 0.0 109.299 -179.724 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 97.7 mt-10 -62.76 -36.35 82.78 Favored 'General case' 0 N--CA 1.491 1.579 0 O-C-N 121.344 -0.848 . . . . 0.0 109.306 -179.939 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . -60.86 -41.62 99.29 Favored Glycine 0 N--CA 1.492 2.402 0 N-CA-C 109.501 -1.44 . . . . 0.0 109.501 -179.902 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 97.5 mttt -77.37 -25.13 50.65 Favored 'General case' 0 N--CA 1.493 1.702 0 O-C-N 121.118 -1.225 . . . . 0.0 109.687 179.776 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 57.8 tp -61.66 -39.2 90.54 Favored 'General case' 0 N--CA 1.49 1.554 0 O-C-N 121.432 -0.793 . . . . 0.0 109.44 179.975 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 49' ' ' ALA . . . . . . . . . . . . . . . -53.66 -42.2 67.61 Favored 'General case' 0 N--CA 1.491 1.621 0 O-C-N 121.3 -0.875 . . . . 0.0 109.948 -179.315 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 50' ' ' GLU . . . . . 0.506 ' OE1' ' N ' ' A' ' 50' ' ' GLU . 58.2 mp0 -69.96 -42.35 73.31 Favored 'General case' 0 N--CA 1.494 1.742 0 O-C-N 121.236 -0.915 . . . . 0.0 109.84 -179.679 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 51' ' ' TYR . . . . . 0.461 ' CZ ' ' CG2' ' A' ' 95' ' ' THR . 4.3 m-85 -50.85 -49.11 59.63 Favored 'General case' 0 N--CA 1.489 1.516 0 O-C-N 121.138 -0.976 . . . . 0.0 108.779 -179.193 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 52' ' ' ILE . . . . . . . . . . . . . 93.6 mt -65.52 -43.57 94.26 Favored 'Isoleucine or valine' 0 C--N 1.297 -1.675 0 O-C-N 121.57 -0.706 . . . . 0.0 110.066 179.878 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 48.0 t -58.2 -49.51 76.78 Favored 'General case' 0 N--CA 1.493 1.696 0 O-C-N 121.132 -0.98 . . . . 0.0 110.503 -178.583 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 54' ' ' LEU . . . . . 0.624 ' CD1' ' HZ2' ' A' ' 94' ' ' LYS . 4.3 mm? -64.35 -41.25 96.84 Favored 'General case' 0 N--CA 1.491 1.622 0 O-C-N 121.099 -1.001 . . . . 0.0 109.105 179.554 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -62.78 -36.35 82.82 Favored 'General case' 0 N--CA 1.49 1.527 0 O-C-N 121.382 -0.823 . . . . 0.0 109.531 -179.831 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 56' ' ' LYS . . . . . . . . . . . . . 30.3 mmtm -62.27 -45.56 92.74 Favored 'General case' 0 N--CA 1.492 1.649 0 O-C-N 121.385 -0.822 . . . . 0.0 109.934 -179.963 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 58.5 tt0 -68.87 -41.78 77.92 Favored 'General case' 0 N--CA 1.49 1.554 0 O-C-N 121.242 -0.911 . . . . 0.0 109.625 -179.86 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 58' ' ' VAL . . . . . 0.478 ' CG1' ' OE1' ' A' ' 87' ' ' GLU . 66.8 t -64.09 -45.71 95.77 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.455 0 O-C-N 121.308 -0.87 . . . . 0.0 109.607 179.883 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 59' ' ' TYR . . . . . 0.44 ' O ' ' O ' ' A' ' 60' ' ' ALA . 62.9 t80 -126.89 136.22 52.02 Favored 'General case' 0 N--CA 1.5 2.032 0 O-C-N 121.494 -0.754 . . . . 0.0 109.586 -179.46 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 60' ' ' ALA . . . . . 0.44 ' O ' ' O ' ' A' ' 59' ' ' TYR . . . -48.25 -102.99 0.0 OUTLIER 'General case' 0 N--CA 1.494 1.741 0 O-C-N 121.693 -0.63 . . . . 0.0 110.867 -179.286 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 61' ' ' ASN . . . . . . . . . . . . . 83.2 m-20 -85.51 86.9 7.34 Favored 'General case' 0 N--CA 1.492 1.637 0 O-C-N 121.266 -0.896 . . . . 0.0 109.439 -179.119 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 62' ' ' VAL . . . . . . . . . . . . . 14.7 p -81.72 136.74 22.44 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.585 0 O-C-N 121.333 -0.855 . . . . 0.0 109.687 -179.927 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 96.8 mt-10 -108.45 137.09 46.99 Favored 'General case' 0 N--CA 1.5 2.05 0 O-C-N 121.407 -0.808 . . . . 0.0 108.95 179.842 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 64' ' ' TYR . . . . . . . . . . . . . 48.6 p90 -152.56 164.11 38.27 Favored 'General case' 0 N--CA 1.49 1.565 0 O-C-N 121.226 -0.921 . . . . 0.0 109.511 -179.615 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 79.7 mm-40 -138.81 154.34 48.46 Favored 'General case' 0 N--CA 1.497 1.895 0 N-CA-C 108.756 -0.831 . . . . 0.0 108.756 179.793 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 66' ' ' VAL . . . . . . . . . . . . . 2.7 p -125.75 129.07 72.61 Favored 'Isoleucine or valine' 0 N--CA 1.499 1.989 0 N-CA-C 109.088 -0.708 . . . . 0.0 109.088 -179.735 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -88.03 119.32 70.38 Favored Pre-proline 0 N--CA 1.494 1.76 0 O-C-N 121.378 -0.826 . . . . 0.0 109.014 -179.972 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 68' ' ' PRO . . . . . . . . . . . . . 84.8 Cg_exo -47.74 136.91 21.66 Favored 'Trans proline' 0 N--CA 1.499 1.847 0 C-N-CA 121.824 1.683 . . . . 0.0 112.916 179.687 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 69' ' ' VAL . . . . . . . . . . . . . 3.1 t -133.08 162.19 40.37 Favored 'Isoleucine or valine' 0 N--CA 1.503 2.182 0 O-C-N 121.601 -0.687 . . . . 0.0 109.935 -179.847 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -62.22 145.68 52.9 Favored 'General case' 0 N--CA 1.496 1.844 0 O-C-N 121.378 -0.826 . . . . 0.0 110.087 -179.734 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 90.3 m-20 -70.01 -29.96 67.15 Favored 'General case' 0 N--CA 1.491 1.591 0 O-C-N 121.429 -0.795 . . . . 0.0 109.68 179.502 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 72' ' ' ASN . . . . . . . . . . . . . 98.6 m-20 -94.21 6.07 49.79 Favored 'General case' 0 N--CA 1.491 1.614 0 O-C-N 121.596 -0.69 . . . . 0.0 109.188 -179.882 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -87.92 155.08 20.03 Favored 'General case' 0 N--CA 1.491 1.614 0 N-CA-C 108.644 -0.873 . . . . 0.0 108.644 179.583 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 74' ' ' THR . . . . . 0.64 ' O ' ' OG1' ' A' ' 74' ' ' THR . 0.0 OUTLIER -77.82 16.97 0.61 Allowed 'General case' 0 C--N 1.293 -1.881 0 CA-C-O 117.574 -1.203 . . . . 0.0 112.801 -179.808 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -158.81 165.85 33.29 Favored 'General case' 0 N--CA 1.523 3.179 0 C-N-CA 113.187 -3.405 . . . . 0.0 119.864 -175.045 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 7.5 tt -139.03 131.7 28.94 Favored 'General case' 0 C--N 1.297 -1.68 0 CA-C-N 109.348 -3.569 . . . . 0.0 104.952 -178.802 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 77' ' ' HIS . . . . . . . . . . . . . 82.9 t60 -133.76 135.09 43.69 Favored 'General case' 0 N--CA 1.506 2.332 0 O-C-N 120.476 -1.39 . . . . 0.0 107.411 179.54 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -141.19 167.65 21.67 Favored 'General case' 0 N--CA 1.496 1.845 0 O-C-N 121.223 -0.923 . . . . 0.0 109.558 -178.989 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 84.3 mtp180 -123.31 148.79 45.61 Favored 'General case' 0 N--CA 1.498 1.949 0 N-CA-C 108.625 -0.879 . . . . 0.0 108.625 179.827 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 80' ' ' PHE . . . . . . . . . . . . . 62.6 m-85 -130.06 150.27 51.4 Favored 'General case' 0 N--CA 1.5 2.042 0 N-CA-C 109.131 -0.692 . . . . 0.0 109.131 -179.565 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 35.6 ttpt -106.83 119.51 39.54 Favored 'General case' 0 N--CA 1.496 1.848 0 O-C-N 121.429 -0.794 . . . . 0.0 109.319 -179.975 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 82' ' ' PHE . . . . . . . . . . . . . 56.2 m-85 -128.65 153.23 47.5 Favored 'General case' 0 N--CA 1.501 2.078 0 O-C-N 121.606 -0.684 . . . . 0.0 109.299 -179.982 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 83' ' ' GLU . . . . . 0.431 ' O ' ' OD2' ' A' ' 30' ' ' ASP . 27.2 mm-40 -64.84 -41.96 95.3 Favored 'General case' 0 C--N 1.299 -1.594 0 O-C-N 121.51 -0.744 . . . . 0.0 109.854 -179.13 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 84' ' ' VAL . . . . . . . . . . . . . 2.9 m -136.34 160.78 37.91 Favored 'Isoleucine or valine' 0 N--CA 1.501 2.082 0 O-C-N 121.354 -0.841 . . . . 0.0 110.424 -179.145 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 85' ' ' SER . . . . . 0.522 ' O ' ' N ' ' A' ' 88' ' ' LYS . 11.6 t -63.75 -41.06 98.08 Favored 'General case' 0 N--CA 1.491 1.6 0 O-C-N 121.597 -0.689 . . . . 0.0 110.24 179.553 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 86' ' ' ALA . . . . . . . . . . . . . . . -40.75 -36.19 0.58 Allowed 'General case' 0 N--CA 1.5 2.04 0 O-C-N 121.621 -0.675 . . . . 0.0 110.02 -179.005 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 87' ' ' GLU . . . . . 0.478 ' OE1' ' CG1' ' A' ' 58' ' ' VAL . 70.3 mm-40 -65.71 -37.7 87.15 Favored 'General case' 0 C--N 1.301 -1.5 0 O-C-N 121.353 -0.842 . . . . 0.0 109.077 179.249 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 88' ' ' LYS . . . . . 0.522 ' N ' ' O ' ' A' ' 85' ' ' SER . 28.2 tptp -63.65 -46.38 85.92 Favored 'General case' 0 C--N 1.303 -1.428 0 O-C-N 121.26 -0.9 . . . . 0.0 109.398 179.875 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 89' ' ' LEU . . . . . 0.409 ' N ' ' CD1' ' A' ' 89' ' ' LEU . 10.8 mp -61.56 -46.95 87.72 Favored 'General case' 0 C--N 1.302 -1.48 0 O-C-N 121.319 -0.863 . . . . 0.0 109.465 -179.301 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 90' ' ' ILE . . . . . . . . . . . . . 96.8 mt -68.18 -44.2 84.37 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.522 0 O-C-N 121.212 -0.93 . . . . 0.0 109.668 179.81 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 91' ' ' PHE . . . . . . . . . . . . . 88.8 t80 -61.39 -46.48 90.01 Favored 'General case' 0 N--CA 1.491 1.599 0 O-C-N 121.395 -0.815 . . . . 0.0 109.54 -179.722 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 92' ' ' GLU . . . . . . . . . . . . . 84.0 tt0 -66.11 -40.02 90.4 Favored 'General case' 0 C--N 1.303 -1.441 0 O-C-N 121.272 -0.893 . . . . 0.0 109.151 179.98 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 93' ' ' LEU . . . . . . . . . . . . . 8.2 tp -62.93 -48.71 77.76 Favored 'General case' 0 N--CA 1.488 1.471 0 O-C-N 121.397 -0.814 . . . . 0.0 109.343 -179.701 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 94' ' ' LYS . . . . . 0.624 ' HZ2' ' CD1' ' A' ' 54' ' ' LEU . 17.3 ttpp -70.17 -45.36 66.87 Favored 'General case' 0 N--CA 1.491 1.609 0 O-C-N 121.475 -0.766 . . . . 0.0 109.827 179.74 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 95' ' ' THR . . . . . 0.461 ' CG2' ' CZ ' ' A' ' 51' ' ' TYR . 92.2 m -62.11 -44.26 97.04 Favored 'General case' 0 C--N 1.301 -1.523 0 O-C-N 121.558 -0.714 . . . . 0.0 109.419 -179.825 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 96' ' ' ARG . . . . . . . . . . . . . 71.1 ttp85 -57.99 -42.44 85.13 Favored 'General case' 0 N--CA 1.489 1.497 0 O-C-N 121.389 -0.819 . . . . 0.0 109.161 179.803 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 97' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.301 -1.507 0 O-C-N 121.379 -0.826 . . . . 0.0 108.86 179.733 . . . . . . . . 0 0 . 1 . 015 nuclear orig core ' A' A ' 30' ' ' ASP . . . . . 0.533 ' OD2' ' NZ ' ' A' ' 81' ' ' LYS . 25.9 p-10 . . . . . 0 N--CA 1.492 1.658 0 N-CA-C 109.373 -0.603 . . . . 0.0 109.373 . . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 53.1 t -116.7 135.28 57.54 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.845 0 CA-C-O 121.499 0.666 . . . . 0.0 109.647 -179.381 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -109.01 156.21 20.01 Favored 'General case' 0 N--CA 1.492 1.637 0 N-CA-C 109.191 -0.67 . . . . 0.0 109.191 179.92 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 99.4 mt-10 -107.1 128.15 54.13 Favored 'General case' 0 N--CA 1.496 1.825 0 O-C-N 121.551 -0.718 . . . . 0.0 110.113 -179.111 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 34' ' ' VAL . . . . . . . . . . . . . 53.2 t -123.45 135.17 64.17 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.693 0 O-C-N 121.618 -0.677 . . . . 0.0 109.343 -179.864 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 28.1 p -132.33 142.35 49.31 Favored 'General case' 0 N--CA 1.495 1.781 0 O-C-N 121.518 -0.739 . . . . 0.0 109.273 179.608 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 85.6 mt -125.43 148.9 48.63 Favored 'General case' 0 N--CA 1.496 1.854 0 O-C-N 121.651 -0.656 . . . . 0.0 109.283 179.854 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 37' ' ' PHE . . . . . . . . . . . . . 91.9 m-85 -127.07 144.94 50.9 Favored 'General case' 0 N--CA 1.493 1.686 0 O-C-N 121.757 -0.59 . . . . 0.0 109.588 -179.746 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . 164.86 -156.14 27.93 Favored Glycine 0 N--CA 1.485 1.913 0 N-CA-C 109.926 -1.27 . . . . 0.0 109.926 179.92 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 9.8 m -80.4 -141.53 0.04 OUTLIER 'General case' 0 N--CA 1.49 1.546 0 O-C-N 121.547 -0.972 . . . . 0.0 110.655 -179.325 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 40' ' ' ASP . . . . . 0.443 ' CG ' ' H ' ' A' ' 41' ' ' LYS . 44.9 t0 -54.31 179.0 0.02 OUTLIER 'General case' 0 N--CA 1.488 1.471 0 CA-C-O 121.773 0.797 . . . . 0.0 110.59 -179.008 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 41' ' ' LYS . . . . . 0.443 ' H ' ' CG ' ' A' ' 40' ' ' ASP . 26.9 ttmt -61.28 -39.84 91.91 Favored 'General case' 0 N--CA 1.49 1.566 0 O-C-N 121.702 -0.624 . . . . 0.0 110.378 -179.394 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -47.08 -49.78 21.09 Favored 'General case' 0 N--CA 1.494 1.76 0 O-C-N 121.248 -0.908 . . . . 0.0 110.289 -178.788 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 43' ' ' HIS . . . . . . . . . . . . . 6.0 t60 -61.64 -41.98 98.26 Favored 'General case' 0 N--CA 1.49 1.573 0 O-C-N 121.346 -0.846 . . . . 0.0 109.564 -179.353 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 54.8 mt -63.96 -39.03 93.21 Favored 'General case' 0 N--CA 1.49 1.554 0 O-C-N 121.415 -0.803 . . . . 0.0 109.623 -179.861 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 96.6 mt-10 -58.22 -41.23 83.6 Favored 'General case' 0 N--CA 1.489 1.488 0 O-C-N 121.319 -0.863 . . . . 0.0 109.428 -179.743 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . -62.43 -43.41 99.08 Favored Glycine 0 N--CA 1.489 2.189 0 N-CA-C 109.244 -1.542 . . . . 0.0 109.244 179.972 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 68.6 mttm -65.28 -39.82 93.09 Favored 'General case' 0 N--CA 1.489 1.506 0 O-C-N 121.364 -1.08 . . . . 0.0 109.285 179.466 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 53.5 tp -62.02 -40.37 95.47 Favored 'General case' 0 N--CA 1.489 1.519 0 O-C-N 121.477 -0.764 . . . . 0.0 109.604 -179.545 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 49' ' ' ALA . . . . . . . . . . . . . . . -57.25 -40.84 78.45 Favored 'General case' 0 N--CA 1.49 1.535 0 O-C-N 121.346 -0.846 . . . . 0.0 109.505 -179.156 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 75.4 mt-10 -68.64 -37.41 79.68 Favored 'General case' 0 N--CA 1.489 1.505 0 O-C-N 121.515 -0.741 . . . . 0.0 109.443 179.828 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 3.7 m-85 -61.78 -43.69 98.35 Favored 'General case' 0 N--CA 1.491 1.587 0 O-C-N 121.656 -0.652 . . . . 0.0 109.533 -179.34 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 52' ' ' ILE . . . . . . . . . . . . . 93.3 mt -63.71 -42.96 97.77 Favored 'Isoleucine or valine' 0 C--N 1.302 -1.46 0 N-CA-C 108.892 -0.781 . . . . 0.0 108.892 -179.904 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 25.2 m -49.75 -55.31 14.47 Favored 'General case' 0 N--CA 1.49 1.552 0 O-C-N 121.368 -0.832 . . . . 0.0 109.747 -179.529 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 54' ' ' LEU . . . . . 0.466 ' N ' ' CD2' ' A' ' 54' ' ' LEU . 4.0 mm? -65.17 -38.48 90.67 Favored 'General case' 0 N--CA 1.489 1.512 0 O-C-N 121.438 -0.789 . . . . 0.0 109.101 179.725 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -55.78 -46.82 77.88 Favored 'General case' 0 N--CA 1.488 1.429 0 O-C-N 121.487 -0.758 . . . . 0.0 109.391 -179.517 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 56' ' ' LYS . . . . . . . . . . . . . 66.0 mttm -63.65 -41.3 98.23 Favored 'General case' 0 C--N 1.303 -1.455 0 O-C-N 121.575 -0.703 . . . . 0.0 109.816 179.922 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 98.8 mm-40 -63.12 -47.21 83.75 Favored 'General case' 0 N--CA 1.487 1.417 0 O-C-N 121.448 -0.783 . . . . 0.0 109.607 -179.618 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 58' ' ' VAL . . . . . . . . . . . . . 75.1 t -66.13 -45.16 91.04 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.452 0 O-C-N 121.363 -0.836 . . . . 0.0 109.801 -179.916 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 59' ' ' TYR . . . . . . . . . . . . . 83.4 t80 -140.64 119.83 12.9 Favored 'General case' 0 N--CA 1.496 1.85 0 O-C-N 121.381 -0.825 . . . . 0.0 109.924 -179.528 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -71.66 154.66 41.23 Favored 'General case' 0 N--CA 1.491 1.608 0 O-C-N 121.629 -0.669 . . . . 0.0 110.939 -179.679 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 61' ' ' ASN . . . . . . . . . . . . . 10.4 m120 60.23 35.96 20.89 Favored 'General case' 0 N--CA 1.493 1.68 0 CA-C-O 121.465 0.65 . . . . 0.0 109.286 179.828 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 62' ' ' VAL . . . . . . . . . . . . . 12.4 p -71.89 137.88 22.73 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.491 0 O-C-N 121.548 -0.72 . . . . 0.0 109.912 -179.995 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 84.5 tt0 -113.01 146.04 39.8 Favored 'General case' 0 N--CA 1.492 1.675 0 CA-C-O 121.488 0.661 . . . . 0.0 109.397 -179.768 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 64' ' ' TYR . . . . . . . . . . . . . 53.3 p90 -150.89 162.94 39.82 Favored 'General case' 0 N--CA 1.487 1.413 0 O-C-N 121.295 -0.878 . . . . 0.0 110.047 179.964 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 65' ' ' GLU . . . . . 0.485 ' CD ' ' N ' ' A' ' 66' ' ' VAL . 9.6 tm-20 -142.6 148.8 38.08 Favored 'General case' 0 N--CA 1.489 1.523 0 N-CA-C 108.949 -0.76 . . . . 0.0 108.949 179.5 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 66' ' ' VAL . . . . . 0.485 ' N ' ' CD ' ' A' ' 65' ' ' GLU . 54.5 t -116.41 131.0 70.27 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.55 0 CA-C-O 121.741 0.782 . . . . 0.0 109.846 -179.652 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -84.76 156.65 61.33 Favored Pre-proline 0 C--N 1.306 -1.294 0 N-CA-C 108.811 -0.811 . . . . 0.0 108.811 179.526 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 68' ' ' PRO . . . . . . . . . . . . . 96.6 Cg_exo -43.03 138.72 3.94 Favored 'Trans proline' 0 N--CA 1.493 1.484 0 C-N-CA 122.588 2.192 . . . . 0.0 112.801 179.626 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 69' ' ' VAL . . . . . 0.519 ' C ' ' H ' ' A' ' 71' ' ' ASP . 67.2 t -124.42 134.06 67.71 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.735 0 CA-C-O 121.569 0.699 . . . . 0.0 109.828 -179.448 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 70' ' ' ALA . . . . . 0.655 ' O ' ' N ' ' A' ' 72' ' ' ASN . . . -73.2 35.89 0.08 Allowed 'General case' 0 N--CA 1.487 1.408 0 O-C-N 121.606 -0.684 . . . . 0.0 109.556 179.828 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 71' ' ' ASP . . . . . 0.519 ' H ' ' C ' ' A' ' 69' ' ' VAL . 97.9 m-20 53.39 -73.45 0.01 OUTLIER 'General case' 0 N--CA 1.496 1.827 0 CA-C-O 121.59 0.709 . . . . 0.0 110.059 179.76 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 72' ' ' ASN . . . . . 0.655 ' N ' ' O ' ' A' ' 70' ' ' ALA . 51.7 t30 -86.96 18.41 3.56 Favored 'General case' 0 C--N 1.299 -1.618 0 N-CA-C 108.136 -1.061 . . . . 0.0 108.136 179.492 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 73' ' ' ALA . . . . . 0.536 ' C ' ' H ' ' A' ' 75' ' ' GLU . . . -52.78 -6.96 0.06 Allowed 'General case' 0 N--CA 1.492 1.673 0 N-CA-C 109.274 -0.639 . . . . 0.0 109.274 -179.986 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 74' ' ' THR . . . . . 0.557 ' H ' ' C ' ' A' ' 72' ' ' ASN . 6.1 p 61.96 -4.65 0.18 Allowed 'General case' 0 N--CA 1.492 1.674 0 O-C-N 121.625 -0.672 . . . . 0.0 109.624 -179.866 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 75' ' ' GLU . . . . . 0.536 ' H ' ' C ' ' A' ' 73' ' ' ALA . 22.4 pt-20 -149.08 150.44 32.76 Favored 'General case' 0 N--CA 1.49 1.534 0 O-C-N 121.161 -0.962 . . . . 0.0 109.41 179.404 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 6.2 tt -122.72 129.44 51.78 Favored 'General case' 0 N--CA 1.493 1.704 0 CA-C-O 121.566 0.698 . . . . 0.0 109.49 179.647 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 77' ' ' HIS . . . . . . . . . . . . . 97.7 m-70 -97.87 130.7 44.75 Favored 'General case' 0 N--CA 1.488 1.462 0 O-C-N 121.562 -0.711 . . . . 0.0 109.651 -179.658 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -146.64 153.88 40.82 Favored 'General case' 0 N--CA 1.489 1.498 0 O-C-N 121.37 -0.831 . . . . 0.0 109.582 179.939 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 99.6 mtt180 -129.78 148.02 51.61 Favored 'General case' 0 N--CA 1.491 1.582 0 N-CA-C 109.249 -0.648 . . . . 0.0 109.249 -179.949 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 80' ' ' PHE . . . . . . . . . . . . . 30.1 m-85 -126.12 149.92 48.6 Favored 'General case' 0 N--CA 1.493 1.722 0 O-C-N 121.629 -0.669 . . . . 0.0 109.419 -179.777 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 81' ' ' LYS . . . . . 0.533 ' NZ ' ' OD2' ' A' ' 30' ' ' ASP . 63.9 tttp -105.93 124.04 48.94 Favored 'General case' 0 N--CA 1.491 1.58 0 O-C-N 121.548 -0.72 . . . . 0.0 109.323 -179.969 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 82' ' ' PHE . . . . . 0.405 ' CD1' ' OE2' ' A' ' 87' ' ' GLU . 62.2 m-85 -124.95 144.52 50.31 Favored 'General case' 0 N--CA 1.493 1.675 0 CA-C-O 121.594 0.711 . . . . 0.0 109.56 -179.876 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 83.9 tt0 -67.03 -29.22 68.98 Favored 'General case' 0 N--CA 1.488 1.429 0 O-C-N 121.61 -0.681 . . . . 0.0 109.8 -179.627 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 84' ' ' VAL . . . . . . . . . . . . . 35.0 m -131.51 150.37 34.08 Favored 'Isoleucine or valine' 0 N--CA 1.499 2.015 0 CA-C-O 121.832 0.825 . . . . 0.0 110.37 -179.483 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 36.9 m -72.6 -32.29 65.85 Favored 'General case' 0 N--CA 1.49 1.528 0 CA-C-O 121.451 0.643 . . . . 0.0 109.586 179.939 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 86' ' ' ALA . . . . . . . . . . . . . . . -54.36 -34.98 62.27 Favored 'General case' 0 N--CA 1.489 1.514 0 O-C-N 121.299 -0.875 . . . . 0.0 108.79 -179.669 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 87' ' ' GLU . . . . . 0.405 ' OE2' ' CD1' ' A' ' 82' ' ' PHE . 80.4 tt0 -65.33 -32.17 73.69 Favored 'General case' 0 C--N 1.303 -1.437 0 N-CA-C 109.096 -0.705 . . . . 0.0 109.096 179.765 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 88' ' ' LYS . . . . . . . . . . . . . 88.8 tttt -63.2 -44.33 95.67 Favored 'General case' 0 N--CA 1.49 1.551 0 O-C-N 121.373 -0.829 . . . . 0.0 109.39 179.975 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 93.9 mt -62.05 -49.27 76.67 Favored 'General case' 0 N--CA 1.491 1.607 0 O-C-N 121.39 -0.818 . . . . 0.0 110.145 -179.217 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 90' ' ' ILE . . . . . 0.501 ' CD1' ' N ' ' A' ' 90' ' ' ILE . 1.4 mp -70.32 -42.11 78.65 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.582 0 O-C-N 121.366 -0.834 . . . . 0.0 109.403 -179.971 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 91' ' ' PHE . . . . . . . . . . . . . 70.3 t80 -57.45 -45.85 84.27 Favored 'General case' 0 C--N 1.303 -1.445 0 O-C-N 121.406 -0.809 . . . . 0.0 108.886 -179.137 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 92' ' ' GLU . . . . . . . . . . . . . 98.1 mt-10 -68.23 -33.58 74.66 Favored 'General case' 0 C--N 1.301 -1.506 0 N-CA-C 109.116 -0.698 . . . . 0.0 109.116 179.263 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 93' ' ' LEU . . . . . . . . . . . . . 59.0 tp -62.82 -43.19 99.46 Favored 'General case' 0 N--CA 1.488 1.459 0 O-C-N 121.496 -0.753 . . . . 0.0 109.401 -179.736 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 94' ' ' LYS . . . . . . . . . . . . . 67.2 mmtt -65.25 -42.5 93.27 Favored 'General case' 0 N--CA 1.487 1.407 0 O-C-N 121.468 -0.77 . . . . 0.0 109.735 -179.581 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 18.0 p -66.11 -43.06 88.28 Favored 'General case' 0 N--CA 1.488 1.454 0 O-C-N 121.253 -0.904 . . . . 0.0 109.497 -179.732 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 96' ' ' ARG . . . . . . . . . . . . . 17.3 tpp180 -62.61 -44.76 95.49 Favored 'General case' 0 N--CA 1.487 1.388 0 O-C-N 121.305 -0.872 . . . . 0.0 109.396 -179.81 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 97' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.488 1.434 0 N-CA-C 108.778 -0.823 . . . . 0.0 108.778 -179.835 . . . . . . . . 0 0 . 1 . 016 nuclear orig core ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 90.7 m-20 . . . . . 0 N--CA 1.487 1.4 0 N-CA-C 109.651 -0.5 . . . . 0.0 109.651 . . . . . . . . . 0 0 . 1 . 016 nuclear orig core ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 51.1 t -119.92 133.85 65.33 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.958 0 O-C-N 121.616 -0.678 . . . . 0.0 109.29 -179.828 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -126.65 149.45 49.51 Favored 'General case' 0 N--CA 1.494 1.766 0 CA-C-O 121.505 0.669 . . . . 0.0 109.603 -179.646 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 17.3 pt-20 -91.54 140.14 30.03 Favored 'General case' 0 N--CA 1.49 1.548 0 O-C-N 121.565 -0.709 . . . . 0.0 109.929 -179.577 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 34' ' ' VAL . . . . . . . . . . . . . 48.4 t -130.16 135.42 60.91 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.793 0 N-CA-C 108.566 -0.901 . . . . 0.0 108.566 179.293 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 44.8 t -134.96 142.71 46.55 Favored 'General case' 0 N--CA 1.493 1.709 0 N-CA-C 109.196 -0.668 . . . . 0.0 109.196 179.877 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 76.7 mt -119.72 156.75 29.93 Favored 'General case' 0 N--CA 1.498 1.963 0 N-CA-C 109.256 -0.646 . . . . 0.0 109.256 -179.743 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 37' ' ' PHE . . . . . . . . . . . . . 92.4 m-85 -119.48 138.82 52.9 Favored 'General case' 0 N--CA 1.494 1.772 0 N-CA-C 109.445 -0.576 . . . . 0.0 109.445 -179.582 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . -178.14 -175.62 45.43 Favored Glycine 0 N--CA 1.486 2.028 0 N-CA-C 109.781 -1.328 . . . . 0.0 109.781 -179.908 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 39' ' ' SER . . . . . 0.495 ' OG ' ' N ' ' A' ' 40' ' ' ASP . 93.7 p -98.93 -77.39 0.52 Allowed 'General case' 0 N--CA 1.494 1.739 0 O-C-N 121.643 -0.916 . . . . 0.0 109.637 179.89 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 40' ' ' ASP . . . . . 0.543 ' OD1' ' N ' ' A' ' 41' ' ' LYS . 58.3 t0 -80.59 156.44 26.43 Favored 'General case' 0 N--CA 1.49 1.558 0 O-C-N 121.322 -0.861 . . . . 0.0 110.015 -179.169 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 41' ' ' LYS . . . . . 0.543 ' N ' ' OD1' ' A' ' 40' ' ' ASP . 4.5 tmtt? -62.26 -42.13 99.06 Favored 'General case' 0 N--CA 1.488 1.44 0 O-C-N 121.316 -0.865 . . . . 0.0 109.757 -179.306 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -55.7 -41.19 73.42 Favored 'General case' 0 N--CA 1.492 1.628 0 O-C-N 120.984 -1.072 . . . . 0.0 110.291 -179.038 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 43' ' ' HIS . . . . . . . . . . . . . 82.0 t60 -61.24 -42.39 98.53 Favored 'General case' 0 C--N 1.301 -1.536 0 O-C-N 121.135 -0.978 . . . . 0.0 109.537 -179.78 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 84.0 mt -63.4 -40.06 96.19 Favored 'General case' 0 N--CA 1.49 1.534 0 O-C-N 121.346 -0.846 . . . . 0.0 109.838 -179.775 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 96.5 mt-10 -60.83 -37.22 81.29 Favored 'General case' 0 C--N 1.301 -1.516 0 O-C-N 121.197 -0.94 . . . . 0.0 109.139 179.874 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . -62.16 -42.87 99.73 Favored Glycine 0 N--CA 1.489 2.202 0 N-CA-C 109.341 -1.504 . . . . 0.0 109.341 179.855 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 54.9 mtpt -65.48 -36.61 84.39 Favored 'General case' 0 N--CA 1.488 1.454 0 O-C-N 121.312 -1.111 . . . . 0.0 109.577 179.421 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 57.5 tp -60.89 -40.41 92.94 Favored 'General case' 0 N--CA 1.489 1.485 0 O-C-N 121.497 -0.752 . . . . 0.0 109.593 -179.109 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 49' ' ' ALA . . . . . . . . . . . . . . . -56.11 -42.41 76.8 Favored 'General case' 0 C--N 1.302 -1.491 0 O-C-N 121.178 -0.951 . . . . 0.0 109.433 -179.352 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 97.3 mt-10 -66.48 -39.13 88.59 Favored 'General case' 0 C--N 1.302 -1.488 0 O-C-N 121.467 -0.771 . . . . 0.0 109.512 179.834 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 51' ' ' TYR . . . . . 0.506 ' CE2' ' CG2' ' A' ' 95' ' ' THR . 4.3 m-85 -62.2 -40.77 97.19 Favored 'General case' 0 N--CA 1.491 1.598 0 O-C-N 121.519 -0.738 . . . . 0.0 109.638 -179.527 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 52' ' ' ILE . . . . . . . . . . . . . 96.8 mt -63.27 -42.61 97.04 Favored 'Isoleucine or valine' 0 C--N 1.298 -1.641 0 O-C-N 121.364 -0.835 . . . . 0.0 109.402 -179.671 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 66.6 m -57.82 -49.99 74.77 Favored 'General case' 0 N--CA 1.491 1.586 0 O-C-N 121.18 -0.95 . . . . 0.0 110.642 -179.022 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 54' ' ' LEU . . . . . 0.424 ' N ' ' CD2' ' A' ' 54' ' ' LEU . 4.2 mm? -66.05 -41.16 91.2 Favored 'General case' 0 N--CA 1.493 1.683 0 O-C-N 121.05 -1.031 . . . . 0.0 109.495 179.732 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -64.25 -39.14 93.34 Favored 'General case' 0 C--N 1.301 -1.516 0 O-C-N 121.46 -0.775 . . . . 0.0 109.476 -179.512 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 56' ' ' LYS . . . . . . . . . . . . . 88.8 tttt -64.05 -43.98 93.87 Favored 'General case' 0 C--N 1.304 -1.4 0 O-C-N 121.418 -0.801 . . . . 0.0 110.076 -179.478 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 15.5 mm100 -66.54 -41.64 88.41 Favored 'General case' 0 N--CA 1.489 1.497 0 O-C-N 121.236 -0.915 . . . . 0.0 109.635 -179.624 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 58' ' ' VAL . . . . . 0.469 ' CG1' ' OE1' ' A' ' 87' ' ' GLU . 74.7 t -64.92 -45.3 95.21 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.507 0 O-C-N 121.424 -0.797 . . . . 0.0 110.626 -179.27 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 59' ' ' TYR . . . . . . . . . . . . . 83.5 t80 -127.86 129.93 47.74 Favored 'General case' 0 N--CA 1.499 2.0 0 O-C-N 121.499 -0.751 . . . . 0.0 110.111 -178.898 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 60' ' ' ALA . . . . . 0.441 ' O ' ' CG ' ' A' ' 61' ' ' ASN . . . -68.51 154.99 40.81 Favored 'General case' 0 N--CA 1.489 1.478 0 O-C-N 121.59 -0.693 . . . . 0.0 110.234 -179.787 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 61' ' ' ASN . . . . . 0.441 ' CG ' ' O ' ' A' ' 60' ' ' ALA . 12.9 p30 45.4 58.31 4.27 Favored 'General case' 0 N--CA 1.493 1.724 0 CA-C-O 121.749 0.785 . . . . 0.0 109.347 -179.744 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 62' ' ' VAL . . . . . . . . . . . . . 14.7 p -74.09 136.5 25.15 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.458 0 CA-C-O 121.48 0.657 . . . . 0.0 110.211 -179.508 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 96.9 mt-10 -124.44 140.05 53.31 Favored 'General case' 0 N--CA 1.492 1.661 0 N-CA-C 109.248 -0.649 . . . . 0.0 109.248 179.826 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 64' ' ' TYR . . . . . . . . . . . . . 50.7 p90 -149.93 161.79 41.62 Favored 'General case' 0 C--N 1.303 -1.444 0 O-C-N 121.447 -0.783 . . . . 0.0 109.132 -179.854 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 49.4 tp10 -142.57 147.03 35.22 Favored 'General case' 0 N--CA 1.491 1.599 0 N-CA-C 108.66 -0.867 . . . . 0.0 108.66 179.694 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 66' ' ' VAL . . . . . . . . . . . . . 75.5 t -117.45 128.39 74.72 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.699 0 O-C-N 121.763 -0.586 . . . . 0.0 109.563 -179.85 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -81.84 168.29 25.14 Favored Pre-proline 0 N--CA 1.489 1.487 0 O-C-N 121.533 -0.729 . . . . 0.0 109.158 -179.878 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 68' ' ' PRO . . . . . . . . . . . . . 51.1 Cg_exo -53.36 131.7 44.7 Favored 'Trans proline' 0 N--CA 1.497 1.717 0 C-N-CA 122.198 1.932 . . . . 0.0 112.537 179.588 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 69' ' ' VAL . . . . . . . . . . . . . 54.4 t -133.75 136.68 53.8 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.872 0 O-C-N 121.613 -0.679 . . . . 0.0 109.632 179.58 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -67.83 150.64 48.34 Favored 'General case' 0 N--CA 1.49 1.534 0 O-C-N 121.54 -0.725 . . . . 0.0 110.489 -179.694 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 96.8 m-20 -63.08 -37.16 86.1 Favored 'General case' 0 N--CA 1.492 1.669 0 O-C-N 121.426 -0.796 . . . . 0.0 109.979 179.904 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 72' ' ' ASN . . . . . . . . . . . . . 20.2 t-20 -86.64 9.33 18.97 Favored 'General case' 0 N--CA 1.493 1.677 0 O-C-N 121.296 -0.877 . . . . 0.0 108.891 -179.916 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -63.24 142.92 58.2 Favored 'General case' 0 N--CA 1.489 1.505 0 O-C-N 121.412 -0.805 . . . . 0.0 110.157 -179.465 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 74' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -105.84 5.54 30.83 Favored 'General case' 0 N--CA 1.493 1.686 0 N-CA-C 108.405 -0.961 . . . . 0.0 108.405 179.245 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 96.8 mt-10 -141.96 160.49 40.1 Favored 'General case' 0 N--CA 1.496 1.835 0 O-C-N 121.402 -0.811 . . . . 0.0 109.141 179.372 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 6.6 tp -129.1 134.09 47.93 Favored 'General case' 0 N--CA 1.496 1.868 0 O-C-N 121.669 -0.645 . . . . 0.0 109.349 179.912 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 77' ' ' HIS . . . . . . . . . . . . . 77.7 m80 -104.94 124.07 48.85 Favored 'General case' 0 N--CA 1.494 1.726 0 CA-C-O 121.425 0.631 . . . . 0.0 109.587 179.688 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -150.66 162.17 41.2 Favored 'General case' 0 N--CA 1.488 1.469 0 O-C-N 121.492 -0.755 . . . . 0.0 109.019 -179.995 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 84.4 mtt85 -128.89 149.54 50.73 Favored 'General case' 0 N--CA 1.493 1.711 0 N-CA-C 109.114 -0.698 . . . . 0.0 109.114 179.872 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 80' ' ' PHE . . . . . . . . . . . . . 34.4 m-85 -128.14 152.1 48.43 Favored 'General case' 0 N--CA 1.494 1.734 0 O-C-N 121.665 -0.647 . . . . 0.0 109.452 -179.821 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 65.7 tttm -107.81 140.21 41.24 Favored 'General case' 0 N--CA 1.492 1.653 0 CA-C-O 121.324 0.583 . . . . 0.0 109.924 -179.373 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 82' ' ' PHE . . . . . . . . . . . . . 82.7 m-85 -141.67 -164.6 1.81 Allowed 'General case' 0 N--CA 1.492 1.67 0 O-C-N 121.52 -0.738 . . . . 0.0 109.404 179.896 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 83.0 tt0 -100.46 -50.56 3.87 Favored 'General case' 0 N--CA 1.492 1.632 0 O-C-N 121.607 -0.683 . . . . 0.0 109.285 179.806 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 84' ' ' VAL . . . . . . . . . . . . . 2.5 m -134.72 164.88 32.82 Favored 'Isoleucine or valine' 0 N--CA 1.499 2.001 0 O-C-N 121.451 -0.781 . . . . 0.0 110.311 -179.534 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 38.1 t -61.87 -19.05 62.21 Favored 'General case' 0 N--CA 1.489 1.523 0 O-C-N 121.755 -0.591 . . . . 0.0 109.61 -179.908 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 86' ' ' ALA . . . . . . . . . . . . . . . -61.45 -37.21 82.73 Favored 'General case' 0 N--CA 1.489 1.487 0 O-C-N 121.241 -0.912 . . . . 0.0 109.618 -179.899 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 87' ' ' GLU . . . . . 0.469 ' OE1' ' CG1' ' A' ' 58' ' ' VAL . 79.6 mm-40 -66.61 -34.99 79.11 Favored 'General case' 0 N--CA 1.49 1.556 0 O-C-N 121.315 -0.865 . . . . 0.0 109.386 -179.916 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 88' ' ' LYS . . . . . . . . . . . . . 88.7 tttt -62.85 -46.48 87.71 Favored 'General case' 0 N--CA 1.49 1.552 0 O-C-N 121.328 -0.858 . . . . 0.0 109.628 -179.791 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 87.1 mt -63.26 -44.38 95.3 Favored 'General case' 0 N--CA 1.488 1.468 0 O-C-N 121.346 -0.846 . . . . 0.0 109.409 -179.669 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 90' ' ' ILE . . . . . . . . . . . . . 97.0 mt -66.55 -45.15 89.47 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.461 0 O-C-N 121.34 -0.85 . . . . 0.0 109.791 -179.954 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 91' ' ' PHE . . . . . . . . . . . . . 86.2 t80 -64.4 -43.41 94.53 Favored 'General case' 0 N--CA 1.489 1.484 0 O-C-N 121.477 -0.764 . . . . 0.0 109.78 -179.919 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 92' ' ' GLU . . . . . . . . . . . . . 47.6 tp10 -59.21 -39.24 82.04 Favored 'General case' 0 N--CA 1.488 1.46 0 O-C-N 121.409 -0.807 . . . . 0.0 108.887 -179.36 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 93' ' ' LEU . . . . . . . . . . . . . 5.5 tt -62.96 -43.56 98.47 Favored 'General case' 0 C--N 1.301 -1.529 0 O-C-N 121.434 -0.792 . . . . 0.0 109.633 179.928 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 94' ' ' LYS . . . . . . . . . . . . . 99.2 mttt -64.68 -40.83 96.07 Favored 'General case' 0 N--CA 1.489 1.482 0 O-C-N 121.529 -0.732 . . . . 0.0 109.428 -179.795 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 95' ' ' THR . . . . . 0.506 ' CG2' ' CE2' ' A' ' 51' ' ' TYR . 21.1 p -64.84 -42.97 94.49 Favored 'General case' 0 N--CA 1.49 1.534 0 O-C-N 121.317 -0.864 . . . . 0.0 109.304 -179.914 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 96' ' ' ARG . . . . . . . . . . . . . 89.4 mtm180 -63.81 -38.69 92.03 Favored 'General case' 0 N--CA 1.488 1.441 0 O-C-N 121.467 -0.771 . . . . 0.0 109.136 179.483 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 97' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.488 1.473 0 O-C-N 121.369 -0.832 . . . . 0.0 109.686 -179.931 . . . . . . . . 0 0 . 1 . 017 nuclear orig core ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 31.6 p30 . . . . . 0 N--CA 1.49 1.537 0 N-CA-C 108.774 -0.824 . . . . 0.0 108.774 . . . . . . . . . 0 0 . 1 . 017 nuclear orig core ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 53.5 t -126.02 133.7 68.31 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.864 0 N-CA-C 109.27 -0.641 . . . . 0.0 109.27 179.802 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -138.33 151.19 47.32 Favored 'General case' 0 N--CA 1.492 1.665 0 O-C-N 121.469 -0.769 . . . . 0.0 109.573 179.897 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 15.4 pt-20 -94.21 145.91 24.38 Favored 'General case' 0 N--CA 1.492 1.671 0 O-C-N 121.528 -0.733 . . . . 0.0 109.961 -179.552 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 34' ' ' VAL . . . . . . . . . . . . . 92.7 t -119.36 127.57 75.85 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.789 0 N-CA-C 108.64 -0.874 . . . . 0.0 108.64 179.893 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 26.1 t -117.36 128.0 54.61 Favored 'General case' 0 N--CA 1.494 1.736 0 N-CA-C 109.103 -0.703 . . . . 0.0 109.103 -179.829 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 55.1 tp -124.98 142.66 51.34 Favored 'General case' 0 N--CA 1.497 1.922 0 CA-C-O 121.381 0.61 . . . . 0.0 109.614 -179.996 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 37' ' ' PHE . . . . . . . . . . . . . 92.8 m-85 -104.69 147.01 28.14 Favored 'General case' 0 N--CA 1.493 1.723 0 O-C-N 121.685 -0.634 . . . . 0.0 109.818 179.992 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . -172.9 179.31 44.43 Favored Glycine 0 N--CA 1.488 2.128 0 N-CA-C 109.759 -1.336 . . . . 0.0 109.759 179.748 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 19.0 t -78.52 -99.27 0.02 OUTLIER 'General case' 0 N--CA 1.49 1.562 0 O-C-N 121.476 -1.014 . . . . 0.0 110.05 -179.809 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 40' ' ' ASP . . . . . . . . . . . . . 55.7 p-10 -85.59 175.44 8.78 Favored 'General case' 0 N--CA 1.49 1.573 0 O-C-N 121.424 -0.798 . . . . 0.0 110.453 -179.114 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 88.8 tttt -63.32 -41.96 98.95 Favored 'General case' 0 N--CA 1.491 1.581 0 O-C-N 121.528 -0.733 . . . . 0.0 109.196 179.905 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -53.5 -43.13 68.0 Favored 'General case' 0 N--CA 1.49 1.543 0 O-C-N 121.602 -0.686 . . . . 0.0 109.542 -179.65 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 43' ' ' HIS . . . . . . . . . . . . . 28.8 t-80 -63.21 -44.0 96.57 Favored 'General case' 0 N--CA 1.489 1.509 0 O-C-N 121.468 -0.77 . . . . 0.0 109.306 -179.851 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 84.5 mt -63.6 -39.87 95.48 Favored 'General case' 0 N--CA 1.491 1.575 0 O-C-N 121.52 -0.737 . . . . 0.0 109.306 179.982 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 97.1 mt-10 -59.65 -37.87 79.9 Favored 'General case' 0 N--CA 1.488 1.45 0 O-C-N 121.346 -0.846 . . . . 0.0 109.689 -179.782 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . -64.22 -52.01 47.82 Favored Glycine 0 N--CA 1.492 2.41 0 N-CA-C 109.588 -1.405 . . . . 0.0 109.588 -179.445 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 97.3 mttt -67.04 -32.61 73.92 Favored 'General case' 0 N--CA 1.49 1.54 0 O-C-N 121.395 -1.062 . . . . 0.0 109.376 179.299 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 52.6 tp -58.07 -40.74 81.8 Favored 'General case' 0 C--N 1.301 -1.53 0 O-C-N 121.569 -0.707 . . . . 0.0 109.286 -179.341 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 49' ' ' ALA . . . . . . . . . . . . . . . -59.74 -39.43 84.71 Favored 'General case' 0 N--CA 1.488 1.468 0 O-C-N 121.395 -0.816 . . . . 0.0 109.442 -179.597 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 97.8 mt-10 -70.17 -39.21 75.41 Favored 'General case' 0 N--CA 1.49 1.565 0 O-C-N 121.452 -0.78 . . . . 0.0 109.616 179.797 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 4.4 m-85 -61.71 -48.61 79.99 Favored 'General case' 0 N--CA 1.492 1.627 0 O-C-N 121.361 -0.837 . . . . 0.0 109.547 -179.514 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 52' ' ' ILE . . . . . . . . . . . . . 95.4 mt -65.61 -44.45 93.71 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.444 0 O-C-N 121.346 -0.846 . . . . 0.0 109.359 -179.664 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 66.2 m -63.03 -42.07 99.69 Favored 'General case' 0 N--CA 1.488 1.465 0 O-C-N 121.557 -0.715 . . . . 0.0 109.637 -179.705 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 54' ' ' LEU . . . . . . . . . . . . . 56.0 tp -63.59 -42.25 98.28 Favored 'General case' 0 N--CA 1.489 1.48 0 O-C-N 121.497 -0.752 . . . . 0.0 109.329 -179.705 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -62.48 -41.4 98.76 Favored 'General case' 0 N--CA 1.489 1.505 0 O-C-N 121.523 -0.736 . . . . 0.0 109.477 -179.04 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 56' ' ' LYS . . . . . 0.479 ' O ' ' N ' ' A' ' 60' ' ' ALA . 97.8 mttt -64.93 -42.5 94.61 Favored 'General case' 0 C--N 1.302 -1.48 0 O-C-N 121.496 -0.752 . . . . 0.0 110.084 -179.797 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 58.4 tt0 -64.65 -42.03 95.71 Favored 'General case' 0 N--CA 1.49 1.534 0 O-C-N 121.118 -0.989 . . . . 0.0 109.314 -179.597 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 58' ' ' VAL . . . . . . . . . . . . . 71.6 t -68.46 -45.71 81.62 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.517 0 O-C-N 121.443 -0.785 . . . . 0.0 110.124 -179.834 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 59' ' ' TYR . . . . . 0.506 ' O ' ' CB ' ' A' ' 60' ' ' ALA . 53.8 t80 -110.39 -57.18 2.25 Favored 'General case' 0 N--CA 1.496 1.866 0 O-C-N 121.56 -0.713 . . . . 0.0 109.913 -178.818 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 60' ' ' ALA . . . . . 0.506 ' CB ' ' O ' ' A' ' 59' ' ' TYR . . . 82.98 145.22 0.07 Allowed 'General case' 0 N--CA 1.499 2.013 0 CA-C-O 121.27 0.557 . . . . 0.0 109.707 -179.757 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 61' ' ' ASN . . . . . . . . . . . . . 5.4 m120 59.49 33.46 22.22 Favored 'General case' 0 N--CA 1.491 1.61 0 N-CA-C 108.534 -0.913 . . . . 0.0 108.534 -179.253 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 62' ' ' VAL . . . . . . . . . . . . . 9.9 p -90.97 152.82 3.29 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.655 0 O-C-N 121.577 -0.702 . . . . 0.0 110.343 -179.524 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 96.9 mt-10 -113.43 132.5 55.61 Favored 'General case' 0 N--CA 1.494 1.727 0 N-CA-C 108.892 -0.781 . . . . 0.0 108.892 179.556 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 64' ' ' TYR . . . . . . . . . . . . . 52.4 p90 -142.83 162.22 36.04 Favored 'General case' 0 N--CA 1.489 1.516 0 O-C-N 121.432 -0.792 . . . . 0.0 109.428 -179.58 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 79.6 mm-40 -138.53 157.72 45.63 Favored 'General case' 0 N--CA 1.49 1.526 0 O-C-N 121.53 -0.731 . . . . 0.0 109.041 -179.946 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 66' ' ' VAL . . . . . . . . . . . . . 3.3 p -125.5 132.47 70.92 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.696 0 CA-C-O 121.648 0.737 . . . . 0.0 109.478 -179.6 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -86.27 170.5 12.48 Favored Pre-proline 0 N--CA 1.489 1.501 0 O-C-N 121.527 -0.733 . . . . 0.0 109.381 -179.719 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 68' ' ' PRO . . . . . . . . . . . . . 37.1 Cg_exo -54.73 132.38 51.35 Favored 'Trans proline' 0 N--CA 1.494 1.534 0 C-N-CA 122.171 1.914 . . . . 0.0 112.209 179.776 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 69' ' ' VAL . . . . . . . . . . . . . 55.0 t -130.51 133.29 63.89 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.792 0 CA-C-O 121.479 0.657 . . . . 0.0 109.599 179.664 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -74.07 156.0 37.9 Favored 'General case' 0 N--CA 1.487 1.425 0 CA-C-O 121.635 0.731 . . . . 0.0 110.529 -179.711 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 92.2 m-20 -62.47 -39.78 94.53 Favored 'General case' 0 N--CA 1.492 1.628 0 O-C-N 121.545 -0.722 . . . . 0.0 109.92 -179.94 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 72' ' ' ASN . . . . . . . . . . . . . 90.9 m-20 -95.38 16.14 17.62 Favored 'General case' 0 N--CA 1.495 1.79 0 O-C-N 121.345 -0.847 . . . . 0.0 109.404 -179.396 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -59.06 143.47 48.4 Favored 'General case' 0 N--CA 1.491 1.624 0 O-C-N 121.364 -0.835 . . . . 0.0 110.311 -179.321 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 74' ' ' THR . . . . . . . . . . . . . 61.2 p -105.44 -1.0 25.5 Favored 'General case' 0 N--CA 1.494 1.735 0 N-CA-C 108.876 -0.787 . . . . 0.0 108.876 179.708 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 95.9 mt-10 -138.99 158.34 44.38 Favored 'General case' 0 N--CA 1.493 1.703 0 O-C-N 121.475 -0.766 . . . . 0.0 109.596 -179.734 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 6.2 tp -124.78 133.49 53.12 Favored 'General case' 0 N--CA 1.492 1.632 0 O-C-N 121.641 -0.662 . . . . 0.0 109.419 -179.912 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 77' ' ' HIS . . . . . . . . . . . . . 80.8 m80 -112.13 121.12 44.07 Favored 'General case' 0 N--CA 1.491 1.623 0 N-CA-C 109.085 -0.709 . . . . 0.0 109.085 179.556 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -147.1 160.69 42.11 Favored 'General case' 0 N--CA 1.489 1.522 0 O-C-N 121.239 -0.913 . . . . 0.0 109.12 -179.977 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 95.6 mtt180 -126.63 141.97 51.69 Favored 'General case' 0 N--CA 1.494 1.767 0 CA-C-O 121.593 0.711 . . . . 0.0 109.966 -179.715 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 80' ' ' PHE . . . . . . . . . . . . . 42.9 m-85 -128.66 148.53 50.82 Favored 'General case' 0 N--CA 1.493 1.676 0 N-CA-C 109.041 -0.725 . . . . 0.0 109.041 179.819 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 88.3 tttt -104.54 117.07 33.25 Favored 'General case' 0 N--CA 1.492 1.66 0 O-C-N 121.591 -0.693 . . . . 0.0 109.443 -179.757 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 82' ' ' PHE . . . . . . . . . . . . . 65.0 m-85 -112.68 141.78 46.06 Favored 'General case' 0 N--CA 1.494 1.748 0 CA-C-O 121.55 0.691 . . . . 0.0 109.854 -179.889 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 1.4 tm-20 -66.42 -34.19 77.39 Favored 'General case' 0 N--CA 1.488 1.444 0 N-CA-C 109.042 -0.725 . . . . 0.0 109.042 179.484 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 84' ' ' VAL . . . . . . . . . . . . . 31.5 m -135.07 161.3 40.21 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.734 0 CA-C-O 121.607 0.717 . . . . 0.0 109.724 -179.784 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 25.0 m -75.67 -20.55 58.35 Favored 'General case' 0 N--CA 1.491 1.576 0 O-C-N 121.586 -0.696 . . . . 0.0 109.61 -179.903 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 86' ' ' ALA . . . . . . . . . . . . . . . -62.09 -39.38 92.25 Favored 'General case' 0 N--CA 1.494 1.726 0 O-C-N 121.333 -0.854 . . . . 0.0 109.633 -179.468 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 72.8 mm-40 -67.96 -32.28 72.6 Favored 'General case' 0 C--N 1.299 -1.594 0 O-C-N 121.604 -0.685 . . . . 0.0 109.163 -179.814 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 88' ' ' LYS . . . . . . . . . . . . . 4.6 tmtt? -64.36 -49.83 70.09 Favored 'General case' 0 N--CA 1.49 1.539 0 O-C-N 121.288 -0.882 . . . . 0.0 109.069 -179.712 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 17.9 mt -63.64 -44.84 92.68 Favored 'General case' 0 N--CA 1.489 1.519 0 O-C-N 121.276 -0.89 . . . . 0.0 109.662 -179.68 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 90' ' ' ILE . . . . . 0.422 HD13 HG23 ' A' ' 90' ' ' ILE . 97.3 mt -66.41 -43.89 90.93 Favored 'Isoleucine or valine' 0 C--N 1.301 -1.521 0 O-C-N 121.579 -0.701 . . . . 0.0 109.425 -179.745 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 91' ' ' PHE . . . . . . . . . . . . . 81.9 t80 -61.55 -44.93 96.14 Favored 'General case' 0 N--CA 1.49 1.572 0 O-C-N 121.574 -0.704 . . . . 0.0 109.441 -179.588 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 92' ' ' GLU . . . . . . . . . . . . . 80.5 tt0 -62.13 -46.1 90.5 Favored 'General case' 0 N--CA 1.49 1.573 0 O-C-N 121.524 -0.735 . . . . 0.0 109.583 -179.627 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 93' ' ' LEU . . . . . . . . . . . . . 85.3 mt -63.67 -43.44 96.7 Favored 'General case' 0 N--CA 1.491 1.613 0 O-C-N 121.341 -0.849 . . . . 0.0 109.831 -179.537 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 94' ' ' LYS . . . . . . . . . . . . . 55.7 mtpt -65.05 -40.96 95.49 Favored 'General case' 0 C--N 1.302 -1.457 0 O-C-N 121.328 -0.857 . . . . 0.0 109.691 179.863 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 20.6 p -65.27 -35.79 82.1 Favored 'General case' 0 N--CA 1.488 1.471 0 O-C-N 121.385 -0.822 . . . . 0.0 109.493 -179.743 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 96' ' ' ARG . . . . . . . . . . . . . 24.4 mmt180 -63.46 -42.37 98.61 Favored 'General case' 0 C--N 1.3 -1.562 0 O-C-N 121.436 -0.79 . . . . 0.0 109.4 179.638 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 97' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.3 -1.568 0 O-C-N 121.472 -0.767 . . . . 0.0 108.942 179.539 . . . . . . . . 0 0 . 1 . 018 nuclear orig core ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 26.2 t0 . . . . . 0 N--CA 1.495 1.792 0 CA-C-O 121.713 0.768 . . . . 0.0 110.716 . . . . . . . . . 0 0 . 1 . 018 nuclear orig core ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 20.4 t -125.69 160.98 31.42 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.768 0 O-C-N 121.601 -0.687 . . . . 0.0 109.728 -179.97 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 32' ' ' ALA . . . . . 0.606 ' CB ' ' HZ3' ' A' ' 88' ' ' LYS . . . -128.64 148.61 50.82 Favored 'General case' 0 N--CA 1.495 1.822 0 O-C-N 121.567 -0.708 . . . . 0.0 110.088 -179.555 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 81.1 tt0 -104.24 135.57 45.47 Favored 'General case' 0 N--CA 1.491 1.589 0 O-C-N 121.62 -0.675 . . . . 0.0 109.404 -179.894 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 34' ' ' VAL . . . . . . . . . . . . . 56.0 t -124.98 130.7 73.18 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.816 0 O-C-N 121.617 -0.677 . . . . 0.0 109.188 179.765 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 72.4 m -133.28 121.7 22.81 Favored 'General case' 0 N--CA 1.491 1.588 0 N-CA-C 109.006 -0.739 . . . . 0.0 109.006 179.527 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 50.3 tp -122.03 137.65 54.73 Favored 'General case' 0 N--CA 1.496 1.833 0 CA-C-O 121.416 0.627 . . . . 0.0 109.36 -179.986 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 37' ' ' PHE . . . . . . . . . . . . . 97.0 m-85 -102.92 148.02 26.19 Favored 'General case' 0 N--CA 1.492 1.65 0 O-C-N 121.51 -0.744 . . . . 0.0 109.443 -179.863 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . -170.05 -172.14 36.25 Favored Glycine 0 N--CA 1.49 2.251 0 N-CA-C 109.923 -1.271 . . . . 0.0 109.923 -179.78 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 39' ' ' SER . . . . . 0.486 ' OG ' ' N ' ' A' ' 40' ' ' ASP . 91.9 p -106.55 -82.71 0.54 Allowed 'General case' 0 N--CA 1.497 1.885 0 O-C-N 121.331 -1.1 . . . . 0.0 109.942 -179.774 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 40' ' ' ASP . . . . . 0.486 ' N ' ' OG ' ' A' ' 39' ' ' SER . 30.6 t70 -83.9 161.18 20.93 Favored 'General case' 0 N--CA 1.492 1.639 0 O-C-N 121.248 -0.907 . . . . 0.0 110.773 -179.018 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 65.7 tttm -64.72 -37.05 86.27 Favored 'General case' 0 N--CA 1.492 1.63 0 O-C-N 121.512 -0.742 . . . . 0.0 109.969 179.59 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -56.36 -40.52 74.65 Favored 'General case' 0 N--CA 1.492 1.646 0 O-C-N 121.284 -0.885 . . . . 0.0 110.016 -179.202 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 43' ' ' HIS . . . . . . . . . . . . . 68.2 m80 -66.63 -41.36 88.42 Favored 'General case' 0 N--CA 1.49 1.56 0 O-C-N 121.208 -0.932 . . . . 0.0 109.686 -179.921 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 89.0 mt -63.95 -41.56 97.56 Favored 'General case' 0 N--CA 1.494 1.774 0 O-C-N 121.308 -0.87 . . . . 0.0 109.556 179.944 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 80.6 mm-40 -61.47 -42.06 98.2 Favored 'General case' 0 C--N 1.302 -1.492 0 O-C-N 121.347 -0.845 . . . . 0.0 109.432 -179.696 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . -63.05 -50.76 60.68 Favored Glycine 0 N--CA 1.492 2.414 0 N-CA-C 109.691 -1.363 . . . . 0.0 109.691 -179.655 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 64.7 mttp -65.64 -35.98 82.36 Favored 'General case' 0 N--CA 1.492 1.665 0 O-C-N 121.348 -1.09 . . . . 0.0 109.415 179.545 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 53.8 tp -59.6 -38.68 81.88 Favored 'General case' 0 N--CA 1.493 1.714 0 O-C-N 121.538 -0.726 . . . . 0.0 109.498 -179.259 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 49' ' ' ALA . . . . . . . . . . . . . . . -53.15 -32.59 48.44 Favored 'General case' 0 N--CA 1.49 1.556 0 O-C-N 121.177 -0.952 . . . . 0.0 109.789 -179.434 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 73.6 mm-40 -65.31 -40.11 93.33 Favored 'General case' 0 N--CA 1.492 1.645 0 O-C-N 121.203 -0.936 . . . . 0.0 109.423 -179.882 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 51' ' ' TYR . . . . . 0.494 ' CE2' ' CG2' ' A' ' 95' ' ' THR . 31.6 m-85 -62.92 -41.68 99.54 Favored 'General case' 0 N--CA 1.49 1.573 0 O-C-N 121.326 -0.859 . . . . 0.0 109.931 -179.758 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 52' ' ' ILE . . . . . . . . . . . . . 34.6 mm -63.98 -44.95 98.01 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.641 0 O-C-N 121.14 -0.975 . . . . 0.0 109.482 -179.35 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 53' ' ' SER . . . . . 0.49 ' HG ' ' N ' ' A' ' 54' ' ' LEU . 76.1 p -65.81 -44.61 85.11 Favored 'General case' 0 N--CA 1.491 1.611 0 O-C-N 121.166 -0.959 . . . . 0.0 110.153 -179.706 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 54' ' ' LEU . . . . . 0.49 ' N ' ' HG ' ' A' ' 53' ' ' SER . 85.2 mt -65.43 -42.23 92.68 Favored 'General case' 0 N--CA 1.493 1.703 0 O-C-N 121.24 -0.913 . . . . 0.0 109.943 -179.636 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -61.16 -49.76 75.92 Favored 'General case' 0 N--CA 1.492 1.648 0 O-C-N 121.408 -0.808 . . . . 0.0 110.702 -178.893 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 56' ' ' LYS . . . . . . . . . . . . . 98.5 mttt -65.11 -43.87 90.58 Favored 'General case' 0 N--CA 1.492 1.627 0 O-C-N 121.188 -0.945 . . . . 0.0 110.056 -179.361 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 59.2 tt0 -65.94 -47.21 75.43 Favored 'General case' 0 N--CA 1.491 1.597 0 O-C-N 121.334 -0.854 . . . . 0.0 109.328 -179.9 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 58' ' ' VAL . . . . . . . . . . . . . 54.6 t -64.97 -45.42 94.73 Favored 'Isoleucine or valine' 0 C--N 1.302 -1.492 0 O-C-N 121.45 -0.781 . . . . 0.0 109.94 -179.926 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 59' ' ' TYR . . . . . . . . . . . . . 54.9 t80 -131.91 124.04 28.66 Favored 'General case' 0 N--CA 1.498 1.964 0 O-C-N 121.365 -0.834 . . . . 0.0 110.042 -179.204 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 60' ' ' ALA . . . . . 0.42 ' O ' ' OD1' ' A' ' 61' ' ' ASN . . . -66.43 148.38 51.96 Favored 'General case' 0 N--CA 1.491 1.59 0 O-C-N 121.688 -0.633 . . . . 0.0 110.902 -179.601 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 61' ' ' ASN . . . . . 0.42 ' OD1' ' O ' ' A' ' 60' ' ' ALA . 7.6 p-10 44.61 52.65 7.59 Favored 'General case' 0 N--CA 1.496 1.829 0 CA-C-O 121.717 0.77 . . . . 0.0 109.425 179.722 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 62' ' ' VAL . . . . . . . . . . . . . 15.0 p -79.09 140.22 17.18 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.499 0 O-C-N 121.635 -0.666 . . . . 0.0 109.911 -179.776 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 96.7 mt-10 -110.1 132.47 54.13 Favored 'General case' 0 N--CA 1.494 1.756 0 CA-C-O 121.58 0.705 . . . . 0.0 109.563 -179.57 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 64' ' ' TYR . . . . . . . . . . . . . 53.0 p90 -147.99 164.53 33.49 Favored 'General case' 0 N--CA 1.489 1.476 0 O-C-N 121.378 -0.826 . . . . 0.0 109.52 -179.847 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 95.7 mt-10 -139.31 151.95 46.83 Favored 'General case' 0 N--CA 1.492 1.626 0 O-C-N 121.451 -0.781 . . . . 0.0 109.273 179.893 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 66' ' ' VAL . . . . . . . . . . . . . 3.1 p -123.91 130.55 73.84 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.768 0 CA-C-O 121.537 0.684 . . . . 0.0 109.657 -179.493 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -76.7 172.35 9.87 Favored Pre-proline 0 C--N 1.303 -1.448 0 O-C-N 121.683 -0.636 . . . . 0.0 109.68 -179.85 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 68' ' ' PRO . . . . . . . . . . . . . 52.5 Cg_exo -54.8 139.07 77.85 Favored 'Trans proline' 0 N--CA 1.498 1.781 0 C-N-CA 122.57 2.18 . . . . 0.0 112.427 179.934 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 69' ' ' VAL . . . . . . . . . . . . . 60.1 t -128.96 132.32 67.46 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.924 0 O-C-N 121.593 -0.692 . . . . 0.0 109.572 179.702 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -87.02 163.49 17.02 Favored 'General case' 0 N--CA 1.489 1.503 0 O-C-N 121.413 -0.804 . . . . 0.0 109.881 -179.968 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 75.4 m-20 -63.25 -40.86 98.6 Favored 'General case' 0 N--CA 1.491 1.59 0 O-C-N 121.385 -0.822 . . . . 0.0 109.543 -179.917 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 72' ' ' ASN . . . . . . . . . . . . . 98.8 m-20 -99.31 19.35 15.62 Favored 'General case' 0 N--CA 1.493 1.71 0 O-C-N 121.423 -0.798 . . . . 0.0 109.372 -179.289 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -54.18 139.35 35.89 Favored 'General case' 0 N--CA 1.491 1.614 0 O-C-N 121.252 -0.905 . . . . 0.0 110.05 -179.279 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 74' ' ' THR . . . . . . . . . . . . . 81.6 p -107.78 -0.98 21.33 Favored 'General case' 0 N--CA 1.494 1.735 0 N-CA-C 108.879 -0.786 . . . . 0.0 108.879 179.6 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 17.3 pt-20 -141.99 160.04 41.02 Favored 'General case' 0 N--CA 1.495 1.813 0 O-C-N 121.208 -0.933 . . . . 0.0 109.34 179.327 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 6.6 tp -130.02 130.43 44.96 Favored 'General case' 0 N--CA 1.492 1.657 0 N-CA-C 109.054 -0.721 . . . . 0.0 109.054 179.617 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 77' ' ' HIS . . . . . . . . . . . . . 59.0 t-80 -114.53 113.71 24.79 Favored 'General case' 0 N--CA 1.493 1.676 0 N-CA-C 109.043 -0.725 . . . . 0.0 109.043 179.912 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -135.95 159.37 41.88 Favored 'General case' 0 N--CA 1.493 1.698 0 O-C-N 121.427 -0.796 . . . . 0.0 109.328 -179.778 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 15.9 tpp180 -127.86 141.2 51.62 Favored 'General case' 0 N--CA 1.492 1.641 0 N-CA-C 109.243 -0.651 . . . . 0.0 109.243 -179.764 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 80' ' ' PHE . . . . . . . . . . . . . 52.8 m-85 -126.08 146.62 49.85 Favored 'General case' 0 N--CA 1.494 1.728 0 CA-C-O 121.448 0.642 . . . . 0.0 109.414 -179.883 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 3.3 ttmp? -109.35 127.58 54.44 Favored 'General case' 0 N--CA 1.49 1.53 0 O-C-N 121.753 -0.592 . . . . 0.0 109.551 -179.772 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 82' ' ' PHE . . . . . . . . . . . . . 70.5 m-85 -125.02 147.03 49.15 Favored 'General case' 0 N--CA 1.491 1.616 0 CA-C-O 121.531 0.681 . . . . 0.0 109.607 -179.75 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 83.9 tt0 -67.45 -37.14 82.51 Favored 'General case' 0 C--N 1.302 -1.498 0 O-C-N 121.525 -0.734 . . . . 0.0 109.738 -179.909 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 84' ' ' VAL . . . . . . . . . . . . . 30.1 m -137.02 162.5 34.12 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.876 0 O-C-N 121.258 -0.901 . . . . 0.0 110.467 -179.306 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 74.9 p -69.97 -16.05 63.13 Favored 'General case' 0 N--CA 1.49 1.555 0 O-C-N 121.783 -0.573 . . . . 0.0 110.036 179.747 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 86' ' ' ALA . . . . . . . . . . . . . . . -62.78 -40.85 98.57 Favored 'General case' 0 N--CA 1.495 1.825 0 O-C-N 121.108 -0.995 . . . . 0.0 109.735 -179.623 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 87' ' ' GLU . . . . . 0.53 ' N ' ' OE1' ' A' ' 87' ' ' GLU . 4.9 mp0 -70.2 -30.48 67.6 Favored 'General case' 0 N--CA 1.491 1.624 0 O-C-N 121.411 -0.806 . . . . 0.0 108.848 179.883 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 88' ' ' LYS . . . . . 0.606 ' HZ3' ' CB ' ' A' ' 32' ' ' ALA . 64.6 tttp -62.62 -47.49 83.53 Favored 'General case' 0 C--N 1.3 -1.567 0 O-C-N 121.221 -0.924 . . . . 0.0 109.314 -179.956 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 48.3 tp -64.71 -47.45 78.25 Favored 'General case' 0 N--CA 1.49 1.55 0 O-C-N 121.312 -0.867 . . . . 0.0 109.857 -179.38 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 90' ' ' ILE . . . . . . . . . . . . . 97.0 mt -66.58 -45.07 89.54 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.734 0 O-C-N 121.236 -0.915 . . . . 0.0 109.674 -179.533 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 91' ' ' PHE . . . . . . . . . . . . . 91.2 t80 -64.45 -45.35 87.83 Favored 'General case' 0 N--CA 1.491 1.588 0 O-C-N 121.581 -0.7 . . . . 0.0 110.021 -179.587 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 92' ' ' GLU . . . . . . . . . . . . . 47.1 tp10 -66.25 -37.37 85.34 Favored 'General case' 0 N--CA 1.49 1.544 0 O-C-N 121.334 -0.854 . . . . 0.0 109.63 -179.225 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 93' ' ' LEU . . . . . . . . . . . . . 6.2 tt -62.73 -44.26 96.66 Favored 'General case' 0 C--N 1.3 -1.561 0 O-C-N 121.219 -0.925 . . . . 0.0 109.819 -179.582 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 94' ' ' LYS . . . . . . . . . . . . . 68.0 mttm -65.29 -42.88 92.67 Favored 'General case' 0 N--CA 1.491 1.588 0 O-C-N 121.334 -0.853 . . . . 0.0 110.238 -179.633 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 95' ' ' THR . . . . . 0.494 ' CG2' ' CE2' ' A' ' 51' ' ' TYR . 19.7 p -65.2 -44.23 89.03 Favored 'General case' 0 N--CA 1.492 1.657 0 O-C-N 121.39 -0.819 . . . . 0.0 110.367 -179.048 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 96' ' ' ARG . . . . . . . . . . . . . 83.3 mtp180 -64.4 -39.53 94.03 Favored 'General case' 0 N--CA 1.491 1.597 0 O-C-N 121.176 -0.953 . . . . 0.0 109.659 -179.796 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 97' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 1.545 0 O-C-N 121.291 -0.88 . . . . 0.0 109.911 -179.687 . . . . . . . . 0 0 . 1 . 019 nuclear orig core ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 88.4 m-20 . . . . . 0 N--CA 1.497 1.9 0 N-CA-C 109.03 -0.73 . . . . 0.0 109.03 . . . . . . . . . 0 0 . 1 . 019 nuclear orig core ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 52.0 t -124.61 134.77 65.9 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.934 0 O-C-N 121.482 -0.761 . . . . 0.0 109.324 -179.946 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -110.14 154.93 22.62 Favored 'General case' 0 N--CA 1.495 1.805 0 CA-C-O 121.695 0.76 . . . . 0.0 109.515 -179.946 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 95.8 mt-10 -87.68 126.48 34.99 Favored 'General case' 0 N--CA 1.489 1.518 0 CA-C-O 121.585 0.707 . . . . 0.0 109.653 -179.621 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 34' ' ' VAL . . . . . . . . . . . . . 53.7 t -124.99 134.99 65.52 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.712 0 CA-C-O 121.748 0.785 . . . . 0.0 109.198 -179.626 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 6.0 p -134.81 140.49 45.91 Favored 'General case' 0 N--CA 1.491 1.58 0 N-CA-C 108.89 -0.781 . . . . 0.0 108.89 179.878 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 36' ' ' LEU . . . . . 0.416 ' CD2' ' CZ ' ' A' ' 51' ' ' TYR . 0.2 OUTLIER -121.0 124.04 43.89 Favored 'General case' 0 N--CA 1.494 1.761 0 CA-C-O 121.709 0.766 . . . . 0.0 109.131 -179.662 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 37' ' ' PHE . . . . . . . . . . . . . 92.5 m-85 -99.79 146.02 27.05 Favored 'General case' 0 N--CA 1.492 1.656 0 O-C-N 121.506 -0.746 . . . . 0.0 109.777 179.872 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . -178.84 -169.31 39.3 Favored Glycine 0 N--CA 1.489 2.171 0 N-CA-C 109.837 -1.305 . . . . 0.0 109.837 -179.975 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 39' ' ' SER . . . . . 0.494 ' OG ' ' N ' ' A' ' 40' ' ' ASP . 3.0 t -82.23 -99.37 0.04 OUTLIER 'General case' 0 N--CA 1.491 1.606 0 O-C-N 121.634 -0.921 . . . . 0.0 109.91 -179.939 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 40' ' ' ASP . . . . . 0.494 ' N ' ' OG ' ' A' ' 39' ' ' SER . 97.4 m-20 -83.6 178.03 8.15 Favored 'General case' 0 N--CA 1.495 1.811 0 O-C-N 121.165 -0.959 . . . . 0.0 110.696 -179.464 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 87.9 tttt -63.62 -33.14 74.95 Favored 'General case' 0 N--CA 1.493 1.676 0 CA-C-O 121.404 0.621 . . . . 0.0 110.092 -179.795 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -60.53 -38.59 84.94 Favored 'General case' 0 N--CA 1.492 1.663 0 O-C-N 121.161 -0.962 . . . . 0.0 109.725 -179.533 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 43' ' ' HIS . . . . . . . . . . . . . 83.6 m-70 -68.43 -37.38 80.23 Favored 'General case' 0 N--CA 1.492 1.671 0 O-C-N 121.313 -0.867 . . . . 0.0 109.931 179.868 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 97.0 mt -63.61 -42.23 98.23 Favored 'General case' 0 N--CA 1.493 1.724 0 O-C-N 121.514 -0.741 . . . . 0.0 110.27 -178.953 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 98.0 mt-10 -69.69 -38.53 77.03 Favored 'General case' 0 C--N 1.299 -1.607 0 O-C-N 121.205 -0.934 . . . . 0.0 109.637 -179.852 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 46' ' ' GLY . . . . . 0.441 ' O ' ' OE1' ' A' ' 50' ' ' GLU . . . -62.78 -40.85 99.73 Favored Glycine 0 N--CA 1.493 2.435 0 N-CA-C 110.178 -1.169 . . . . 0.0 110.178 -179.644 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 56.7 mtpt -81.29 -21.75 39.1 Favored 'General case' 0 N--CA 1.489 1.485 0 O-C-N 121.365 -1.08 . . . . 0.0 109.316 179.905 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 57.6 tp -65.89 -38.15 88.0 Favored 'General case' 0 N--CA 1.492 1.668 0 O-C-N 121.542 -0.724 . . . . 0.0 109.787 179.838 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 49' ' ' ALA . . . . . . . . . . . . . . . -56.96 -34.74 68.35 Favored 'General case' 0 N--CA 1.493 1.725 0 O-C-N 121.359 -0.838 . . . . 0.0 109.861 -179.179 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 50' ' ' GLU . . . . . 0.564 ' N ' ' OE1' ' A' ' 50' ' ' GLU . 51.8 mp0 -67.28 -40.78 86.19 Favored 'General case' 0 C--N 1.299 -1.609 0 O-C-N 121.348 -0.845 . . . . 0.0 109.549 -179.909 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 51' ' ' TYR . . . . . 0.416 ' CZ ' ' CD2' ' A' ' 36' ' ' LEU . 3.9 m-85 -60.24 -42.83 96.12 Favored 'General case' 0 N--CA 1.492 1.665 0 O-C-N 121.407 -0.808 . . . . 0.0 109.821 -179.642 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 52' ' ' ILE . . . . . . . . . . . . . 95.7 mt -64.13 -42.67 96.3 Favored 'Isoleucine or valine' 0 C--N 1.298 -1.653 0 O-C-N 121.361 -0.837 . . . . 0.0 109.613 -179.676 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 48.4 m -52.92 -51.74 60.23 Favored 'General case' 0 N--CA 1.493 1.695 0 O-C-N 121.364 -0.835 . . . . 0.0 110.012 -178.951 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 54' ' ' LEU . . . . . 0.46 ' N ' ' CD2' ' A' ' 54' ' ' LEU . 4.2 mm? -65.31 -40.74 94.14 Favored 'General case' 0 N--CA 1.493 1.713 0 O-C-N 121.255 -0.903 . . . . 0.0 110.076 179.807 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -64.73 -38.37 90.77 Favored 'General case' 0 C--N 1.3 -1.563 0 O-C-N 121.373 -0.83 . . . . 0.0 110.08 -179.336 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 56' ' ' LYS . . . . . . . . . . . . . 45.4 tttp -63.77 -42.74 97.72 Favored 'General case' 0 N--CA 1.489 1.521 0 O-C-N 121.283 -0.886 . . . . 0.0 109.68 -179.683 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 77.0 mt-30 -65.75 -43.71 88.13 Favored 'General case' 0 N--CA 1.494 1.745 0 O-C-N 121.37 -0.831 . . . . 0.0 109.687 -179.765 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 58' ' ' VAL . . . . . . . . . . . . . 79.7 t -65.33 -44.74 94.7 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.675 0 O-C-N 121.383 -0.823 . . . . 0.0 109.518 -179.948 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 59' ' ' TYR . . . . . 0.425 ' O ' ' O ' ' A' ' 60' ' ' ALA . 62.6 t80 -126.66 133.14 51.04 Favored 'General case' 0 N--CA 1.497 1.902 0 CA-C-O 121.866 0.841 . . . . 0.0 109.406 -179.793 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 60' ' ' ALA . . . . . 0.425 ' O ' ' O ' ' A' ' 59' ' ' TYR . . . -44.43 -100.01 0.0 OUTLIER 'General case' 0 N--CA 1.493 1.679 0 CA-C-O 121.645 0.736 . . . . 0.0 111.129 -179.229 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 61' ' ' ASN . . . . . . . . . . . . . 10.4 m120 -87.11 90.29 8.3 Favored 'General case' 0 N--CA 1.491 1.59 0 O-C-N 121.334 -0.854 . . . . 0.0 109.351 -179.051 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 62' ' ' VAL . . . . . . . . . . . . . 11.0 p -80.15 136.68 22.93 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.552 0 O-C-N 121.571 -0.706 . . . . 0.0 109.768 -179.978 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 84.8 tt0 -113.64 138.39 50.26 Favored 'General case' 0 N--CA 1.495 1.784 0 CA-C-O 121.623 0.725 . . . . 0.0 109.178 -179.854 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 64' ' ' TYR . . . . . . . . . . . . . 50.7 p90 -148.36 162.64 39.14 Favored 'General case' 0 N--CA 1.491 1.614 0 O-C-N 121.413 -0.804 . . . . 0.0 109.962 -179.499 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 49.3 tp10 -139.69 145.73 38.75 Favored 'General case' 0 N--CA 1.493 1.686 0 N-CA-C 108.789 -0.819 . . . . 0.0 108.789 179.623 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 66' ' ' VAL . . . . . . . . . . . . . 27.2 m -115.52 128.03 72.88 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.764 0 CA-C-O 121.768 0.795 . . . . 0.0 110.018 -179.26 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -80.15 171.82 11.41 Favored Pre-proline 0 N--CA 1.488 1.446 0 N-CA-C 109.569 -0.53 . . . . 0.0 109.569 -179.85 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 68' ' ' PRO . . . . . . . . . . . . . 51.0 Cg_exo -51.68 129.5 30.11 Favored 'Trans proline' 0 N--CA 1.494 1.54 0 C-N-CA 122.428 2.085 . . . . 0.0 112.309 179.624 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 69' ' ' VAL . . . . . . . . . . . . . 51.0 t -131.51 134.1 61.05 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.794 0 CA-C-O 121.803 0.811 . . . . 0.0 109.899 179.911 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -73.01 153.07 41.05 Favored 'General case' 0 N--CA 1.49 1.541 0 CA-C-O 121.735 0.779 . . . . 0.0 110.335 -179.992 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 64.6 t0 -63.6 -36.1 82.7 Favored 'General case' 0 N--CA 1.49 1.563 0 CA-C-O 121.591 0.71 . . . . 0.0 109.322 179.308 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 72' ' ' ASN . . . . . . . . . . . . . 56.5 p30 -95.43 19.1 11.39 Favored 'General case' 0 N--CA 1.493 1.709 0 O-C-N 121.266 -0.897 . . . . 0.0 108.722 179.849 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -64.26 143.86 57.57 Favored 'General case' 0 N--CA 1.49 1.538 0 O-C-N 121.435 -0.791 . . . . 0.0 110.358 -179.715 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 74' ' ' THR . . . . . . . . . . . . . 6.3 p -106.18 -0.62 24.45 Favored 'General case' 0 N--CA 1.492 1.673 0 N-CA-C 108.589 -0.893 . . . . 0.0 108.589 179.268 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 80.9 tt0 -141.74 154.42 45.26 Favored 'General case' 0 N--CA 1.494 1.746 0 O-C-N 121.222 -0.924 . . . . 0.0 109.379 179.884 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 6.7 tp -117.03 131.89 56.83 Favored 'General case' 0 N--CA 1.493 1.699 0 O-C-N 121.569 -0.707 . . . . 0.0 109.512 -179.814 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 77' ' ' HIS . . . . . . . . . . . . . 7.4 t-160 -105.66 108.33 19.79 Favored 'General case' 0 N--CA 1.493 1.703 0 N-CA-C 109.062 -0.718 . . . . 0.0 109.062 179.846 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -147.01 159.35 43.68 Favored 'General case' 0 N--CA 1.492 1.653 0 O-C-N 121.353 -0.842 . . . . 0.0 109.596 -179.413 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 89.7 mtm-85 -131.8 148.95 52.59 Favored 'General case' 0 N--CA 1.496 1.846 0 O-C-N 121.639 -0.663 . . . . 0.0 109.356 -179.917 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 80' ' ' PHE . . . . . . . . . . . . . 28.3 m-85 -121.61 147.43 45.86 Favored 'General case' 0 N--CA 1.5 2.049 0 CA-C-O 121.669 0.747 . . . . 0.0 109.599 -179.802 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 64.2 tttp -109.26 114.02 27.35 Favored 'General case' 0 N--CA 1.491 1.618 0 CA-C-O 121.732 0.777 . . . . 0.0 109.37 179.903 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 82' ' ' PHE . . . . . . . . . . . . . 82.7 m-85 -100.98 -109.25 0.22 Allowed 'General case' 0 N--CA 1.494 1.725 0 CA-C-O 121.635 0.731 . . . . 0.0 109.561 -179.973 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 47.3 tp10 -168.78 -37.96 0.02 OUTLIER 'General case' 0 N--CA 1.489 1.493 0 N-CA-C 108.539 -0.912 . . . . 0.0 108.539 179.926 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 84' ' ' VAL . . . . . . . . . . . . . 27.3 m -133.77 161.94 40.24 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.909 0 O-C-N 121.471 -0.768 . . . . 0.0 109.63 -179.998 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 15.5 m -72.9 -19.63 61.24 Favored 'General case' 0 N--CA 1.491 1.597 0 O-C-N 121.464 -0.773 . . . . 0.0 109.274 179.825 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 86' ' ' ALA . . . . . . . . . . . . . . . -63.43 -39.52 94.7 Favored 'General case' 0 N--CA 1.492 1.634 0 O-C-N 121.215 -0.928 . . . . 0.0 109.714 -179.98 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 97.0 mt-10 -71.01 -32.26 69.01 Favored 'General case' 0 N--CA 1.493 1.691 0 O-C-N 121.334 -0.854 . . . . 0.0 109.37 179.731 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 88' ' ' LYS . . . . . . . . . . . . . 14.4 tmtt? -62.18 -48.01 81.97 Favored 'General case' 0 C--N 1.302 -1.49 0 O-C-N 121.33 -0.856 . . . . 0.0 110.013 -179.803 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 94.0 mt -64.97 -42.94 94.12 Favored 'General case' 0 N--CA 1.492 1.659 0 O-C-N 121.338 -0.851 . . . . 0.0 109.372 -179.68 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 90' ' ' ILE . . . . . 0.418 HD11 HG23 ' A' ' 90' ' ' ILE . 95.1 mt -65.36 -45.45 93.19 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.645 0 CA-C-O 121.737 0.779 . . . . 0.0 109.512 -179.91 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 91' ' ' PHE . . . . . . . . . . . . . 80.9 t80 -66.0 -44.07 85.9 Favored 'General case' 0 N--CA 1.49 1.568 0 CA-C-O 121.724 0.773 . . . . 0.0 109.845 -179.909 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 92' ' ' GLU . . . . . . . . . . . . . 48.4 tp10 -59.97 -38.7 83.28 Favored 'General case' 0 N--CA 1.491 1.61 0 O-C-N 121.445 -0.785 . . . . 0.0 109.469 -179.163 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 93' ' ' LEU . . . . . . . . . . . . . 5.5 tt -63.53 -44.35 94.48 Favored 'General case' 0 C--N 1.297 -1.679 0 O-C-N 121.38 -0.825 . . . . 0.0 109.865 179.974 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 94' ' ' LYS . . . . . . . . . . . . . 62.5 mttp -65.7 -41.64 92.13 Favored 'General case' 0 N--CA 1.492 1.674 0 O-C-N 121.433 -0.792 . . . . 0.0 109.77 -179.878 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 23.4 p -66.59 -38.6 87.38 Favored 'General case' 0 N--CA 1.493 1.688 0 O-C-N 121.315 -0.866 . . . . 0.0 109.653 -179.782 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 96' ' ' ARG . . . . . . . . . . . . . 25.1 mmt180 -65.14 -40.97 95.13 Favored 'General case' 0 N--CA 1.492 1.663 0 O-C-N 121.227 -0.921 . . . . 0.0 109.935 179.739 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 97' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.3 -1.578 0 O-C-N 121.323 -0.861 . . . . 0.0 109.839 -179.688 . . . . . . . . 0 0 . 1 . 020 nuclear orig core ' A' A ' 30' ' ' ASP . . . . . 0.49 ' CG ' ' HZ1' ' A' ' 81' ' ' LYS . 51.1 p30 . . . . . 0 N--CA 1.488 1.466 0 N-CA-C 109.18 -0.674 . . . . 0.0 109.18 . . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 52.6 t -122.7 135.83 61.48 Favored 'Isoleucine or valine' 0 N--CA 1.502 2.142 0 O-C-N 121.403 -0.811 . . . . 0.0 109.775 -179.609 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 32' ' ' ALA . . . . . 0.579 ' CB ' ' HZ3' ' A' ' 88' ' ' LYS . . . -113.83 151.73 31.67 Favored 'General case' 0 N--CA 1.496 1.856 0 CA-C-O 121.42 0.629 . . . . 0.0 109.601 -179.967 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 40.3 tt0 -109.04 145.62 35.29 Favored 'General case' 0 N--CA 1.496 1.867 0 CA-C-O 121.499 0.666 . . . . 0.0 110.266 -179.312 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 34' ' ' VAL . . . . . . . . . . . . . 55.5 t -124.46 131.95 72.03 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.887 0 CA-C-O 121.487 0.661 . . . . 0.0 109.435 179.96 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 56.8 m -108.33 121.83 45.72 Favored 'General case' 0 N--CA 1.496 1.836 0 N-CA-C 109.264 -0.643 . . . . 0.0 109.264 179.542 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 49.5 tp -121.98 135.77 54.88 Favored 'General case' 0 N--CA 1.495 1.793 0 CA-C-O 121.595 0.712 . . . . 0.0 109.656 179.856 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 37' ' ' PHE . . . . . . . . . . . . . 86.1 t80 -113.17 138.12 50.43 Favored 'General case' 0 N--CA 1.494 1.73 0 CA-C-O 121.578 0.704 . . . . 0.0 109.69 -179.851 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . -169.11 -170.51 33.79 Favored Glycine 0 N--CA 1.489 2.189 0 N-CA-C 110.15 -1.18 . . . . 0.0 110.15 -179.849 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 32.8 p -82.36 -108.9 0.03 OUTLIER 'General case' 0 N--CA 1.491 1.585 0 O-C-N 121.677 -0.896 . . . . 0.0 110.104 -179.69 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 40' ' ' ASP . . . . . . . . . . . . . 99.4 m-20 -81.05 175.13 10.94 Favored 'General case' 0 N--CA 1.493 1.72 0 O-C-N 121.192 -0.943 . . . . 0.0 110.698 -179.352 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 88.6 tttt -62.71 -41.98 99.42 Favored 'General case' 0 N--CA 1.491 1.624 0 CA-C-O 121.527 0.679 . . . . 0.0 109.966 -179.892 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -54.01 -46.29 71.73 Favored 'General case' 0 N--CA 1.492 1.662 0 O-C-N 121.394 -0.816 . . . . 0.0 109.796 -179.451 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 43' ' ' HIS . . . . . 0.627 ' CE1' ' HZ3' ' A' ' 47' ' ' LYS . 82.9 t60 -66.67 -42.65 86.24 Favored 'General case' 0 N--CA 1.493 1.682 0 O-C-N 121.283 -0.885 . . . . 0.0 109.72 179.829 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 37.0 mt -63.29 -41.26 98.97 Favored 'General case' 0 N--CA 1.496 1.851 0 O-C-N 121.333 -0.855 . . . . 0.0 109.877 -179.94 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 66.0 mm-40 -62.46 -38.23 88.97 Favored 'General case' 0 N--CA 1.49 1.565 0 O-C-N 121.439 -0.788 . . . . 0.0 109.623 -179.775 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . -59.3 -53.91 42.27 Favored Glycine 0 N--CA 1.494 2.504 0 N-CA-C 109.519 -1.432 . . . . 0.0 109.519 -179.884 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 47' ' ' LYS . . . . . 0.627 ' HZ3' ' CE1' ' A' ' 43' ' ' HIS . 47.6 mttp -66.47 -37.63 85.54 Favored 'General case' 0 N--CA 1.493 1.683 0 O-C-N 121.456 -1.026 . . . . 0.0 109.605 179.02 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 49.0 tp -51.84 -34.07 38.85 Favored 'General case' 0 N--CA 1.494 1.746 0 CA-C-O 121.657 0.742 . . . . 0.0 109.681 -179.373 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 49' ' ' ALA . . . . . . . . . . . . . . . -56.37 -34.46 66.67 Favored 'General case' 0 N--CA 1.491 1.612 0 O-C-N 121.354 -0.841 . . . . 0.0 109.635 -179.698 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 80.5 mm-40 -66.46 -43.16 86.26 Favored 'General case' 0 N--CA 1.495 1.79 0 O-C-N 121.259 -0.9 . . . . 0.0 109.974 -179.923 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 64.0 m-85 -64.1 -44.53 92.02 Favored 'General case' 0 N--CA 1.495 1.816 0 O-C-N 121.325 -0.859 . . . . 0.0 109.872 -179.727 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 52' ' ' ILE . . . . . 0.403 HD13 HG23 ' A' ' 52' ' ' ILE . 96.4 mt -65.18 -43.75 95.45 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.732 0 O-C-N 121.287 -0.883 . . . . 0.0 109.677 -179.987 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 60.9 m -61.86 -41.14 97.48 Favored 'General case' 0 N--CA 1.493 1.697 0 O-C-N 121.293 -0.879 . . . . 0.0 109.729 -179.844 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 54' ' ' LEU . . . . . . . . . . . . . 46.6 tp -63.79 -40.98 97.97 Favored 'General case' 0 N--CA 1.491 1.605 0 O-C-N 121.248 -0.907 . . . . 0.0 109.643 -179.988 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -60.12 -40.65 90.46 Favored 'General case' 0 N--CA 1.491 1.604 0 O-C-N 121.378 -0.826 . . . . 0.0 109.392 -179.355 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 56' ' ' LYS . . . . . . . . . . . . . 98.4 mttt -65.19 -41.52 94.48 Favored 'General case' 0 N--CA 1.491 1.582 0 O-C-N 121.456 -0.777 . . . . 0.0 109.551 179.587 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 67.5 tp60 -65.21 -46.33 81.12 Favored 'General case' 0 N--CA 1.493 1.709 0 O-C-N 121.32 -0.862 . . . . 0.0 109.919 -179.399 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 58' ' ' VAL . . . . . . . . . . . . . 88.0 t -65.23 -43.87 95.25 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.572 0 O-C-N 121.199 -0.938 . . . . 0.0 109.118 -179.979 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 59' ' ' TYR . . . . . . . . . . . . . 45.1 t80 -138.54 117.99 12.9 Favored 'General case' 0 N--CA 1.496 1.865 0 O-C-N 121.433 -0.792 . . . . 0.0 109.545 -179.806 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -69.39 149.11 48.73 Favored 'General case' 0 N--CA 1.492 1.64 0 CA-C-O 121.714 0.768 . . . . 0.0 110.625 -179.615 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 61' ' ' ASN . . . . . . . . . . . . . 8.8 t-20 60.09 39.35 19.76 Favored 'General case' 0 N--CA 1.491 1.613 0 CA-C-O 121.779 0.8 . . . . 0.0 109.472 179.806 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 62' ' ' VAL . . . . . . . . . . . . . 14.1 p -76.67 139.15 19.3 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.762 0 O-C-N 121.438 -0.789 . . . . 0.0 110.523 -179.967 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 96.0 mt-10 -106.05 136.09 46.34 Favored 'General case' 0 N--CA 1.497 1.891 0 CA-C-O 121.756 0.789 . . . . 0.0 109.594 179.944 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 64' ' ' TYR . . . . . . . . . . . . . 50.4 p90 -151.03 162.98 39.82 Favored 'General case' 0 N--CA 1.49 1.54 0 O-C-N 121.458 -0.776 . . . . 0.0 109.681 -179.478 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 79.8 mm-40 -139.5 152.45 46.97 Favored 'General case' 0 N--CA 1.495 1.78 0 O-C-N 121.408 -0.808 . . . . 0.0 109.643 179.853 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 66' ' ' VAL . . . . . . . . . . . . . 53.8 t -113.44 129.87 68.45 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.75 0 CA-C-O 121.718 0.771 . . . . 0.0 109.218 -179.679 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -77.06 168.88 24.37 Favored Pre-proline 0 C--N 1.302 -1.486 0 O-C-N 121.727 -0.608 . . . . 0.0 109.766 -179.55 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 68' ' ' PRO . . . . . . . . . . . . . 27.8 Cg_exo -59.04 143.25 99.88 Favored 'Trans proline' 0 N--CA 1.493 1.483 0 C-N-CA 122.371 2.047 . . . . 0.0 112.354 179.557 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 69' ' ' VAL . . . . . 0.541 ' C ' ' H ' ' A' ' 71' ' ' ASP . 47.2 t -120.99 132.58 70.12 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.74 0 CA-C-O 121.676 0.751 . . . . 0.0 109.589 -179.856 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 70' ' ' ALA . . . . . 0.62 ' O ' ' N ' ' A' ' 72' ' ' ASN . . . -74.42 30.49 0.08 Allowed 'General case' 0 N--CA 1.491 1.602 0 O-C-N 121.576 -0.703 . . . . 0.0 109.453 179.861 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 71' ' ' ASP . . . . . 0.541 ' H ' ' C ' ' A' ' 69' ' ' VAL . 25.0 t0 55.6 -71.74 0.01 OUTLIER 'General case' 0 N--CA 1.493 1.7 0 CA-C-O 121.625 0.726 . . . . 0.0 110.728 179.658 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 72' ' ' ASN . . . . . 0.62 ' N ' ' O ' ' A' ' 70' ' ' ALA . 64.3 t30 -75.51 -2.15 27.58 Favored 'General case' 0 C--N 1.299 -1.628 0 O-C-N 121.299 -0.876 . . . . 0.0 109.429 -179.723 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -43.95 146.84 0.55 Allowed 'General case' 0 N--CA 1.496 1.843 0 O-C-N 121.306 -0.871 . . . . 0.0 110.125 179.974 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 74' ' ' THR . . . . . . . . . . . . . 5.0 p -96.74 0.15 49.09 Favored 'General case' 0 N--CA 1.492 1.658 0 O-C-N 121.385 -0.822 . . . . 0.0 108.965 -179.922 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 21.6 pt-20 -144.78 156.63 44.15 Favored 'General case' 0 N--CA 1.495 1.782 0 O-C-N 121.133 -0.979 . . . . 0.0 109.862 179.855 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 6.8 tt -126.4 133.26 51.33 Favored 'General case' 0 N--CA 1.492 1.644 0 CA-C-O 121.62 0.724 . . . . 0.0 109.267 -180.0 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 77' ' ' HIS . . . . . . . . . . . . . 73.8 m80 -105.76 129.37 53.97 Favored 'General case' 0 N--CA 1.495 1.819 0 O-C-N 121.626 -0.671 . . . . 0.0 109.639 -179.664 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -140.75 155.87 46.32 Favored 'General case' 0 N--CA 1.494 1.775 0 O-C-N 121.359 -0.838 . . . . 0.0 109.787 -179.774 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 95.7 mtt180 -128.04 147.16 50.51 Favored 'General case' 0 N--CA 1.497 1.876 0 CA-C-O 121.402 0.62 . . . . 0.0 109.83 -179.716 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 80' ' ' PHE . . . . . . . . . . . . . 83.8 m-85 -127.96 148.04 50.5 Favored 'General case' 0 N--CA 1.496 1.871 0 CA-C-O 121.451 0.643 . . . . 0.0 109.568 -179.851 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 81' ' ' LYS . . . . . 0.49 ' HZ1' ' CG ' ' A' ' 30' ' ' ASP . 63.4 tttp -111.37 127.35 55.63 Favored 'General case' 0 N--CA 1.494 1.739 0 N-CA-C 109.207 -0.664 . . . . 0.0 109.207 179.94 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 82' ' ' PHE . . . . . . . . . . . . . 78.0 m-85 -122.54 145.04 48.69 Favored 'General case' 0 N--CA 1.494 1.746 0 CA-C-O 121.875 0.845 . . . . 0.0 109.649 -179.782 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 32.4 mm-40 -69.46 -32.76 71.89 Favored 'General case' 0 C--N 1.299 -1.608 0 O-C-N 121.751 -0.593 . . . . 0.0 109.638 -179.815 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 84' ' ' VAL . . . . . . . . . . . . . 3.2 m -130.61 157.28 42.98 Favored 'Isoleucine or valine' 0 N--CA 1.499 1.999 0 CA-C-O 121.915 0.864 . . . . 0.0 110.397 -179.427 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 85' ' ' SER . . . . . 0.497 ' O ' ' N ' ' A' ' 88' ' ' LYS . 38.9 t -67.63 -40.2 84.65 Favored 'General case' 0 N--CA 1.492 1.626 0 CA-C-O 121.535 0.683 . . . . 0.0 110.213 179.645 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 86' ' ' ALA . . . . . 0.423 ' C ' ' O ' ' A' ' 85' ' ' SER . . . -40.85 -44.24 2.22 Favored 'General case' 0 N--CA 1.496 1.845 0 O-C-N 121.397 -0.815 . . . . 0.0 110.356 -179.042 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 98.2 mt-10 -66.03 -30.14 70.63 Favored 'General case' 0 C--N 1.299 -1.62 0 O-C-N 121.279 -0.888 . . . . 0.0 110.08 179.895 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 88' ' ' LYS . . . . . 0.579 ' HZ3' ' CB ' ' A' ' 32' ' ' ALA . 65.0 tttp -63.38 -46.8 84.8 Favored 'General case' 0 N--CA 1.494 1.727 0 O-C-N 121.068 -1.02 . . . . 0.0 110.062 -179.904 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 89' ' ' LEU . . . . . 0.505 ' CD2' ' N ' ' A' ' 89' ' ' LEU . 3.6 mm? -63.37 -47.58 81.49 Favored 'General case' 0 N--CA 1.493 1.723 0 O-C-N 121.23 -0.919 . . . . 0.0 110.128 -179.2 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 90' ' ' ILE . . . . . 0.487 ' CD1' ' N ' ' A' ' 90' ' ' ILE . 1.3 mp -69.19 -43.69 81.3 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.636 0 O-C-N 121.271 -0.893 . . . . 0.0 109.521 179.634 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 91' ' ' PHE . . . . . . . . . . . . . 62.2 t80 -60.37 -46.41 90.04 Favored 'General case' 0 C--N 1.298 -1.651 0 O-C-N 121.456 -0.778 . . . . 0.0 109.869 -179.116 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 92' ' ' GLU . . . . . 0.495 ' OE2' ' NZ ' ' A' ' 88' ' ' LYS . 97.1 mt-10 -67.74 -37.95 82.85 Favored 'General case' 0 N--CA 1.49 1.561 0 O-C-N 121.395 -0.816 . . . . 0.0 109.998 179.903 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 93' ' ' LEU . . . . . . . . . . . . . 6.4 tt -64.05 -46.82 82.71 Favored 'General case' 0 N--CA 1.49 1.575 0 O-C-N 121.129 -0.982 . . . . 0.0 110.156 -179.708 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 94' ' ' LYS . . . . . . . . . . . . . 96.1 mttt -66.91 -45.45 77.89 Favored 'General case' 0 N--CA 1.495 1.794 0 O-C-N 121.383 -0.823 . . . . 0.0 110.2 179.996 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 21.5 p -67.44 -41.47 84.71 Favored 'General case' 0 N--CA 1.492 1.665 0 O-C-N 121.23 -0.919 . . . . 0.0 109.61 -179.698 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 96' ' ' ARG . . . . . 0.435 ' CG ' ' O ' ' A' ' 92' ' ' GLU . 8.0 mmp_? -64.38 -43.81 93.3 Favored 'General case' 0 N--CA 1.49 1.565 0 O-C-N 121.221 -0.924 . . . . 0.0 109.698 179.825 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 97' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.3 -1.55 0 CA-C-O 121.771 0.796 . . . . 0.0 109.204 179.767 . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' A' A ' 1' ' ' MET . . . . . 0.428 ' H2 ' ' H ' ' A' ' 2' ' ' SER . 96.9 mtp . . . . . 0 N--CA 1.49 1.562 0 N-CA-C 108.731 -0.841 . . . . 0.0 108.731 . . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 2' ' ' SER . . . . . 0.428 ' H ' ' H2 ' ' A' ' 1' ' ' MET . 48.2 t -63.72 143.46 57.82 Favored 'General case' 0 N--CA 1.492 1.669 0 CA-C-O 121.811 0.815 . . . . 0.0 110.326 -179.532 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 3' ' ' ASN . . . . . . . . . . . . . 3.5 m120 -64.48 -40.51 95.8 Favored 'General case' 0 N--CA 1.491 1.576 0 N-CA-C 109.462 -0.57 . . . . 0.0 109.462 -179.732 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 15.1 pt20 -82.04 142.66 32.15 Favored 'General case' 0 N--CA 1.494 1.744 0 CA-C-O 121.687 0.756 . . . . 0.0 110.31 -179.253 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 62.6 p -78.08 165.61 23.79 Favored 'General case' 0 N--CA 1.489 1.518 0 CA-C-O 121.767 0.794 . . . . 0.0 110.544 -179.449 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 2.5 p -178.75 72.14 0.02 OUTLIER 'General case' 0 N--CA 1.492 1.639 0 CA-C-O 121.533 0.682 . . . . 0.0 109.257 179.613 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 7' ' ' VAL . . . . . . . . . . . . . 24.5 m -88.68 128.97 40.53 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.866 0 CA-C-O 121.727 0.775 . . . . 0.0 109.719 179.94 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 81.2 tt0 -90.06 113.16 24.82 Favored 'General case' 0 N--CA 1.494 1.772 0 CA-C-O 121.761 0.791 . . . . 0.0 109.638 -179.617 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 59.6 t-20 -96.23 -67.4 0.85 Allowed 'General case' 0 N--CA 1.495 1.791 0 N-CA-C 109.278 -0.638 . . . . 0.0 109.278 179.857 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 97.7 mt-10 41.53 -120.9 0.49 Allowed 'General case' 0 N--CA 1.494 1.757 0 CA-C-O 121.515 0.674 . . . . 0.0 110.421 -179.695 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 35.3 m -79.87 140.83 16.16 Favored 'Isoleucine or valine' 0 C--N 1.304 -1.383 0 CA-C-O 121.876 0.846 . . . . 0.0 110.512 -179.061 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 12' ' ' CYS . . . . . 0.415 ' O ' ' O ' ' A' ' 13' ' ' GLU . 4.9 p -145.66 155.88 43.29 Favored 'General case' 0 N--CA 1.49 1.542 0 CA-C-O 121.803 0.811 . . . . 0.0 109.705 179.547 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 13' ' ' GLU . . . . . 0.415 ' O ' ' O ' ' A' ' 12' ' ' CYS . 97.7 mt-10 42.35 -167.89 0.01 OUTLIER 'General case' 0 N--CA 1.491 1.599 0 CA-C-O 121.807 0.813 . . . . 0.0 110.956 179.94 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 14' ' ' ALA . . . . . 0.507 ' O ' ' N ' ' A' ' 16' ' ' GLY . . . 62.24 133.26 0.01 OUTLIER 'General case' 0 N--CA 1.489 1.492 0 CA-C-O 121.586 0.707 . . . . 0.0 110.467 -179.906 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 34.9 m 45.32 16.64 0.02 OUTLIER 'General case' 0 N--CA 1.491 1.591 0 CA-C-O 121.432 0.634 . . . . 0.0 109.531 -179.963 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 16' ' ' GLY . . . . . 0.507 ' N ' ' O ' ' A' ' 14' ' ' ALA . . . -84.41 -3.7 88.39 Favored Glycine 0 N--CA 1.493 2.461 0 N-CA-C 109.343 -1.503 . . . . 0.0 109.343 -179.931 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 37.8 m 44.45 25.92 0.15 Allowed 'General case' 0 N--CA 1.493 1.722 0 O-C-N 121.9 -0.765 . . . . 0.0 109.674 -179.87 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -65.0 99.95 0.39 Allowed 'General case' 0 N--CA 1.49 1.538 0 CA-C-O 121.727 0.775 . . . . 0.0 109.947 -179.968 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 79.8 175.81 48.52 Favored Glycine 0 N--CA 1.49 2.249 0 N-CA-C 110.739 -0.944 . . . . 0.0 110.739 179.02 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 49.0 tp10 -155.79 -34.63 0.09 Allowed 'General case' 0 N--CA 1.49 1.533 0 N-CA-C 108.778 -0.823 . . . . 0.0 108.778 179.654 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 21' ' ' ILE . . . . . . . . . . . . . 38.1 pt -87.35 139.56 17.15 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.95 0 CA-C-O 121.93 0.871 . . . . 0.0 110.521 -179.491 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . -84.81 129.52 9.28 Favored Glycine 0 N--CA 1.489 2.182 0 N-CA-C 110.164 -1.174 . . . . 0.0 110.164 -179.379 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 23' ' ' PHE . . . . . . . . . . . . . 92.4 t80 -148.01 -33.36 0.25 Allowed 'General case' 0 N--CA 1.493 1.696 0 O-C-N 121.846 -0.796 . . . . 0.0 109.077 179.544 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 8.9 pt -80.27 164.03 3.25 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.81 0 CA-C-O 121.748 0.785 . . . . 0.0 110.774 -179.652 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 25' ' ' ILE . . . . . . . . . . . . . 96.2 mt -72.88 132.96 32.68 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.337 0 CA-C-O 121.733 0.778 . . . . 0.0 110.421 -179.248 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 71.4 ttp85 -55.19 132.22 47.12 Favored 'General case' 0 N--CA 1.49 1.534 0 CA-C-O 121.817 0.817 . . . . 0.0 110.272 -179.33 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 16.7 pt-20 -67.2 144.05 56.2 Favored 'General case' 0 N--CA 1.49 1.551 0 CA-C-O 121.762 0.791 . . . . 0.0 110.357 -179.478 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . -177.19 175.65 47.73 Favored Glycine 0 N--CA 1.489 2.2 0 N-CA-C 110.147 -1.181 . . . . 0.0 110.147 179.856 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 37.1 p-10 -68.15 -21.02 64.93 Favored 'General case' 0 N--CA 1.49 1.571 0 O-C-N 121.806 -0.82 . . . . 0.0 109.572 -179.748 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 83.3 m-20 -90.37 9.05 30.47 Favored 'General case' 0 N--CA 1.494 1.76 0 O-C-N 121.505 -0.747 . . . . 0.0 109.005 179.83 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 51.3 t -124.8 136.1 61.83 Favored 'Isoleucine or valine' 0 N--CA 1.499 2.016 0 CA-C-O 121.728 0.775 . . . . 0.0 109.712 179.886 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -123.9 148.1 47.12 Favored 'General case' 0 N--CA 1.496 1.861 0 CA-C-O 121.86 0.838 . . . . 0.0 109.913 -179.961 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 96.7 mt-10 -104.42 142.01 35.33 Favored 'General case' 0 N--CA 1.496 1.85 0 CA-C-O 121.737 0.78 . . . . 0.0 109.984 -179.702 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 34' ' ' VAL . . . . . . . . . . . . . 55.5 t -125.89 132.84 70.24 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.769 0 CA-C-O 121.638 0.732 . . . . 0.0 109.331 -179.967 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 45.5 t -126.24 110.73 13.76 Favored 'General case' 0 N--CA 1.494 1.761 0 CA-C-O 121.678 0.752 . . . . 0.0 109.61 179.778 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 51.4 tp -121.98 146.64 46.96 Favored 'General case' 0 N--CA 1.497 1.886 0 CA-C-O 121.818 0.818 . . . . 0.0 109.512 179.827 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 37' ' ' PHE . . . . . . . . . . . . . 41.7 p90 -141.87 155.77 45.53 Favored 'General case' 0 N--CA 1.492 1.648 0 CA-C-O 121.781 0.801 . . . . 0.0 110.293 -179.714 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . -166.66 -155.41 8.94 Favored Glycine 0 N--CA 1.491 2.312 0 N-CA-C 110.482 -1.047 . . . . 0.0 110.482 -179.579 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 39' ' ' SER . . . . . 0.491 ' OG ' ' CG ' ' A' ' 43' ' ' HIS . 74.3 p -63.24 -41.88 99.13 Favored 'General case' 0 N--CA 1.496 1.862 0 O-C-N 122.027 -0.69 . . . . 0.0 110.129 -179.103 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 40' ' ' ASP . . . . . . . . . . . . . 53.3 p-10 -171.62 -168.18 0.58 Allowed 'General case' 0 N--CA 1.491 1.586 0 CA-C-O 121.788 0.804 . . . . 0.0 110.01 179.769 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 41' ' ' LYS . . . . . 0.552 ' HZ2' ' CG ' ' A' ' 45' ' ' GLU . 28.3 tptp -62.43 -45.55 92.59 Favored 'General case' 0 C--N 1.303 -1.452 0 O-C-N 121.727 -0.608 . . . . 0.0 110.09 -179.265 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -50.41 -51.57 45.23 Favored 'General case' 0 N--CA 1.494 1.773 0 O-C-N 121.68 -0.637 . . . . 0.0 110.533 -178.358 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 43' ' ' HIS . . . . . 0.491 ' CG ' ' OG ' ' A' ' 39' ' ' SER . 23.0 m-70 -67.01 -37.35 84.01 Favored 'General case' 0 N--CA 1.495 1.782 0 O-C-N 121.441 -0.787 . . . . 0.0 110.115 -179.242 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 18.0 mt -63.58 -40.3 96.6 Favored 'General case' 0 N--CA 1.493 1.702 0 O-C-N 121.358 -0.839 . . . . 0.0 109.427 -179.467 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 45' ' ' GLU . . . . . 0.552 ' CG ' ' HZ2' ' A' ' 41' ' ' LYS . 96.0 mt-10 -61.56 -42.21 98.5 Favored 'General case' 0 N--CA 1.489 1.511 0 N-CA-C 109.036 -0.727 . . . . 0.0 109.036 -179.857 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . -64.55 -48.08 77.04 Favored Glycine 0 N--CA 1.494 2.542 0 N-CA-C 109.584 -1.406 . . . . 0.0 109.584 179.931 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 63.0 mttp -66.97 -33.9 76.59 Favored 'General case' 0 N--CA 1.493 1.698 0 O-C-N 121.712 -0.876 . . . . 0.0 108.995 179.641 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 58.7 tp -59.46 -40.23 86.21 Favored 'General case' 0 C--N 1.303 -1.423 0 N-CA-C 109.503 -0.555 . . . . 0.0 109.503 -178.965 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 49' ' ' ALA . . . . . . . . . . . . . . . -55.97 -39.97 72.56 Favored 'General case' 0 N--CA 1.491 1.618 0 O-C-N 121.563 -0.71 . . . . 0.0 109.23 -179.468 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 97.8 mt-10 -68.33 -39.75 81.83 Favored 'General case' 0 N--CA 1.492 1.659 0 O-C-N 121.62 -0.675 . . . . 0.0 109.419 179.791 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 51' ' ' TYR . . . . . 0.576 ' CE2' ' CG2' ' A' ' 95' ' ' THR . 4.3 m-85 -59.13 -40.69 86.24 Favored 'General case' 0 N--CA 1.494 1.763 0 O-C-N 121.536 -0.727 . . . . 0.0 109.145 -179.432 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 52' ' ' ILE . . . . . 0.557 ' CG2' ' HZ3' ' A' ' 56' ' ' LYS . 95.5 mt -63.98 -42.52 96.01 Favored 'Isoleucine or valine' 0 C--N 1.301 -1.518 0 N-CA-C 109.134 -0.691 . . . . 0.0 109.134 -179.844 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 49.4 m -53.23 -45.99 68.94 Favored 'General case' 0 N--CA 1.493 1.695 0 O-C-N 121.714 -0.616 . . . . 0.0 109.463 -179.0 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 54' ' ' LEU . . . . . 0.407 ' N ' ' CD2' ' A' ' 54' ' ' LEU . 4.0 mm? -64.73 -39.81 94.26 Favored 'General case' 0 C--N 1.3 -1.556 0 O-C-N 121.763 -0.586 . . . . 0.0 109.453 179.168 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -59.13 -49.48 77.73 Favored 'General case' 0 N--CA 1.49 1.573 0 CA-C-O 121.202 0.525 . . . . 0.0 109.769 -179.019 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 56' ' ' LYS . . . . . 0.557 ' HZ3' ' CG2' ' A' ' 52' ' ' ILE . 62.2 mttp -64.6 -39.66 94.11 Favored 'General case' 0 N--CA 1.49 1.564 0 O-C-N 121.6 -0.688 . . . . 0.0 109.359 179.715 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 51.5 tt0 -62.15 -49.19 76.85 Favored 'General case' 0 N--CA 1.489 1.494 0 O-C-N 121.73 -0.606 . . . . 0.0 109.375 -179.433 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 58' ' ' VAL . . . . . . . . . . . . . 72.8 t -66.49 -44.45 90.34 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.587 0 O-C-N 121.761 -0.587 . . . . 0.0 109.795 -179.731 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 59' ' ' TYR . . . . . . . . . . . . . 51.3 t80 -135.75 125.19 24.96 Favored 'General case' 0 N--CA 1.498 1.946 0 CA-C-O 121.918 0.866 . . . . 0.0 110.024 -179.421 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -71.45 144.77 49.61 Favored 'General case' 0 N--CA 1.492 1.629 0 CA-C-O 121.57 0.7 . . . . 0.0 110.73 -179.588 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 61' ' ' ASN . . . . . . . . . . . . . 10.7 m120 57.29 37.44 28.18 Favored 'General case' 0 N--CA 1.493 1.702 0 CA-C-O 121.544 0.688 . . . . 0.0 109.156 179.603 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 62' ' ' VAL . . . . . . . . . . . . . 10.3 p -67.63 138.73 22.13 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.509 0 CA-C-O 121.709 0.766 . . . . 0.0 110.194 -179.643 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 97.3 mt-10 -108.91 142.74 39.09 Favored 'General case' 0 N--CA 1.495 1.813 0 CA-C-O 121.726 0.774 . . . . 0.0 109.671 -179.466 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 64' ' ' TYR . . . . . . . . . . . . . 49.9 p90 -151.22 161.91 41.86 Favored 'General case' 0 N--CA 1.492 1.639 0 CA-C-O 121.936 0.874 . . . . 0.0 110.486 -179.993 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 80.5 tt0 -144.24 145.55 32.12 Favored 'General case' 0 N--CA 1.493 1.721 0 CA-C-O 121.511 0.672 . . . . 0.0 109.426 179.959 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 66' ' ' VAL . . . . . . . . . . . . . 30.8 m -120.71 129.99 75.04 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.903 0 CA-C-O 121.999 0.904 . . . . 0.0 110.266 -179.646 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -78.57 170.74 14.82 Favored Pre-proline 0 C--N 1.301 -1.501 0 CA-C-N 115.976 -0.556 . . . . 0.0 109.506 179.925 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 68' ' ' PRO . . . . . . . . . . . . . 46.7 Cg_exo -54.58 134.11 60.29 Favored 'Trans proline' 0 N--CA 1.496 1.621 0 C-N-CA 122.578 2.186 . . . . 0.0 113.276 179.752 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 69' ' ' VAL . . . . . . . . . . . . . 64.9 t -134.76 132.85 54.21 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.939 0 CA-C-O 121.661 0.743 . . . . 0.0 109.93 179.445 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -82.37 163.7 21.54 Favored 'General case' 0 N--CA 1.49 1.569 0 CA-C-O 121.619 0.723 . . . . 0.0 109.516 179.343 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 49.8 t0 -64.92 -40.69 95.44 Favored 'General case' 0 N--CA 1.489 1.486 0 O-C-N 121.721 -0.612 . . . . 0.0 109.645 -179.53 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 72' ' ' ASN . . . . . . . . . . . . . 95.0 m-20 -97.87 21.81 10.08 Favored 'General case' 0 N--CA 1.495 1.819 0 N-CA-C 108.97 -0.752 . . . . 0.0 108.97 -179.586 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 73' ' ' ALA . . . . . 0.489 ' C ' ' H ' ' A' ' 75' ' ' GLU . . . -62.36 -36.55 82.59 Favored 'General case' 0 N--CA 1.494 1.767 0 O-C-N 121.649 -0.657 . . . . 0.0 109.411 -179.826 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 74' ' ' THR . . . . . . . . . . . . . 2.0 m 67.78 -6.37 0.71 Allowed 'General case' 0 N--CA 1.491 1.606 0 N-CA-C 109.432 -0.581 . . . . 0.0 109.432 -179.965 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 75' ' ' GLU . . . . . 0.498 ' OE1' ' CE1' ' A' ' 77' ' ' HIS . 2.9 pp20? -137.85 145.98 42.88 Favored 'General case' 0 N--CA 1.495 1.82 0 CA-C-O 121.93 0.872 . . . . 0.0 110.336 -179.873 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 2.0 tp -121.06 128.92 53.08 Favored 'General case' 0 N--CA 1.49 1.56 0 CA-C-O 121.586 0.708 . . . . 0.0 109.451 -179.928 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 77' ' ' HIS . . . . . 0.498 ' CE1' ' OE1' ' A' ' 75' ' ' GLU . 30.6 m80 -106.09 114.48 28.65 Favored 'General case' 0 N--CA 1.495 1.788 0 CA-C-O 121.672 0.749 . . . . 0.0 109.213 179.913 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -135.07 154.62 51.63 Favored 'General case' 0 N--CA 1.495 1.78 0 CA-C-O 121.899 0.857 . . . . 0.0 110.227 -179.675 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 94.6 mtt-85 -129.46 146.22 51.33 Favored 'General case' 0 N--CA 1.496 1.829 0 CA-C-O 121.536 0.684 . . . . 0.0 109.585 -179.956 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 80' ' ' PHE . . . . . . . . . . . . . 67.9 m-85 -126.34 144.49 50.79 Favored 'General case' 0 N--CA 1.498 1.942 0 CA-C-O 121.803 0.811 . . . . 0.0 109.965 -179.876 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 21.6 ttpp -115.17 121.46 43.06 Favored 'General case' 0 N--CA 1.494 1.746 0 CA-C-O 121.719 0.771 . . . . 0.0 109.565 -179.792 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 82' ' ' PHE . . . . . . . . . . . . . 83.5 m-85 -115.32 -129.42 0.3 Allowed 'General case' 0 N--CA 1.496 1.859 0 CA-C-O 121.532 0.682 . . . . 0.0 109.613 -179.876 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 78.8 tt0 -140.46 -33.29 0.56 Allowed 'General case' 0 N--CA 1.493 1.71 0 N-CA-C 108.841 -0.8 . . . . 0.0 108.841 -179.54 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 84' ' ' VAL . . . . . . . . . . . . . 27.5 m -135.79 159.8 39.49 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.894 0 CA-C-O 121.891 0.853 . . . . 0.0 109.852 179.953 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 38.0 m -63.37 -34.92 78.76 Favored 'General case' 0 N--CA 1.49 1.536 0 CA-C-O 121.319 0.58 . . . . 0.0 109.907 -179.567 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 86' ' ' ALA . . . . . . . . . . . . . . . -50.22 -45.94 54.28 Favored 'General case' 0 N--CA 1.491 1.577 0 O-C-N 121.526 -0.734 . . . . 0.0 109.676 -178.911 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 87' ' ' GLU . . . . . 0.56 ' OE1' ' N ' ' A' ' 87' ' ' GLU . 0.0 OUTLIER -52.12 -37.81 55.46 Favored 'General case' 0 N--CA 1.493 1.695 0 O-C-N 121.56 -0.712 . . . . 0.0 109.654 -179.103 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 88' ' ' LYS . . . . . . . . . . . . . 88.7 tttt -64.13 -46.1 85.61 Favored 'General case' 0 N--CA 1.49 1.527 0 O-C-N 121.675 -0.64 . . . . 0.0 109.526 -179.609 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 89' ' ' LEU . . . . . 0.496 ' CD2' ' N ' ' A' ' 89' ' ' LEU . 4.0 mm? -63.94 -45.31 89.74 Favored 'General case' 0 N--CA 1.492 1.664 0 O-C-N 121.651 -0.655 . . . . 0.0 110.427 -179.252 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 90' ' ' ILE . . . . . . . . . . . . . 37.1 mm -70.2 -45.28 76.38 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.665 0 O-C-N 121.773 -0.58 . . . . 0.0 109.684 -179.641 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 91' ' ' PHE . . . . . . . . . . . . . 83.9 t80 -64.51 -45.33 87.69 Favored 'General case' 0 N--CA 1.492 1.66 0 O-C-N 121.648 -0.658 . . . . 0.0 109.896 179.84 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 92' ' ' GLU . . . . . . . . . . . . . 46.5 tp10 -66.48 -38.0 86.33 Favored 'General case' 0 N--CA 1.491 1.595 0 O-C-N 121.726 -0.609 . . . . 0.0 109.533 -178.949 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 93' ' ' LEU . . . . . . . . . . . . . 5.5 tt -62.68 -49.17 76.17 Favored 'General case' 0 C--N 1.303 -1.44 0 O-C-N 121.572 -0.705 . . . . 0.0 109.952 -179.301 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 94' ' ' LYS . . . . . . . . . . . . . 49.6 mtmt -69.67 -40.96 76.11 Favored 'General case' 0 N--CA 1.49 1.551 0 O-C-N 121.647 -0.658 . . . . 0.0 109.746 -179.87 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 95' ' ' THR . . . . . 0.576 ' CG2' ' CE2' ' A' ' 51' ' ' TYR . 98.9 m -61.61 -46.9 87.85 Favored 'General case' 0 N--CA 1.491 1.621 0 O-C-N 121.657 -0.652 . . . . 0.0 109.594 -178.917 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 96' ' ' ARG . . . . . . . . . . . . . 78.8 mtp85 -65.8 -40.36 91.83 Favored 'General case' 0 N--CA 1.492 1.669 0 O-C-N 121.687 -0.633 . . . . 0.0 109.338 179.67 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 97' ' ' ALA . . . . . 0.479 ' O ' ' N ' ' A' ' 101' ' ' LEU . . . -64.66 -36.27 83.72 Favored 'General case' 0 N--CA 1.489 1.484 0 N-CA-C 109.023 -0.732 . . . . 0.0 109.023 -179.813 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 98' ' ' LEU . . . . . . . . . . . . . 3.6 tt -62.13 -47.83 82.82 Favored 'General case' 0 N--CA 1.488 1.427 0 CA-C-O 121.489 0.661 . . . . 0.0 109.238 -179.342 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 99' ' ' ALA . . . . . . . . . . . . . . . -74.89 -40.92 60.65 Favored 'General case' 0 N--CA 1.491 1.618 0 O-C-N 121.562 -0.711 . . . . 0.0 109.856 -179.749 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 100' ' ' ARG . . . . . 0.409 ' O ' ' C ' ' A' ' 101' ' ' LEU . 83.4 mmt-85 -80.52 -10.15 59.75 Favored 'General case' 0 N--CA 1.491 1.583 0 N-CA-C 109.273 -0.64 . . . . 0.0 109.273 -179.158 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 101' ' ' LEU . . . . . 0.479 ' N ' ' O ' ' A' ' 97' ' ' ALA . 90.5 mt 40.35 59.71 1.99 Allowed 'General case' 0 N--CA 1.493 1.717 0 CA-C-O 121.438 0.637 . . . . 0.0 109.879 -179.914 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 102' ' ' GLU . . . . . . . . . . . . . 18.0 pt-20 -90.16 -5.34 56.57 Favored 'General case' 0 N--CA 1.492 1.674 0 N-CA-C 108.966 -0.754 . . . . 0.0 108.966 179.975 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 103' ' ' HIS . . . . . . . . . . . . . 78.2 t60 -77.29 136.4 38.49 Favored 'General case' 0 N--CA 1.493 1.697 0 CA-C-O 121.735 0.779 . . . . 0.0 110.125 -179.479 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 104' ' ' HIS . . . . . 0.598 ' NE2' ' CD2' ' A' ' 105' ' ' HIS . 71.6 t60 59.73 168.91 0.07 Allowed 'General case' 0 N--CA 1.49 1.532 0 CA-C-O 121.633 0.73 . . . . 0.0 110.308 179.664 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 105' ' ' HIS . . . . . 0.598 ' CD2' ' NE2' ' A' ' 104' ' ' HIS . 34.3 p80 -84.75 -147.86 0.1 Allowed 'General case' 0 N--CA 1.489 1.511 0 CA-C-O 121.473 0.654 . . . . 0.0 109.932 -179.452 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 106' ' ' HIS . . . . . 0.63 ' CD2' ' H ' ' A' ' 108' ' ' HIS . 81.8 t60 -63.71 158.5 21.43 Favored 'General case' 0 N--CA 1.49 1.558 0 CA-C-O 121.889 0.852 . . . . 0.0 111.049 -178.668 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 107' ' ' HIS . . . . . 0.409 ' N ' ' CG ' ' A' ' 106' ' ' HIS . 73.2 m80 -61.47 -45.7 93.17 Favored 'General case' 0 N--CA 1.487 1.407 0 N-CA-C 109.243 -0.651 . . . . 0.0 109.243 -179.778 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 108' ' ' HIS . . . . . 0.63 ' H ' ' CD2' ' A' ' 106' ' ' HIS . 74.1 m80 . . . . . 0 N--CA 1.496 1.868 0 CA-C-O 118.253 -0.88 . . . . 0.0 109.52 -179.787 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 1' ' ' MET . . . . . 0.493 ' N ' ' SD ' ' A' ' 1' ' ' MET . 4.0 mpp? . . . . . 0 N--CA 1.488 1.432 0 N-CA-C 108.607 -0.886 . . . . 0.0 108.607 . . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 2' ' ' SER . . . . . 0.413 ' O ' ' OD1' ' A' ' 3' ' ' ASN . 46.3 t -140.93 150.34 43.01 Favored 'General case' 0 N--CA 1.495 1.822 0 O-C-N 121.326 -0.859 . . . . 0.0 109.809 -179.96 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 3' ' ' ASN . . . . . 0.413 ' OD1' ' O ' ' A' ' 2' ' ' SER . 7.1 p-10 44.08 46.41 7.14 Favored 'General case' 0 N--CA 1.495 1.784 0 CA-C-O 121.659 0.742 . . . . 0.0 109.693 -179.905 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 14.0 pt20 -71.35 138.85 49.55 Favored 'General case' 0 N--CA 1.492 1.642 0 CA-C-O 121.847 0.832 . . . . 0.0 110.265 -179.865 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 5' ' ' THR . . . . . 0.513 ' O ' ' SG ' ' A' ' 6' ' ' CYS . 2.8 p -84.67 -169.23 2.53 Favored 'General case' 0 N--CA 1.49 1.547 0 CA-C-O 121.639 0.733 . . . . 0.0 110.345 -179.414 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 6' ' ' CYS . . . . . 0.513 ' SG ' ' O ' ' A' ' 5' ' ' THR . 20.7 p 38.83 93.86 0.01 OUTLIER 'General case' 0 N--CA 1.495 1.79 0 CA-C-O 121.88 0.848 . . . . 0.0 110.365 179.975 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 7' ' ' VAL . . . . . . . . . . . . . 7.3 p -80.16 128.79 38.38 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.451 0 CA-C-O 121.853 0.835 . . . . 0.0 109.99 -179.526 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 97.1 mt-10 -88.55 -8.18 55.21 Favored 'General case' 0 N--CA 1.495 1.781 0 O-C-N 121.408 -0.807 . . . . 0.0 109.404 179.987 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 49.5 t30 -150.69 107.23 3.5 Favored 'General case' 0 N--CA 1.496 1.846 0 O-C-N 120.966 -1.084 . . . . 0.0 109.484 -179.977 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 17.3 pt-20 -57.2 -157.6 0.0 OUTLIER 'General case' 0 N--CA 1.495 1.797 0 CA-C-O 121.829 0.823 . . . . 0.0 111.116 -179.219 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 7.7 p -64.67 136.26 26.86 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.626 0 CA-C-O 121.934 0.873 . . . . 0.0 110.75 -179.204 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 12' ' ' CYS . . . . . 0.564 ' O ' ' N ' ' A' ' 14' ' ' ALA . 0.7 OUTLIER -60.86 -50.65 72.57 Favored 'General case' 0 N--CA 1.492 1.65 0 O-C-N 121.655 -0.653 . . . . 0.0 110.148 -179.802 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 13' ' ' GLU . . . . . 0.421 ' C ' ' O ' ' A' ' 12' ' ' CYS . 84.6 tt0 36.44 -89.01 0.01 OUTLIER 'General case' 0 N--CA 1.499 2.013 0 CA-C-O 121.726 0.774 . . . . 0.0 110.845 -179.418 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 14' ' ' ALA . . . . . 0.564 ' N ' ' O ' ' A' ' 12' ' ' CYS . . . -72.23 -178.58 2.53 Favored 'General case' 0 C--N 1.302 -1.477 0 CA-C-O 121.972 0.891 . . . . 0.0 110.793 -179.242 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 86.9 m -62.34 -38.1 88.19 Favored 'General case' 0 N--CA 1.489 1.513 0 CA-C-O 121.561 0.696 . . . . 0.0 109.284 179.835 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 78.19 0.01 75.55 Favored Glycine 0 N--CA 1.491 2.345 0 N-CA-C 109.404 -1.478 . . . . 0.0 109.404 -179.845 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 21.8 p -156.23 155.74 32.91 Favored 'General case' 0 N--CA 1.491 1.584 0 O-C-N 121.178 -1.189 . . . . 0.0 109.968 -179.94 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . 40.8 -161.48 0.01 OUTLIER 'General case' 0 N--CA 1.496 1.836 0 CA-C-O 121.812 0.815 . . . . 0.0 111.176 179.554 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 154.02 -69.28 0.3 Allowed Glycine 0 N--CA 1.492 2.396 0 N-CA-C 109.144 -1.582 . . . . 0.0 109.144 -179.298 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 68.3 tt0 44.25 -122.31 0.85 Allowed 'General case' 0 N--CA 1.495 1.808 0 O-C-N 121.565 -0.962 . . . . 0.0 109.851 179.901 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 21' ' ' ILE . . . . . . . . . . . . . 93.2 mt -107.43 -29.31 2.64 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.531 0 N-CA-C 108.711 -0.848 . . . . 0.0 108.711 179.893 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 157.57 -156.81 27.61 Favored Glycine 0 N--CA 1.493 2.434 0 C-N-CA 119.453 -1.356 . . . . 0.0 110.515 179.838 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 23' ' ' PHE . . . . . . . . . . . . . 61.2 m-85 -79.32 136.38 37.0 Favored 'General case' 0 N--CA 1.491 1.612 0 O-C-N 121.447 -1.031 . . . . 0.0 110.373 -179.289 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 24' ' ' ILE . . . . . 0.453 ' O ' ' C ' ' A' ' 25' ' ' ILE . 12.3 tt -87.49 170.24 1.29 Allowed 'Isoleucine or valine' 0 N--CA 1.492 1.647 0 O-C-N 121.529 -0.732 . . . . 0.0 109.645 179.899 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 25' ' ' ILE . . . . . 0.453 ' C ' ' O ' ' A' ' 24' ' ' ILE . 20.4 pt 33.5 69.03 0.06 OUTLIER 'Isoleucine or valine' 0 N--CA 1.501 2.086 0 CA-C-O 122.243 1.02 . . . . 0.0 110.276 -179.839 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 26' ' ' ARG . . . . . 0.443 ' O ' ' O ' ' A' ' 25' ' ' ILE . 17.5 ptm180 -48.61 179.25 0.0 OUTLIER 'General case' 0 C--N 1.301 -1.519 0 CA-C-O 122.008 0.909 . . . . 0.0 110.776 -179.09 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 27' ' ' GLU . . . . . 0.501 ' OE1' ' N ' ' A' ' 27' ' ' GLU . 58.5 mp0 -73.57 60.73 0.68 Allowed 'General case' 0 N--CA 1.488 1.444 0 CA-C-O 121.818 0.818 . . . . 0.0 109.502 -179.578 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . -80.49 172.01 54.33 Favored Glycine 0 N--CA 1.488 2.158 0 N-CA-C 110.498 -1.041 . . . . 0.0 110.498 -179.895 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 98.9 m-20 -70.84 -10.95 60.6 Favored 'General case' 0 N--CA 1.492 1.64 0 O-C-N 121.592 -0.946 . . . . 0.0 109.574 179.632 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 30' ' ' ASP . . . . . 0.458 ' N ' ' OD1' ' A' ' 30' ' ' ASP . 29.3 p-10 -92.04 9.82 31.7 Favored 'General case' 0 N--CA 1.493 1.701 0 O-C-N 121.087 -1.008 . . . . 0.0 108.945 179.782 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 17.2 t -117.21 161.24 16.14 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.97 0 O-C-N 121.551 -0.718 . . . . 0.0 109.658 -179.78 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -135.92 151.61 50.15 Favored 'General case' 0 N--CA 1.492 1.63 0 O-C-N 121.514 -0.741 . . . . 0.0 109.436 -179.652 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 33' ' ' GLU . . . . . 0.496 ' OE1' ' NE2' ' A' ' 77' ' ' HIS . 80.4 mm-40 -100.2 142.7 31.32 Favored 'General case' 0 N--CA 1.493 1.71 0 CA-C-O 121.877 0.846 . . . . 0.0 110.035 -179.597 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 34' ' ' VAL . . . . . . . . . . . . . 52.3 t -128.87 135.48 62.11 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.802 0 CA-C-O 121.629 0.728 . . . . 0.0 109.146 -179.915 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 79.8 p -142.4 120.87 12.43 Favored 'General case' 0 N--CA 1.492 1.638 0 O-C-N 121.258 -0.901 . . . . 0.0 109.05 179.779 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 51.0 tp -122.38 136.27 54.86 Favored 'General case' 0 N--CA 1.497 1.887 0 CA-C-O 121.449 0.642 . . . . 0.0 109.587 -179.9 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 37' ' ' PHE . . . . . . . . . . . . . 91.0 t80 -108.48 131.01 55.23 Favored 'General case' 0 N--CA 1.495 1.787 0 CA-C-O 121.61 0.719 . . . . 0.0 109.468 -179.997 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . -172.09 -159.18 17.9 Favored Glycine 0 N--CA 1.488 2.16 0 N-CA-C 109.951 -1.26 . . . . 0.0 109.951 -179.639 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 39' ' ' SER . . . . . 0.449 ' OG ' ' N ' ' A' ' 40' ' ' ASP . 39.7 t -75.78 -146.94 0.03 OUTLIER 'General case' 0 N--CA 1.494 1.771 0 O-C-N 121.645 -0.914 . . . . 0.0 111.042 -179.061 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 40' ' ' ASP . . . . . 0.449 ' N ' ' OG ' ' A' ' 39' ' ' SER . 97.9 m-20 -52.07 175.98 0.02 OUTLIER 'General case' 0 N--CA 1.493 1.706 0 CA-C-O 122.162 0.982 . . . . 0.0 111.24 -178.696 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 38.0 ttmt -62.29 -42.82 99.68 Favored 'General case' 0 N--CA 1.491 1.577 0 O-C-N 121.633 -0.667 . . . . 0.0 109.575 179.608 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -53.46 -44.7 69.13 Favored 'General case' 0 N--CA 1.492 1.63 0 O-C-N 121.337 -0.852 . . . . 0.0 109.569 -179.558 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 43' ' ' HIS . . . . . . . . . . . . . 86.6 t60 -63.17 -43.36 98.49 Favored 'General case' 0 N--CA 1.493 1.694 0 O-C-N 121.277 -0.89 . . . . 0.0 109.62 179.892 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 97.5 mt -64.43 -39.88 94.68 Favored 'General case' 0 N--CA 1.493 1.723 0 O-C-N 121.413 -0.804 . . . . 0.0 109.713 -179.871 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 96.1 mt-10 -60.73 -38.55 85.5 Favored 'General case' 0 N--CA 1.491 1.603 0 O-C-N 121.203 -0.936 . . . . 0.0 109.833 -179.719 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . -62.34 -52.06 52.03 Favored Glycine 0 N--CA 1.494 2.507 0 N-CA-C 109.698 -1.361 . . . . 0.0 109.698 179.951 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 97.3 mttt -67.59 -37.21 82.25 Favored 'General case' 0 N--CA 1.492 1.644 0 O-C-N 121.32 -1.106 . . . . 0.0 109.739 179.157 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 48' ' ' LEU . . . . . 0.5 ' O ' ' N ' ' A' ' 51' ' ' TYR . 20.7 tp -61.62 -40.13 93.74 Favored 'General case' 0 C--N 1.299 -1.595 0 O-C-N 121.532 -0.73 . . . . 0.0 109.427 -179.177 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 49' ' ' ALA . . . . . 0.426 ' C ' ' O ' ' A' ' 48' ' ' LEU . . . -40.44 -33.24 0.24 Allowed 'General case' 0 N--CA 1.497 1.91 0 CA-C-O 121.617 0.723 . . . . 0.0 109.955 -179.588 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 72.8 mm-40 -68.69 -38.53 80.38 Favored 'General case' 0 N--CA 1.491 1.608 0 O-C-N 121.32 -0.862 . . . . 0.0 109.658 179.513 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 51' ' ' TYR . . . . . 0.5 ' N ' ' O ' ' A' ' 48' ' ' LEU . 21.3 m-85 -62.04 -45.31 94.11 Favored 'General case' 0 N--CA 1.494 1.74 0 O-C-N 121.224 -0.923 . . . . 0.0 109.79 -179.761 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 52' ' ' ILE . . . . . . . . . . . . . 97.2 mt -65.24 -44.16 95.17 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.658 0 O-C-N 121.347 -0.845 . . . . 0.0 109.857 -179.658 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 68.9 m -62.52 -45.02 94.9 Favored 'General case' 0 N--CA 1.494 1.729 0 O-C-N 121.163 -0.96 . . . . 0.0 109.713 -179.642 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 54' ' ' LEU . . . . . . . . . . . . . 88.2 mt -65.87 -39.38 90.66 Favored 'General case' 0 N--CA 1.492 1.646 0 O-C-N 121.371 -0.831 . . . . 0.0 109.784 179.883 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -61.37 -38.82 88.37 Favored 'General case' 0 N--CA 1.49 1.565 0 O-C-N 121.352 -0.842 . . . . 0.0 109.666 -179.522 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 56' ' ' LYS . . . . . . . . . . . . . 56.6 mtpt -64.43 -42.53 95.96 Favored 'General case' 0 N--CA 1.491 1.599 0 O-C-N 121.246 -0.909 . . . . 0.0 109.565 179.68 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 19.3 mm100 -68.54 -41.8 79.32 Favored 'General case' 0 N--CA 1.49 1.532 0 O-C-N 121.286 -0.884 . . . . 0.0 109.521 -179.897 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 58' ' ' VAL . . . . . . . . . . . . . 75.0 t -64.76 -45.57 94.74 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.638 0 O-C-N 121.285 -0.884 . . . . 0.0 109.755 179.809 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 59' ' ' TYR . . . . . . . . . . . . . 51.2 t80 -135.09 121.69 20.7 Favored 'General case' 0 N--CA 1.497 1.909 0 O-C-N 121.339 -0.85 . . . . 0.0 109.77 -179.588 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -68.04 144.51 55.08 Favored 'General case' 0 N--CA 1.492 1.673 0 CA-C-O 121.645 0.736 . . . . 0.0 110.764 -179.585 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 61' ' ' ASN . . . . . . . . . . . . . 55.9 t-20 57.75 41.33 25.3 Favored 'General case' 0 N--CA 1.489 1.508 0 CA-C-O 121.906 0.86 . . . . 0.0 108.98 179.659 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 62' ' ' VAL . . . . . . . . . . . . . 7.4 p -70.76 138.66 21.4 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.516 0 CA-C-O 121.772 0.796 . . . . 0.0 110.321 -179.67 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 97.1 mt-10 -111.19 136.74 49.82 Favored 'General case' 0 N--CA 1.494 1.749 0 CA-C-O 121.611 0.719 . . . . 0.0 109.466 -179.849 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 64' ' ' TYR . . . . . . . . . . . . . 52.4 p90 -147.6 161.3 41.41 Favored 'General case' 0 N--CA 1.489 1.485 0 O-C-N 121.432 -0.792 . . . . 0.0 109.767 -179.549 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 83.1 tt0 -144.56 150.16 37.04 Favored 'General case' 0 N--CA 1.49 1.57 0 N-CA-C 108.935 -0.765 . . . . 0.0 108.935 -179.992 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 66' ' ' VAL . . . . . . . . . . . . . 57.3 t -111.48 129.67 66.4 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.89 0 CA-C-O 121.752 0.787 . . . . 0.0 109.83 -179.705 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -79.45 170.54 15.59 Favored Pre-proline 0 N--CA 1.486 1.369 0 O-C-N 121.698 -0.626 . . . . 0.0 109.589 -179.487 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 68' ' ' PRO . . . . . . . . . . . . . 51.3 Cg_exo -54.72 119.11 5.91 Favored 'Trans proline' 0 N--CA 1.496 1.651 0 C-N-CA 122.412 2.075 . . . . 0.0 112.448 179.64 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 69' ' ' VAL . . . . . . . . . . . . . 74.7 t -131.98 133.28 61.01 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.946 0 O-C-N 121.469 -0.769 . . . . 0.0 109.653 179.634 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -78.61 158.07 28.55 Favored 'General case' 0 N--CA 1.493 1.684 0 CA-C-O 121.757 0.789 . . . . 0.0 110.253 179.869 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 56.6 m-20 -64.09 -37.04 85.99 Favored 'General case' 0 N--CA 1.493 1.684 0 O-C-N 121.58 -0.7 . . . . 0.0 109.39 -179.807 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 72' ' ' ASN . . . . . . . . . . . . . 8.3 t-20 -103.91 28.9 6.26 Favored 'General case' 0 N--CA 1.495 1.79 0 O-C-N 121.333 -0.855 . . . . 0.0 108.925 -179.703 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 73' ' ' ALA . . . . . 0.522 ' C ' ' H ' ' A' ' 75' ' ' GLU . . . -72.96 -10.07 59.4 Favored 'General case' 0 N--CA 1.493 1.677 0 O-C-N 121.292 -0.88 . . . . 0.0 108.729 179.622 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 74' ' ' THR . . . . . 0.431 ' OG1' ' O ' ' A' ' 73' ' ' ALA . 68.4 p 49.69 10.59 0.04 OUTLIER 'General case' 0 N--CA 1.493 1.722 0 O-C-N 121.424 -0.797 . . . . 0.0 109.489 -179.726 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 75' ' ' GLU . . . . . 0.522 ' H ' ' C ' ' A' ' 73' ' ' ALA . 80.8 tt0 -153.82 153.04 31.4 Favored 'General case' 0 C--N 1.302 -1.487 0 O-C-N 121.2 -0.937 . . . . 0.0 109.165 179.618 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 5.7 tt -132.38 134.99 45.82 Favored 'General case' 0 N--CA 1.49 1.546 0 O-C-N 121.608 -0.683 . . . . 0.0 109.324 179.971 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 77' ' ' HIS . . . . . 0.496 ' NE2' ' OE1' ' A' ' 33' ' ' GLU . 74.5 t60 -118.75 126.22 51.4 Favored 'General case' 0 N--CA 1.494 1.758 0 CA-C-O 121.74 0.781 . . . . 0.0 109.46 -179.853 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -144.13 163.87 32.32 Favored 'General case' 0 N--CA 1.492 1.661 0 O-C-N 121.389 -0.82 . . . . 0.0 109.408 -179.719 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 84.5 mtt85 -126.01 144.95 50.51 Favored 'General case' 0 N--CA 1.495 1.792 0 N-CA-C 109.226 -0.657 . . . . 0.0 109.226 -179.877 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 80' ' ' PHE . . . . . . . . . . . . . 64.9 m-85 -128.93 152.0 49.04 Favored 'General case' 0 N--CA 1.495 1.798 0 CA-C-O 121.616 0.722 . . . . 0.0 109.374 -179.717 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 65.0 tttm -106.07 137.72 43.5 Favored 'General case' 0 N--CA 1.492 1.655 0 CA-C-O 121.603 0.716 . . . . 0.0 110.007 -179.507 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 82' ' ' PHE . . . . . . . . . . . . . 80.7 m-85 -133.13 -123.46 0.18 Allowed 'General case' 0 N--CA 1.494 1.768 0 N-CA-C 109.201 -0.666 . . . . 0.0 109.201 179.846 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 49.5 tp10 -153.65 -36.89 0.1 Allowed 'General case' 0 N--CA 1.488 1.442 0 O-C-N 121.225 -0.922 . . . . 0.0 108.704 179.959 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 84' ' ' VAL . . . . . . . . . . . . . 27.8 m -135.89 162.49 36.55 Favored 'Isoleucine or valine' 0 N--CA 1.499 1.991 0 O-C-N 121.329 -0.857 . . . . 0.0 110.155 -179.745 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 77.8 p -69.66 -19.95 63.59 Favored 'General case' 0 N--CA 1.492 1.635 0 O-C-N 121.496 -0.753 . . . . 0.0 109.482 179.618 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 86' ' ' ALA . . . . . . . . . . . . . . . -62.72 -37.6 87.15 Favored 'General case' 0 N--CA 1.492 1.63 0 O-C-N 121.253 -0.905 . . . . 0.0 109.521 179.983 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 80.4 mm-40 -71.8 -27.13 62.73 Favored 'General case' 0 N--CA 1.491 1.596 0 O-C-N 121.348 -0.845 . . . . 0.0 109.109 179.572 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 88' ' ' LYS . . . . . . . . . . . . . 36.8 ttmt -63.41 -50.61 69.14 Favored 'General case' 0 N--CA 1.49 1.544 0 O-C-N 121.258 -0.901 . . . . 0.0 109.726 -179.592 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 89' ' ' LEU . . . . . 0.477 ' CD2' ' N ' ' A' ' 89' ' ' LEU . 4.0 mm? -65.41 -44.22 88.09 Favored 'General case' 0 N--CA 1.493 1.72 0 O-C-N 121.349 -0.845 . . . . 0.0 109.893 -179.72 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 90' ' ' ILE . . . . . 0.4 ' O ' ' CB ' ' A' ' 94' ' ' LYS . 96.0 mt -66.63 -43.62 90.3 Favored 'Isoleucine or valine' 0 C--N 1.299 -1.616 0 O-C-N 121.296 -0.877 . . . . 0.0 109.625 -179.94 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 91' ' ' PHE . . . . . 0.459 ' O ' ' OG1' ' A' ' 95' ' ' THR . 82.5 t80 -61.67 -46.74 88.45 Favored 'General case' 0 N--CA 1.49 1.57 0 O-C-N 121.257 -0.902 . . . . 0.0 109.9 -179.619 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 92' ' ' GLU . . . . . . . . . . . . . 8.8 tm-20 -68.19 -51.77 41.87 Favored 'General case' 0 N--CA 1.491 1.611 0 O-C-N 121.345 -0.847 . . . . 0.0 109.996 -179.463 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 93' ' ' LEU . . . . . . . . . . . . . 3.1 tt -63.64 -46.67 84.6 Favored 'General case' 0 C--N 1.3 -1.586 0 O-C-N 121.173 -0.954 . . . . 0.0 109.659 -179.101 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 94' ' ' LYS . . . . . 0.4 ' CB ' ' O ' ' A' ' 90' ' ' ILE . 55.1 tttp -63.32 -47.27 82.92 Favored 'General case' 0 N--CA 1.491 1.61 0 O-C-N 121.205 -0.935 . . . . 0.0 110.09 -179.072 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 95' ' ' THR . . . . . 0.459 ' OG1' ' O ' ' A' ' 91' ' ' PHE . 60.0 p -67.68 -42.09 82.65 Favored 'General case' 0 C--N 1.299 -1.595 0 O-C-N 121.258 -0.901 . . . . 0.0 109.465 -179.854 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 96' ' ' ARG . . . . . . . . . . . . . 12.1 tpt180 -65.47 -41.54 93.23 Favored 'General case' 0 C--N 1.3 -1.553 0 O-C-N 121.313 -0.867 . . . . 0.0 109.322 -179.853 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 97' ' ' ALA . . . . . . . . . . . . . . . -57.92 -40.19 79.81 Favored 'General case' 0 N--CA 1.489 1.517 0 O-C-N 121.366 -0.834 . . . . 0.0 109.245 -179.762 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 98' ' ' LEU . . . . . . . . . . . . . 2.2 tt -64.04 -42.75 96.96 Favored 'General case' 0 N--CA 1.493 1.678 0 CA-C-O 121.945 0.878 . . . . 0.0 109.454 -179.695 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 99' ' ' ALA . . . . . . . . . . . . . . . -58.11 -48.92 78.72 Favored 'General case' 0 N--CA 1.493 1.694 0 O-C-N 121.144 -0.972 . . . . 0.0 110.313 -179.056 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 100' ' ' ARG . . . . . . . . . . . . . 18.5 ptp180 -80.55 -19.39 45.78 Favored 'General case' 0 C--N 1.299 -1.604 0 O-C-N 121.313 -0.867 . . . . 0.0 109.537 -179.775 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 101' ' ' LEU . . . . . . . . . . . . . 50.5 tp -96.0 126.54 41.31 Favored 'General case' 0 N--CA 1.494 1.731 0 O-C-N 121.251 -0.906 . . . . 0.0 110.028 -179.452 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 102' ' ' GLU . . . . . . . . . . . . . 78.9 mm-40 -61.31 153.63 26.04 Favored 'General case' 0 N--CA 1.489 1.475 0 CA-C-O 122.021 0.915 . . . . 0.0 110.621 -179.7 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 103' ' ' HIS . . . . . . . . . . . . . 86.3 t60 -58.99 -42.25 89.59 Favored 'General case' 0 N--CA 1.489 1.522 0 O-C-N 121.637 -0.664 . . . . 0.0 110.051 -179.768 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 104' ' ' HIS . . . . . 0.405 ' O ' ' CG ' ' A' ' 104' ' ' HIS . 56.6 p-80 -86.13 121.05 28.19 Favored 'General case' 0 N--CA 1.492 1.673 0 O-C-N 121.118 -0.989 . . . . 0.0 110.355 -179.137 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 105' ' ' HIS . . . . . . . . . . . . . 56.7 t-80 -151.38 -75.93 0.14 Allowed 'General case' 0 N--CA 1.493 1.695 0 O-C-N 121.554 -0.716 . . . . 0.0 109.178 179.867 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 106' ' ' HIS . . . . . 0.585 ' HD1' ' H ' ' A' ' 108' ' ' HIS . 54.1 t-80 -153.16 164.36 38.19 Favored 'General case' 0 N--CA 1.494 1.77 0 O-C-N 121.167 -0.958 . . . . 0.0 109.997 179.904 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 107' ' ' HIS . . . . . 0.44 ' O ' ' O ' ' A' ' 108' ' ' HIS . 78.7 m80 -62.36 -41.29 98.5 Favored 'General case' 0 N--CA 1.495 1.788 0 O-C-N 121.512 -0.743 . . . . 0.0 110.008 -179.995 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 108' ' ' HIS . . . . . 0.585 ' H ' ' HD1' ' A' ' 106' ' ' HIS . 86.4 t60 . . . . . 0 N--CA 1.494 1.729 0 CA-C-O 118.006 -0.997 . . . . 0.0 110.04 -179.463 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 96.8 mmm . . . . . 0 N--CA 1.49 1.565 0 CA-C-O 121.48 0.657 . . . . 0.0 109.801 . . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 80.7 p -69.15 -16.48 63.65 Favored 'General case' 0 N--CA 1.489 1.488 0 O-C-N 121.492 -0.755 . . . . 0.0 109.556 -179.935 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 3' ' ' ASN . . . . . . . . . . . . . 98.9 m-20 -63.11 -40.88 98.92 Favored 'General case' 0 N--CA 1.49 1.566 0 O-C-N 121.365 -0.835 . . . . 0.0 109.551 -179.985 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 3.9 tm0? -155.27 101.85 2.24 Favored 'General case' 0 N--CA 1.492 1.641 0 O-C-N 121.219 -0.926 . . . . 0.0 109.012 179.673 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 35.2 m -66.71 133.85 51.03 Favored 'General case' 0 N--CA 1.489 1.481 0 O-C-N 121.479 -0.763 . . . . 0.0 110.453 -179.45 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 6' ' ' CYS . . . . . 0.456 ' SG ' ' O ' ' A' ' 6' ' ' CYS . 29.3 p -137.86 118.38 13.88 Favored 'General case' 0 N--CA 1.494 1.768 0 N-CA-C 108.793 -0.817 . . . . 0.0 108.793 179.495 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 7' ' ' VAL . . . . . . . . . . . . . 16.5 m -110.18 131.51 61.01 Favored 'Isoleucine or valine' 0 N--CA 1.499 2.01 0 O-C-N 121.504 -0.748 . . . . 0.0 109.808 -179.397 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 8' ' ' GLU . . . . . 0.403 ' OE1' ' N ' ' A' ' 8' ' ' GLU . 60.2 mp0 -62.0 136.1 57.82 Favored 'General case' 0 N--CA 1.489 1.475 0 O-C-N 121.626 -0.671 . . . . 0.0 109.712 -179.557 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 14.0 m120 -82.86 150.74 26.36 Favored 'General case' 0 N--CA 1.489 1.517 0 O-C-N 121.441 -0.787 . . . . 0.0 110.091 -179.46 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 10' ' ' GLU . . . . . 0.474 ' N ' ' CD ' ' A' ' 10' ' ' GLU . 0.9 OUTLIER -145.06 96.59 2.87 Favored 'General case' 0 N--CA 1.49 1.569 0 O-C-N 121.306 -0.871 . . . . 0.0 108.768 179.658 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 35.0 m -100.46 130.41 49.76 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.916 0 O-C-N 121.412 -0.805 . . . . 0.0 109.719 -179.663 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 17.1 p -148.31 32.32 0.81 Allowed 'General case' 0 N--CA 1.492 1.664 0 N-CA-C 108.381 -0.97 . . . . 0.0 108.381 179.908 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 79.5 mm-40 -68.83 148.17 50.67 Favored 'General case' 0 N--CA 1.49 1.561 0 O-C-N 121.559 -0.713 . . . . 0.0 110.302 -179.227 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -65.27 147.7 52.98 Favored 'General case' 0 N--CA 1.491 1.596 0 O-C-N 121.577 -0.702 . . . . 0.0 110.598 -179.546 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 7.5 t -60.58 -39.05 86.62 Favored 'General case' 0 N--CA 1.491 1.617 0 O-C-N 121.409 -0.807 . . . . 0.0 109.805 179.774 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 75.11 20.98 78.92 Favored Glycine 0 N--CA 1.49 2.285 0 N-CA-C 109.828 -1.309 . . . . 0.0 109.828 -179.941 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 41.0 m 52.48 52.7 13.62 Favored 'General case' 0 N--CA 1.492 1.626 0 O-C-N 121.235 -1.156 . . . . 0.0 109.675 -179.811 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . 40.97 -102.02 0.03 OUTLIER 'General case' 0 N--CA 1.493 1.704 0 CA-C-O 121.431 0.634 . . . . 0.0 110.78 179.423 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -70.23 148.44 45.81 Favored Glycine 0 N--CA 1.489 2.169 0 N-CA-C 110.626 -0.99 . . . . 0.0 110.626 -178.915 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 20' ' ' GLU . . . . . 0.542 ' O ' ' N ' ' A' ' 22' ' ' GLY . 53.6 tp10 -169.59 99.46 0.33 Allowed 'General case' 0 N--CA 1.488 1.429 0 O-C-N 121.57 -0.959 . . . . 0.0 108.886 179.011 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 21' ' ' ILE . . . . . . . . . . . . . 92.4 mt 48.77 -88.28 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.493 1.691 0 O-C-N 121.5 -0.75 . . . . 0.0 110.027 -179.946 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 22' ' ' GLY . . . . . 0.542 ' N ' ' O ' ' A' ' 20' ' ' GLU . . . 53.12 94.25 0.01 OUTLIER Glycine 0 N--CA 1.492 2.42 0 N-CA-C 110.006 -1.238 . . . . 0.0 110.006 -179.956 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 23' ' ' PHE . . . . . 0.529 ' O ' ' N ' ' A' ' 25' ' ' ILE . 82.5 m-85 -75.97 144.84 40.75 Favored 'General case' 0 N--CA 1.489 1.485 0 O-C-N 121.283 -1.128 . . . . 0.0 110.347 -179.788 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 97.5 mt 48.91 -87.6 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.49 1.536 0 O-C-N 121.891 -0.506 . . . . 0.0 110.076 179.853 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 25' ' ' ILE . . . . . 0.529 ' N ' ' O ' ' A' ' 23' ' ' PHE . 1.9 pt -77.51 141.08 16.05 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.347 0 C-N-CA 118.745 -1.182 . . . . 0.0 109.892 -178.547 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 17.9 ptp180 -91.74 157.1 17.11 Favored 'General case' 0 N--CA 1.496 1.851 0 CA-C-O 121.906 0.86 . . . . 0.0 110.981 179.001 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 96.7 mt-10 -63.81 153.88 35.24 Favored 'General case' 0 N--CA 1.495 1.806 0 CA-C-O 121.612 0.72 . . . . 0.0 110.841 -179.586 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . 92.36 175.66 41.91 Favored Glycine 0 N--CA 1.492 2.377 0 N-CA-C 110.296 -1.122 . . . . 0.0 110.296 179.436 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 18.8 t0 72.45 64.62 0.12 Allowed 'General case' 0 N--CA 1.495 1.783 0 O-C-N 121.959 -0.73 . . . . 0.0 110.157 179.928 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 96.3 m-20 54.6 70.63 0.6 Allowed 'General case' 0 N--CA 1.493 1.702 0 O-C-N 121.674 -0.641 . . . . 0.0 109.688 179.438 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 49.9 t -120.24 135.63 59.88 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.773 0 N-CA-C 109.112 -0.699 . . . . 0.0 109.112 -179.829 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -118.48 147.91 43.13 Favored 'General case' 0 N--CA 1.492 1.63 0 N-CA-C 109.267 -0.642 . . . . 0.0 109.267 -179.79 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 97.3 mt-10 -105.49 133.92 49.46 Favored 'General case' 0 N--CA 1.492 1.67 0 O-C-N 121.593 -0.692 . . . . 0.0 109.519 -179.74 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 34' ' ' VAL . . . . . . . . . . . . . 48.6 t -123.06 133.44 69.06 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.734 0 N-CA-C 108.771 -0.826 . . . . 0.0 108.771 179.929 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 77.9 p -128.52 122.96 32.33 Favored 'General case' 0 N--CA 1.491 1.588 0 N-CA-C 108.719 -0.845 . . . . 0.0 108.719 -179.944 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 44.9 tp -117.81 132.58 56.43 Favored 'General case' 0 N--CA 1.496 1.858 0 N-CA-C 108.905 -0.776 . . . . 0.0 108.905 179.808 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 37' ' ' PHE . . . . . . . . . . . . . 91.2 t80 -112.98 132.33 55.4 Favored 'General case' 0 N--CA 1.493 1.688 0 O-C-N 121.676 -0.64 . . . . 0.0 109.287 -179.638 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . -168.45 -162.79 21.24 Favored Glycine 0 N--CA 1.487 2.074 0 C-N-CA 119.693 -1.241 . . . . 0.0 110.164 -179.667 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 39' ' ' SER . . . . . 0.515 ' OG ' ' N ' ' A' ' 40' ' ' ASP . 30.0 t -62.65 -128.33 0.0 OUTLIER 'General case' 0 N--CA 1.49 1.55 0 O-C-N 121.667 -0.902 . . . . 0.0 110.766 -179.264 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 40' ' ' ASP . . . . . 0.515 ' N ' ' OG ' ' A' ' 39' ' ' SER . 98.5 m-20 -73.52 175.77 6.74 Favored 'General case' 0 N--CA 1.488 1.467 0 O-C-N 121.398 -0.814 . . . . 0.0 110.134 -179.197 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 88.5 tttt -63.18 -39.97 96.19 Favored 'General case' 0 C--N 1.305 -1.361 0 N-CA-C 109.05 -0.722 . . . . 0.0 109.05 179.512 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -54.81 -46.02 74.47 Favored 'General case' 0 N--CA 1.488 1.468 0 O-C-N 121.352 -0.843 . . . . 0.0 109.416 -179.944 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 43' ' ' HIS . . . . . . . . . . . . . 15.3 t-80 -61.24 -41.56 97.09 Favored 'General case' 0 C--N 1.303 -1.426 0 O-C-N 121.29 -0.881 . . . . 0.0 109.263 179.653 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 96.5 mt -64.41 -39.59 94.13 Favored 'General case' 0 N--CA 1.49 1.526 0 O-C-N 121.459 -0.776 . . . . 0.0 109.656 -179.929 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 97.2 mt-10 -59.39 -41.15 88.71 Favored 'General case' 0 N--CA 1.488 1.462 0 O-C-N 121.178 -0.951 . . . . 0.0 109.847 -179.69 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . -62.81 -46.72 93.04 Favored Glycine 0 N--CA 1.49 2.285 0 N-CA-C 109.162 -1.575 . . . . 0.0 109.162 179.75 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 25.6 mtpp -67.29 -33.12 74.63 Favored 'General case' 0 N--CA 1.488 1.46 0 O-C-N 121.505 -0.997 . . . . 0.0 109.356 179.224 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 44.0 tp -57.55 -38.33 74.57 Favored 'General case' 0 N--CA 1.488 1.467 0 O-C-N 121.518 -0.739 . . . . 0.0 109.399 -179.056 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 49' ' ' ALA . . . . . . . . . . . . . . . -52.15 -40.48 61.47 Favored 'General case' 0 C--N 1.302 -1.46 0 O-C-N 121.26 -0.9 . . . . 0.0 109.998 -179.682 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 75.9 mt-10 -68.01 -40.96 82.88 Favored 'General case' 0 N--CA 1.491 1.586 0 O-C-N 121.138 -0.977 . . . . 0.0 109.629 179.955 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 51' ' ' TYR . . . . . 0.501 ' HH ' ' N ' ' A' ' 99' ' ' ALA . 8.1 m-85 -61.98 -44.9 95.78 Favored 'General case' 0 N--CA 1.49 1.525 0 O-C-N 121.441 -0.787 . . . . 0.0 109.232 179.934 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 52' ' ' ILE . . . . . . . . . . . . . 96.0 mt -63.97 -43.19 97.6 Favored 'Isoleucine or valine' 0 C--N 1.303 -1.422 0 O-C-N 121.513 -0.742 . . . . 0.0 109.771 -179.816 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 79.9 p -59.49 -39.89 85.24 Favored 'General case' 0 N--CA 1.49 1.562 0 O-C-N 121.147 -0.971 . . . . 0.0 110.028 -179.193 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 54' ' ' LEU . . . . . . . . . . . . . 95.0 mt -63.26 -41.84 99.09 Favored 'General case' 0 N--CA 1.489 1.478 0 O-C-N 121.154 -0.967 . . . . 0.0 109.122 179.8 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -64.11 -41.5 97.23 Favored 'General case' 0 N--CA 1.488 1.437 0 O-C-N 121.42 -0.8 . . . . 0.0 109.502 179.911 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 56' ' ' LYS . . . . . . . . . . . . . 56.5 mtpt -65.37 -43.7 89.95 Favored 'General case' 0 N--CA 1.489 1.514 0 O-C-N 121.377 -0.827 . . . . 0.0 109.461 179.728 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 60.7 tt0 -67.34 -43.76 80.73 Favored 'General case' 0 N--CA 1.488 1.456 0 O-C-N 121.408 -0.807 . . . . 0.0 109.377 -179.762 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 58' ' ' VAL . . . . . 0.475 ' CG1' ' OE1' ' A' ' 87' ' ' GLU . 53.6 t -64.63 -45.61 94.88 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.405 0 O-C-N 121.461 -0.774 . . . . 0.0 109.523 179.999 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 59' ' ' TYR . . . . . . . . . . . . . 56.6 t80 -131.98 123.27 27.01 Favored 'General case' 0 N--CA 1.497 1.902 0 O-C-N 121.479 -0.763 . . . . 0.0 109.619 -179.536 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -70.51 144.44 51.36 Favored 'General case' 0 N--CA 1.491 1.612 0 O-C-N 121.544 -0.722 . . . . 0.0 110.898 -179.436 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 61' ' ' ASN . . . . . . . . . . . . . 11.2 t-20 57.94 40.96 25.21 Favored 'General case' 0 N--CA 1.491 1.591 0 O-C-N 121.525 -0.734 . . . . 0.0 109.115 179.594 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 62' ' ' VAL . . . . . . . . . . . . . 11.5 p -75.98 132.32 33.32 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.501 0 O-C-N 121.595 -0.691 . . . . 0.0 110.046 -179.718 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 97.4 mt-10 -90.91 150.74 21.39 Favored 'General case' 0 N--CA 1.492 1.652 0 O-C-N 121.437 -0.789 . . . . 0.0 109.638 -179.89 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 64' ' ' TYR . . . . . 0.45 ' C ' ' OE1' ' A' ' 65' ' ' GLU . 53.9 p90 -156.4 164.07 38.72 Favored 'General case' 0 N--CA 1.49 1.544 0 O-C-N 121.175 -0.953 . . . . 0.0 110.207 -179.729 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 65' ' ' GLU . . . . . 0.602 ' N ' ' CD ' ' A' ' 65' ' ' GLU . 1.8 pm0 -152.61 156.64 39.67 Favored 'General case' 0 N--CA 1.49 1.529 0 N-CA-C 108.634 -0.876 . . . . 0.0 108.634 -179.465 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 66' ' ' VAL . . . . . . . . . . . . . 2.6 p -123.19 129.57 74.85 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.86 0 CA-C-O 121.533 0.683 . . . . 0.0 109.465 -179.82 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -75.96 160.68 77.99 Favored Pre-proline 0 N--CA 1.488 1.469 0 O-C-N 121.607 -0.683 . . . . 0.0 109.333 -179.78 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 68' ' ' PRO . . . . . . . . . . . . . 21.4 Cg_endo -59.76 111.83 1.08 Allowed 'Trans proline' 0 N--CA 1.495 1.61 0 C-N-CA 122.831 2.354 . . . . 0.0 111.738 179.905 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 69' ' ' VAL . . . . . . . . . . . . . 56.0 t -124.66 134.61 66.35 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.917 0 N-CA-C 109.136 -0.69 . . . . 0.0 109.136 179.987 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -67.02 149.83 50.08 Favored 'General case' 0 C--N 1.304 -1.41 0 O-C-N 121.527 -0.733 . . . . 0.0 110.27 -179.625 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 71' ' ' ASP . . . . . 0.547 ' OD1' ' N ' ' A' ' 72' ' ' ASN . 48.2 p-10 -64.75 -29.51 70.49 Favored 'General case' 0 N--CA 1.488 1.456 0 O-C-N 121.565 -0.709 . . . . 0.0 109.566 179.797 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 72' ' ' ASN . . . . . 0.547 ' N ' ' OD1' ' A' ' 71' ' ' ASP . 10.7 m120 -90.27 8.28 34.04 Favored 'General case' 0 N--CA 1.49 1.548 0 O-C-N 121.299 -0.876 . . . . 0.0 108.959 -179.942 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -68.76 148.75 49.88 Favored 'General case' 0 N--CA 1.49 1.564 0 O-C-N 121.506 -0.746 . . . . 0.0 110.464 -179.613 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 74' ' ' THR . . . . . 0.441 ' H ' ' HG1' ' A' ' 74' ' ' THR . 12.7 p -100.27 3.71 43.68 Favored 'General case' 0 N--CA 1.494 1.764 0 O-C-N 121.451 -0.78 . . . . 0.0 109.471 179.821 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 22.2 pt-20 -142.28 160.96 39.22 Favored 'General case' 0 N--CA 1.495 1.819 0 O-C-N 121.137 -0.977 . . . . 0.0 109.55 179.796 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 9.9 tp -127.55 135.03 49.76 Favored 'General case' 0 N--CA 1.493 1.717 0 O-C-N 121.636 -0.665 . . . . 0.0 109.285 -179.88 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 77' ' ' HIS . . . . . . . . . . . . . 75.1 m80 -108.4 128.63 54.94 Favored 'General case' 0 N--CA 1.494 1.768 0 N-CA-C 109.16 -0.681 . . . . 0.0 109.16 179.699 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -151.79 154.57 36.49 Favored 'General case' 0 N--CA 1.489 1.506 0 O-C-N 121.258 -0.901 . . . . 0.0 109.369 179.992 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 79' ' ' ARG . . . . . 0.455 ' O ' ' OE2' ' A' ' 65' ' ' GLU . 84.5 mtt85 -128.74 150.43 50.28 Favored 'General case' 0 N--CA 1.493 1.724 0 N-CA-C 109.311 -0.626 . . . . 0.0 109.311 -179.834 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 80' ' ' PHE . . . . . . . . . . . . . 83.1 m-85 -130.58 147.75 52.3 Favored 'General case' 0 N--CA 1.494 1.774 0 O-C-N 121.609 -0.682 . . . . 0.0 109.22 -179.742 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 49.5 mttm -113.67 139.05 49.38 Favored 'General case' 0 N--CA 1.495 1.819 0 N-CA-C 109.173 -0.676 . . . . 0.0 109.173 179.833 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 82' ' ' PHE . . . . . . . . . . . . . 79.2 m-85 -133.19 158.8 41.95 Favored 'General case' 0 N--CA 1.495 1.786 0 CA-C-O 121.496 0.665 . . . . 0.0 109.872 -179.582 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 81.7 tt0 -65.52 -37.66 87.42 Favored 'General case' 0 C--N 1.303 -1.423 0 O-C-N 121.543 -0.723 . . . . 0.0 109.559 179.953 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 84' ' ' VAL . . . . . . . . . . . . . 35.7 m -136.08 159.56 38.89 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.961 0 O-C-N 121.378 -0.826 . . . . 0.0 110.282 -179.549 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 85' ' ' SER . . . . . 0.509 ' O ' ' N ' ' A' ' 88' ' ' LYS . 38.6 t -64.77 -38.95 92.71 Favored 'General case' 0 N--CA 1.49 1.556 0 O-C-N 121.791 -0.568 . . . . 0.0 110.191 -179.946 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 86' ' ' ALA . . . . . . . . . . . . . . . -40.8 -39.46 1.12 Allowed 'General case' 0 N--CA 1.494 1.767 0 O-C-N 121.607 -0.683 . . . . 0.0 110.24 -179.353 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 87' ' ' GLU . . . . . 0.475 ' OE1' ' CG1' ' A' ' 58' ' ' VAL . 79.5 mm-40 -66.02 -34.03 77.16 Favored 'General case' 0 N--CA 1.488 1.432 0 O-C-N 121.508 -0.745 . . . . 0.0 109.477 179.751 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 88' ' ' LYS . . . . . 0.509 ' N ' ' O ' ' A' ' 85' ' ' SER . 88.5 tttt -62.15 -44.9 95.61 Favored 'General case' 0 N--CA 1.489 1.509 0 O-C-N 121.297 -0.877 . . . . 0.0 109.936 -179.988 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 50.7 tp -62.56 -50.35 71.68 Favored 'General case' 0 N--CA 1.489 1.483 0 O-C-N 121.271 -0.893 . . . . 0.0 110.234 -178.905 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 90' ' ' ILE . . . . . 0.52 ' CD1' ' N ' ' A' ' 90' ' ' ILE . 1.4 mp -69.27 -45.42 79.27 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.567 0 O-C-N 121.302 -0.874 . . . . 0.0 109.853 -179.684 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 91' ' ' PHE . . . . . . . . . . . . . 69.7 t80 -62.59 -44.66 95.76 Favored 'General case' 0 N--CA 1.489 1.51 0 O-C-N 121.388 -0.82 . . . . 0.0 110.168 -179.551 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 92' ' ' GLU . . . . . 0.515 ' OE2' ' NH2' ' A' ' 96' ' ' ARG . 83.0 tt0 -62.36 -38.74 90.71 Favored 'General case' 0 C--N 1.305 -1.369 0 O-C-N 121.358 -0.839 . . . . 0.0 109.95 -179.36 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 93' ' ' LEU . . . . . . . . . . . . . 39.3 mt -63.2 -44.4 95.43 Favored 'General case' 0 N--CA 1.49 1.55 0 O-C-N 121.209 -0.932 . . . . 0.0 109.97 -179.574 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 94' ' ' LYS . . . . . . . . . . . . . 60.9 mttp -66.32 -44.15 84.19 Favored 'General case' 0 N--CA 1.488 1.467 0 O-C-N 121.183 -0.948 . . . . 0.0 110.128 -179.993 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 34.3 p -68.31 -35.82 78.39 Favored 'General case' 0 N--CA 1.487 1.423 0 O-C-N 121.338 -0.851 . . . . 0.0 109.714 -179.654 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 96' ' ' ARG . . . . . 0.515 ' NH2' ' OE2' ' A' ' 92' ' ' GLU . 19.3 tpp180 -68.08 -39.53 82.91 Favored 'General case' 0 N--CA 1.488 1.467 0 O-C-N 121.197 -0.94 . . . . 0.0 108.773 179.608 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 97' ' ' ALA . . . . . . . . . . . . . . . -56.59 -48.04 78.27 Favored 'General case' 0 N--CA 1.486 1.372 0 O-C-N 121.337 -0.852 . . . . 0.0 109.097 179.935 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 98' ' ' LEU . . . . . . . . . . . . . 91.7 mt -63.94 -41.43 97.61 Favored 'General case' 0 N--CA 1.486 1.366 0 O-C-N 121.487 -0.758 . . . . 0.0 109.436 179.559 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 99' ' ' ALA . . . . . 0.501 ' N ' ' HH ' ' A' ' 51' ' ' TYR . . . -64.49 -32.42 74.04 Favored 'General case' 0 N--CA 1.489 1.479 0 O-C-N 121.471 -0.768 . . . . 0.0 109.875 -179.837 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 100' ' ' ARG . . . . . . . . . . . . . 5.9 mmp_? -88.96 1.51 55.35 Favored 'General case' 0 N--CA 1.491 1.6 0 O-C-N 121.243 -0.911 . . . . 0.0 109.089 -179.978 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 101' ' ' LEU . . . . . . . . . . . . . 57.2 tp -63.28 -42.72 99.14 Favored 'General case' 0 C--N 1.304 -1.404 0 O-C-N 121.51 -0.744 . . . . 0.0 109.662 -179.912 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 102' ' ' GLU . . . . . . . . . . . . . 99.0 mt-10 -96.35 120.7 37.14 Favored 'General case' 0 N--CA 1.495 1.778 0 O-C-N 121.216 -0.928 . . . . 0.0 109.787 -179.484 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 103' ' ' HIS . . . . . . . . . . . . . 82.6 t60 -99.41 68.89 1.64 Allowed 'General case' 0 N--CA 1.494 1.761 0 O-C-N 121.468 -0.77 . . . . 0.0 109.73 -179.752 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 104' ' ' HIS . . . . . 0.439 ' O ' ' O ' ' A' ' 105' ' ' HIS . 73.6 m-70 -88.3 -13.69 40.18 Favored 'General case' 0 N--CA 1.49 1.552 0 N-CA-C 108.837 -0.801 . . . . 0.0 108.837 179.413 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 105' ' ' HIS . . . . . 0.439 ' O ' ' O ' ' A' ' 104' ' ' HIS . 86.6 t60 56.59 154.97 0.01 OUTLIER 'General case' 0 N--CA 1.493 1.722 0 CA-C-O 121.597 0.713 . . . . 0.0 110.705 179.285 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 106' ' ' HIS . . . . . . . . . . . . . 76.1 m80 -78.22 132.36 37.52 Favored 'General case' 0 N--CA 1.491 1.601 0 O-C-N 121.504 -0.747 . . . . 0.0 110.445 -179.28 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 107' ' ' HIS . . . . . . . . . . . . . 58.9 t-80 -66.6 -42.57 86.7 Favored 'General case' 0 N--CA 1.489 1.495 0 O-C-N 121.525 -0.734 . . . . 0.0 109.168 179.485 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 108' ' ' HIS . . . . . 0.479 ' CG ' ' O ' ' A' ' 108' ' ' HIS . 81.9 t60 . . . . . 0 N--CA 1.489 1.49 0 CA-C-O 118.016 -0.992 . . . . 0.0 109.86 -179.975 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 97.4 mmm . . . . . 0 N--CA 1.489 1.505 0 N-CA-C 109.073 -0.714 . . . . 0.0 109.073 . . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 28.0 t -65.19 141.55 58.63 Favored 'General case' 0 N--CA 1.489 1.483 0 O-C-N 121.452 -0.78 . . . . 0.0 110.191 -179.425 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 3' ' ' ASN . . . . . 0.416 ' OD1' ' N ' ' A' ' 4' ' ' GLN . 48.4 p30 -70.01 -14.1 62.53 Favored 'General case' 0 N--CA 1.49 1.553 0 O-C-N 121.451 -0.781 . . . . 0.0 109.52 179.816 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 4' ' ' GLN . . . . . 0.416 ' N ' ' OD1' ' A' ' 3' ' ' ASN . 65.6 tp60 -160.55 90.74 0.88 Allowed 'General case' 0 N--CA 1.49 1.571 0 O-C-N 121.054 -1.029 . . . . 0.0 108.989 179.65 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 27.6 m -64.55 135.17 55.72 Favored 'General case' 0 N--CA 1.491 1.597 0 O-C-N 121.344 -0.847 . . . . 0.0 110.007 -179.383 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 37.2 m -93.9 133.85 36.89 Favored 'General case' 0 N--CA 1.495 1.789 0 O-C-N 121.227 -0.921 . . . . 0.0 110.116 -179.581 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 7' ' ' VAL . . . . . . . . . . . . . 7.1 p -147.89 -28.8 0.1 Allowed 'Isoleucine or valine' 0 N--CA 1.494 1.767 0 N-CA-C 108.493 -0.929 . . . . 0.0 108.493 179.406 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 83.2 tt0 -163.18 121.65 2.03 Favored 'General case' 0 N--CA 1.489 1.516 0 O-C-N 121.466 -0.771 . . . . 0.0 109.736 179.675 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 99.0 m-20 -64.3 -39.1 93.24 Favored 'General case' 0 N--CA 1.49 1.528 0 O-C-N 121.456 -0.777 . . . . 0.0 109.653 179.661 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 31.1 tp10 -51.76 150.53 3.94 Favored 'General case' 0 N--CA 1.493 1.705 0 O-C-N 121.387 -0.821 . . . . 0.0 110.488 -178.894 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 4.3 t 61.98 86.23 0.05 OUTLIER 'Isoleucine or valine' 0 N--CA 1.496 1.831 0 O-C-N 121.702 -0.624 . . . . 0.0 109.784 -179.963 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 8.8 t -102.47 -173.64 2.38 Favored 'General case' 0 N--CA 1.496 1.844 0 O-C-N 121.483 -0.761 . . . . 0.0 109.867 -179.863 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 97.8 mt-10 -80.09 3.85 19.09 Favored 'General case' 0 N--CA 1.489 1.487 0 O-C-N 121.434 -0.791 . . . . 0.0 109.225 179.634 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -74.84 -6.32 48.4 Favored 'General case' 0 N--CA 1.489 1.523 0 O-C-N 121.516 -0.74 . . . . 0.0 109.398 179.917 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 92.8 m -63.5 -36.57 84.22 Favored 'General case' 0 C--N 1.305 -1.359 0 O-C-N 121.337 -0.852 . . . . 0.0 108.923 179.631 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 108.46 -142.28 15.99 Favored Glycine 0 N--CA 1.5 2.901 0 N-CA-C 109.082 -1.607 . . . . 0.0 109.082 179.941 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 18.6 t -72.64 129.84 39.19 Favored 'General case' 0 C--N 1.301 -1.508 0 N-CA-C 106.58 -1.637 . . . . 0.0 106.58 178.743 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -73.87 135.52 43.36 Favored 'General case' 0 N--CA 1.496 1.825 0 C-N-CA 118.645 -1.222 . . . . 0.0 111.058 -176.976 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -90.65 108.43 3.56 Favored Glycine 0 N--CA 1.491 2.357 0 N-CA-C 109.691 -1.364 . . . . 0.0 109.691 179.546 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 22.3 pt-20 -85.93 17.38 3.51 Favored 'General case' 0 N--CA 1.49 1.57 0 O-C-N 121.351 -1.087 . . . . 0.0 109.089 179.538 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 21' ' ' ILE . . . . . 0.473 ' O ' ' N ' ' A' ' 23' ' ' PHE . 38.3 pt -80.95 14.43 0.44 Allowed 'Isoleucine or valine' 0 N--CA 1.489 1.519 0 O-C-N 121.469 -0.769 . . . . 0.0 109.332 179.921 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . -42.18 94.51 0.01 OUTLIER Glycine 0 N--CA 1.493 2.482 0 N-CA-C 110.491 -1.043 . . . . 0.0 110.491 -179.406 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 23' ' ' PHE . . . . . 0.473 ' N ' ' O ' ' A' ' 21' ' ' ILE . 0.1 OUTLIER -153.35 -141.16 0.1 Allowed 'General case' 0 N--CA 1.495 1.78 0 O-C-N 121.029 -1.277 . . . . 0.0 109.829 179.756 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 96.6 mt -59.81 139.84 18.8 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.444 0 O-C-N 121.433 -0.792 . . . . 0.0 110.224 -179.184 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 25' ' ' ILE . . . . . . . . . . . . . 97.1 mt -64.32 137.27 25.16 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.521 0 O-C-N 121.561 -0.712 . . . . 0.0 110.367 -179.086 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 63.3 ttm-85 -59.29 143.26 49.86 Favored 'General case' 0 N--CA 1.494 1.757 0 CA-C-O 121.61 0.719 . . . . 0.0 110.466 -179.253 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 96.7 mt-10 -58.56 131.14 49.91 Favored 'General case' 0 N--CA 1.491 1.621 0 O-C-N 121.603 -0.685 . . . . 0.0 110.408 -179.673 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 28' ' ' GLY . . . . . 0.424 ' O ' ' O ' ' A' ' 29' ' ' ASP . . . 177.64 173.2 42.91 Favored Glycine 0 N--CA 1.492 2.387 0 N-CA-C 109.511 -1.435 . . . . 0.0 109.511 179.683 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 29' ' ' ASP . . . . . 0.424 ' O ' ' O ' ' A' ' 28' ' ' GLY . 98.9 m-20 45.02 -172.38 0.01 OUTLIER 'General case' 0 N--CA 1.496 1.852 0 O-C-N 121.46 -1.024 . . . . 0.0 111.0 179.452 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 99.6 m-20 -82.74 88.43 6.74 Favored 'General case' 0 N--CA 1.49 1.543 0 O-C-N 121.602 -0.686 . . . . 0.0 109.44 -179.468 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 9.2 p -86.16 161.34 2.98 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.635 0 O-C-N 121.34 -0.85 . . . . 0.0 109.608 -179.67 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -143.61 139.42 29.63 Favored 'General case' 0 N--CA 1.493 1.721 0 O-C-N 121.294 -0.879 . . . . 0.0 109.016 179.835 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 83.7 tt0 -101.38 142.75 32.33 Favored 'General case' 0 N--CA 1.494 1.755 0 O-C-N 121.403 -0.81 . . . . 0.0 109.132 179.989 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 34' ' ' VAL . . . . . . . . . . . . . 52.4 t -122.54 131.56 72.97 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.905 0 N-CA-C 108.905 -0.776 . . . . 0.0 108.905 179.812 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 35.3 m -111.17 123.41 50.15 Favored 'General case' 0 N--CA 1.494 1.735 0 N-CA-C 108.658 -0.867 . . . . 0.0 108.658 179.904 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 26.3 mt -119.23 149.41 41.81 Favored 'General case' 0 N--CA 1.497 1.887 0 O-C-N 121.501 -0.75 . . . . 0.0 109.649 -179.436 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 37' ' ' PHE . . . . . . . . . . . . . 97.0 m-85 -128.74 147.36 50.76 Favored 'General case' 0 N--CA 1.493 1.717 0 N-CA-C 109.083 -0.71 . . . . 0.0 109.083 -179.405 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . -177.79 -177.65 46.75 Favored Glycine 0 N--CA 1.487 2.091 0 N-CA-C 109.474 -1.45 . . . . 0.0 109.474 -179.865 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 39' ' ' SER . . . . . 0.645 ' HG ' ' H ' ' A' ' 40' ' ' ASP . 8.7 p -87.48 -81.64 0.23 Allowed 'General case' 0 N--CA 1.489 1.498 0 O-C-N 121.387 -1.066 . . . . 0.0 109.824 -179.911 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 40' ' ' ASP . . . . . 0.645 ' H ' ' HG ' ' A' ' 39' ' ' SER . 52.4 p30 -87.78 168.51 12.89 Favored 'General case' 0 N--CA 1.493 1.724 0 O-C-N 121.464 -0.772 . . . . 0.0 110.399 -179.445 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 88.6 tttt -65.93 -36.63 83.9 Favored 'General case' 0 N--CA 1.49 1.555 0 O-C-N 121.674 -0.641 . . . . 0.0 110.188 179.883 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -57.64 -41.62 81.76 Favored 'General case' 0 N--CA 1.492 1.629 0 O-C-N 121.272 -0.893 . . . . 0.0 110.155 -179.106 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 43' ' ' HIS . . . . . . . . . . . . . 80.0 t60 -63.39 -42.13 98.79 Favored 'General case' 0 N--CA 1.489 1.516 0 O-C-N 121.169 -0.957 . . . . 0.0 109.42 -179.788 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 95.3 mt -63.47 -40.54 97.39 Favored 'General case' 0 N--CA 1.489 1.514 0 O-C-N 121.399 -0.813 . . . . 0.0 109.827 -179.671 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 74.5 mt-10 -62.75 -39.68 94.9 Favored 'General case' 0 N--CA 1.488 1.437 0 O-C-N 121.239 -0.913 . . . . 0.0 109.759 -179.639 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . -65.01 -45.17 93.1 Favored Glycine 0 N--CA 1.49 2.287 0 N-CA-C 109.671 -1.372 . . . . 0.0 109.671 -179.844 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 47' ' ' LYS . . . . . 0.518 ' HZ3' ' CB ' ' A' ' 99' ' ' ALA . 16.9 tptm -64.95 -36.03 83.07 Favored 'General case' 0 N--CA 1.489 1.509 0 O-C-N 121.27 -1.135 . . . . 0.0 109.236 179.882 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 60.8 tp -61.73 -39.5 91.74 Favored 'General case' 0 N--CA 1.488 1.451 0 O-C-N 121.339 -0.851 . . . . 0.0 109.345 -179.707 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 49' ' ' ALA . . . . . . . . . . . . . . . -54.03 -34.01 58.81 Favored 'General case' 0 N--CA 1.488 1.468 0 O-C-N 121.336 -0.852 . . . . 0.0 109.823 -179.627 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 79.3 mm-40 -65.31 -41.04 94.46 Favored 'General case' 0 N--CA 1.491 1.599 0 O-C-N 121.226 -0.921 . . . . 0.0 109.713 -179.981 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 10.8 m-85 -60.78 -39.67 89.72 Favored 'General case' 0 N--CA 1.491 1.581 0 O-C-N 121.487 -0.758 . . . . 0.0 109.552 -179.631 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 52' ' ' ILE . . . . . . . . . . . . . 34.1 mm -63.59 -43.51 98.25 Favored 'Isoleucine or valine' 0 C--N 1.301 -1.536 0 O-C-N 121.39 -0.819 . . . . 0.0 109.491 -179.484 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 53' ' ' SER . . . . . 0.481 ' O ' ' NE2' ' A' ' 57' ' ' GLN . 71.1 m -60.32 -51.7 68.4 Favored 'General case' 0 N--CA 1.492 1.674 0 O-C-N 121.081 -1.012 . . . . 0.0 110.136 -179.488 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 54' ' ' LEU . . . . . . . . . . . . . 10.4 mp -65.07 -41.68 94.86 Favored 'General case' 0 N--CA 1.491 1.587 0 O-C-N 121.166 -0.958 . . . . 0.0 109.418 179.785 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -64.67 -39.38 93.57 Favored 'General case' 0 N--CA 1.488 1.428 0 O-C-N 121.282 -0.886 . . . . 0.0 109.731 -179.692 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 56' ' ' LYS . . . . . . . . . . . . . 50.9 tttp -64.08 -45.17 89.91 Favored 'General case' 0 C--N 1.305 -1.36 0 O-C-N 121.237 -0.915 . . . . 0.0 109.393 -179.94 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 57' ' ' GLN . . . . . 0.534 ' OE1' ' N ' ' A' ' 57' ' ' GLN . 0.8 OUTLIER -65.73 -43.78 87.99 Favored 'General case' 0 N--CA 1.488 1.439 0 O-C-N 121.418 -0.801 . . . . 0.0 109.508 -179.853 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 58' ' ' VAL . . . . . . . . . . . . . 56.0 t -63.35 -45.81 97.14 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.39 0 O-C-N 121.25 -0.906 . . . . 0.0 109.453 -179.801 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 59' ' ' TYR . . . . . . . . . . . . . 71.4 t80 -137.79 119.11 14.65 Favored 'General case' 0 N--CA 1.494 1.752 0 O-C-N 121.334 -0.854 . . . . 0.0 109.578 -179.502 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -69.75 153.53 43.24 Favored 'General case' 0 N--CA 1.493 1.682 0 O-C-N 121.563 -0.71 . . . . 0.0 110.538 -179.486 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 61' ' ' ASN . . . . . . . . . . . . . 98.2 m-20 57.73 36.44 26.57 Favored 'General case' 0 N--CA 1.494 1.746 0 O-C-N 121.752 -0.592 . . . . 0.0 109.671 179.897 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 62' ' ' VAL . . . . . . . . . . . . . 12.3 p -72.65 138.45 21.44 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.583 0 O-C-N 121.436 -0.79 . . . . 0.0 109.858 179.933 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 83.1 tt0 -115.61 142.19 47.07 Favored 'General case' 0 N--CA 1.497 1.921 0 O-C-N 121.571 -0.705 . . . . 0.0 109.313 -179.878 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 64' ' ' TYR . . . . . . . . . . . . . 51.4 p90 -148.29 161.27 41.86 Favored 'General case' 0 N--CA 1.493 1.709 0 O-C-N 121.365 -0.834 . . . . 0.0 109.539 -179.866 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 51.1 tp10 -141.0 147.76 39.21 Favored 'General case' 0 N--CA 1.495 1.799 0 N-CA-C 108.687 -0.857 . . . . 0.0 108.687 179.911 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 66' ' ' VAL . . . . . . . . . . . . . 28.8 m -117.82 129.08 74.77 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.805 0 CA-C-O 121.688 0.756 . . . . 0.0 109.953 -179.472 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -70.65 171.81 7.44 Favored Pre-proline 0 N--CA 1.49 1.558 0 O-C-N 121.657 -0.652 . . . . 0.0 109.61 -179.417 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 68' ' ' PRO . . . . . . . . . . . . . 73.2 Cg_exo -50.86 129.89 29.2 Favored 'Trans proline' 0 N--CA 1.497 1.7 0 C-N-CA 122.355 2.037 . . . . 0.0 112.399 179.891 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 69' ' ' VAL . . . . . . . . . . . . . 54.4 t -131.04 134.42 61.53 Favored 'Isoleucine or valine' 0 N--CA 1.499 2.016 0 O-C-N 121.455 -0.778 . . . . 0.0 109.247 179.814 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -83.36 159.73 21.78 Favored 'General case' 0 N--CA 1.491 1.577 0 O-C-N 121.434 -0.792 . . . . 0.0 109.897 -179.913 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 53.3 t0 -64.12 -36.08 82.85 Favored 'General case' 0 N--CA 1.491 1.604 0 O-C-N 121.5 -0.75 . . . . 0.0 109.662 179.562 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 72' ' ' ASN . . . . . . . . . . . . . 55.7 p30 -96.67 17.33 16.69 Favored 'General case' 0 N--CA 1.495 1.778 0 O-C-N 121.235 -0.916 . . . . 0.0 109.237 -179.726 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -61.88 144.23 55.23 Favored 'General case' 0 N--CA 1.492 1.64 0 O-C-N 121.414 -0.804 . . . . 0.0 110.167 -179.641 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 74' ' ' THR . . . . . . . . . . . . . 71.8 p -101.79 -3.07 28.69 Favored 'General case' 0 N--CA 1.496 1.826 0 O-C-N 121.48 -0.763 . . . . 0.0 109.467 179.703 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 17.0 pt-20 -148.62 158.69 44.31 Favored 'General case' 0 N--CA 1.494 1.744 0 O-C-N 121.145 -0.972 . . . . 0.0 109.361 179.624 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 5.7 tt -131.7 134.52 46.0 Favored 'General case' 0 N--CA 1.496 1.829 0 O-C-N 121.521 -0.737 . . . . 0.0 109.237 -179.981 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 77' ' ' HIS . . . . . . . . . . . . . 98.2 m-70 -103.28 130.59 50.58 Favored 'General case' 0 N--CA 1.494 1.738 0 N-CA-C 109.255 -0.646 . . . . 0.0 109.255 -179.642 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -142.53 155.01 44.98 Favored 'General case' 0 N--CA 1.494 1.725 0 O-C-N 121.286 -0.884 . . . . 0.0 109.517 -179.726 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 83.9 mtp180 -127.95 148.11 50.5 Favored 'General case' 0 N--CA 1.494 1.745 0 N-CA-C 108.957 -0.757 . . . . 0.0 108.957 -179.86 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 80' ' ' PHE . . . . . . . . . . . . . 62.4 m-85 -129.33 147.83 51.2 Favored 'General case' 0 N--CA 1.496 1.862 0 O-C-N 121.555 -0.716 . . . . 0.0 109.285 -179.572 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 70.9 mmtt -112.6 104.1 12.18 Favored 'General case' 0 N--CA 1.496 1.827 0 N-CA-C 108.79 -0.818 . . . . 0.0 108.79 -179.996 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 82' ' ' PHE . . . . . . . . . . . . . 68.1 m-85 -98.91 148.92 23.47 Favored 'General case' 0 N--CA 1.492 1.636 0 O-C-N 121.591 -0.693 . . . . 0.0 109.871 -179.263 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 82.9 tt0 -65.4 -36.82 85.13 Favored 'General case' 0 N--CA 1.488 1.431 0 O-C-N 121.48 -0.762 . . . . 0.0 109.904 -179.648 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 84' ' ' VAL . . . . . . . . . . . . . 27.4 m -133.49 156.86 42.13 Favored 'Isoleucine or valine' 0 N--CA 1.499 2.021 0 O-C-N 121.333 -0.854 . . . . 0.0 110.073 -179.582 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 27.1 t -70.15 -17.43 63.18 Favored 'General case' 0 N--CA 1.488 1.443 0 O-C-N 121.573 -0.704 . . . . 0.0 109.529 179.899 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 86' ' ' ALA . . . . . . . . . . . . . . . -62.43 -41.17 98.52 Favored 'General case' 0 N--CA 1.49 1.528 0 O-C-N 121.256 -0.902 . . . . 0.0 109.537 -179.722 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 98.9 mt-10 -65.59 -33.51 76.07 Favored 'General case' 0 C--N 1.302 -1.475 0 O-C-N 121.458 -0.776 . . . . 0.0 109.024 179.642 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 88' ' ' LYS . . . . . . . . . . . . . 88.2 tttt -62.98 -43.96 97.36 Favored 'General case' 0 C--N 1.303 -1.433 0 O-C-N 121.449 -0.782 . . . . 0.0 109.979 179.836 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 96.3 mt -62.42 -48.11 81.13 Favored 'General case' 0 N--CA 1.488 1.427 0 O-C-N 121.193 -0.942 . . . . 0.0 109.884 -179.04 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 90' ' ' ILE . . . . . 0.521 ' CD1' ' N ' ' A' ' 90' ' ' ILE . 1.4 mp -70.58 -44.44 76.8 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.599 0 O-C-N 121.3 -0.875 . . . . 0.0 109.312 179.639 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 91' ' ' PHE . . . . . 0.439 ' O ' ' OG1' ' A' ' 95' ' ' THR . 70.6 t80 -59.13 -44.56 92.03 Favored 'General case' 0 C--N 1.299 -1.606 0 O-C-N 121.461 -0.774 . . . . 0.0 109.883 -179.196 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 92' ' ' GLU . . . . . . . . . . . . . 42.8 tp10 -63.18 -59.09 5.22 Favored 'General case' 0 N--CA 1.49 1.527 0 O-C-N 121.26 -0.9 . . . . 0.0 110.3 -179.322 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 93' ' ' LEU . . . . . 0.428 ' N ' ' CD1' ' A' ' 93' ' ' LEU . 8.8 mp -63.1 -42.67 99.63 Favored 'General case' 0 N--CA 1.492 1.65 0 O-C-N 121.315 -0.866 . . . . 0.0 109.954 -179.347 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 94' ' ' LYS . . . . . . . . . . . . . 64.2 tttp -62.86 -45.29 93.27 Favored 'General case' 0 C--N 1.301 -1.505 0 O-C-N 121.298 -0.876 . . . . 0.0 109.834 -179.682 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 95' ' ' THR . . . . . 0.439 ' OG1' ' O ' ' A' ' 91' ' ' PHE . 22.0 p -65.97 -43.03 89.08 Favored 'General case' 0 N--CA 1.488 1.452 0 O-C-N 121.117 -0.989 . . . . 0.0 109.354 179.709 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 96' ' ' ARG . . . . . . . . . . . . . 93.0 mtt-85 -64.35 -38.51 91.29 Favored 'General case' 0 N--CA 1.487 1.381 0 O-C-N 121.278 -0.889 . . . . 0.0 109.02 179.36 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 97' ' ' ALA . . . . . . . . . . . . . . . -63.01 -39.89 96.11 Favored 'General case' 0 C--N 1.304 -1.388 0 O-C-N 121.537 -0.727 . . . . 0.0 109.182 179.756 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 98' ' ' LEU . . . . . . . . . . . . . 6.3 tt -63.46 -45.84 88.97 Favored 'General case' 0 N--CA 1.487 1.382 0 O-C-N 121.395 -0.815 . . . . 0.0 109.201 179.702 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 99' ' ' ALA . . . . . 0.518 ' CB ' ' HZ3' ' A' ' 47' ' ' LYS . . . -68.63 -37.69 79.93 Favored 'General case' 0 C--N 1.302 -1.48 0 O-C-N 121.522 -0.736 . . . . 0.0 109.251 179.568 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 100' ' ' ARG . . . . . 0.421 ' O ' ' O ' ' A' ' 101' ' ' LEU . 8.2 tpt180 -73.69 -16.27 61.21 Favored 'General case' 0 C--N 1.304 -1.395 0 O-C-N 121.539 -0.726 . . . . 0.0 109.308 -179.816 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 101' ' ' LEU . . . . . 0.498 ' O ' ' N ' ' A' ' 103' ' ' HIS . 47.0 tp 58.78 146.61 0.01 OUTLIER 'General case' 0 N--CA 1.488 1.425 0 CA-C-O 121.663 0.744 . . . . 0.0 110.455 -179.983 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 102' ' ' GLU . . . . . . . . . . . . . 47.1 tp10 -53.08 87.33 0.0 OUTLIER 'General case' 0 N--CA 1.489 1.521 0 CA-C-O 121.451 0.643 . . . . 0.0 109.764 -179.684 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 103' ' ' HIS . . . . . 0.498 ' N ' ' O ' ' A' ' 101' ' ' LEU . 86.4 t60 -66.54 -40.05 88.88 Favored 'General case' 0 C--N 1.301 -1.529 0 CA-C-O 121.52 0.676 . . . . 0.0 109.512 179.406 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 104' ' ' HIS . . . . . 0.449 ' O ' ' O ' ' A' ' 105' ' ' HIS . 75.4 m80 -51.1 126.78 17.35 Favored 'General case' 0 N--CA 1.489 1.498 0 O-C-N 121.317 -0.864 . . . . 0.0 110.348 -179.083 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 105' ' ' HIS . . . . . 0.449 ' O ' ' O ' ' A' ' 104' ' ' HIS . 79.0 m80 43.86 -171.17 0.01 OUTLIER 'General case' 0 N--CA 1.493 1.715 0 CA-C-O 121.788 0.804 . . . . 0.0 110.606 179.431 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 106' ' ' HIS . . . . . 0.414 ' CG ' ' O ' ' A' ' 105' ' ' HIS . 98.5 m-70 -155.04 37.3 0.4 Allowed 'General case' 0 N--CA 1.488 1.475 0 N-CA-C 108.277 -1.008 . . . . 0.0 108.277 -179.947 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 107' ' ' HIS . . . . . . . . . . . . . 1.7 p80 -67.81 141.23 56.57 Favored 'General case' 0 N--CA 1.489 1.523 0 O-C-N 121.413 -0.804 . . . . 0.0 110.171 -179.103 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 108' ' ' HIS . . . . . . . . . . . . . 58.8 t-80 . . . . . 0 N--CA 1.492 1.628 0 CA-C-O 118.014 -0.993 . . . . 0.0 109.839 -179.987 . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 41.5 tpp . . . . . 0 N--CA 1.49 1.537 0 CA-C-O 121.541 0.686 . . . . 0.0 109.3 . . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 40.1 t -67.95 146.0 54.0 Favored 'General case' 0 N--CA 1.491 1.598 0 CA-C-O 121.495 0.664 . . . . 0.0 110.188 -179.727 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 3' ' ' ASN . . . . . . . . . . . . . 11.9 m120 -63.91 -39.61 94.57 Favored 'General case' 0 N--CA 1.489 1.524 0 N-CA-C 109.217 -0.66 . . . . 0.0 109.217 -179.667 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 4' ' ' GLN . . . . . 0.468 ' O ' ' NE2' ' A' ' 4' ' ' GLN . 5.1 pp0? -95.25 139.25 31.84 Favored 'General case' 0 N--CA 1.494 1.733 0 CA-C-O 121.707 0.765 . . . . 0.0 109.793 -179.769 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 5' ' ' THR . . . . . 0.457 ' O ' ' SG ' ' A' ' 6' ' ' CYS . 11.7 m -101.67 -46.46 4.94 Favored 'General case' 0 N--CA 1.492 1.636 0 N-CA-C 109.13 -0.693 . . . . 0.0 109.13 -179.822 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 6' ' ' CYS . . . . . 0.457 ' SG ' ' O ' ' A' ' 5' ' ' THR . 25.2 m -153.22 168.03 27.33 Favored 'General case' 0 N--CA 1.494 1.746 0 CA-C-O 121.675 0.75 . . . . 0.0 109.899 179.994 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 7' ' ' VAL . . . . . 0.423 ' C ' ' H ' ' A' ' 9' ' ' ASN . 14.6 t -76.8 130.53 36.16 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.576 0 CA-C-O 121.706 0.765 . . . . 0.0 110.317 -179.035 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 8' ' ' GLU . . . . . 0.508 ' N ' ' OE1' ' A' ' 8' ' ' GLU . 57.3 mp0 -80.27 20.93 0.63 Allowed 'General case' 0 N--CA 1.49 1.533 0 N-CA-C 109.441 -0.577 . . . . 0.0 109.441 -179.848 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 9' ' ' ASN . . . . . 0.437 ' O ' ' O ' ' A' ' 10' ' ' GLU . 13.3 m120 56.44 34.89 25.04 Favored 'General case' 0 N--CA 1.493 1.712 0 CA-C-O 121.322 0.582 . . . . 0.0 109.495 179.616 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 10' ' ' GLU . . . . . 0.482 ' OE1' ' N ' ' A' ' 10' ' ' GLU . 56.9 mp0 47.73 177.94 0.01 OUTLIER 'General case' 0 N--CA 1.49 1.55 0 CA-C-O 121.658 0.742 . . . . 0.0 111.129 179.512 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 32.9 m -84.17 135.58 24.54 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.516 0 CA-C-O 121.644 0.735 . . . . 0.0 110.234 -179.083 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 52.6 m 50.4 100.83 0.01 OUTLIER 'General case' 0 N--CA 1.491 1.582 0 CA-C-O 121.735 0.779 . . . . 0.0 110.003 179.984 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 13' ' ' GLU . . . . . 0.406 ' OE1' ' N ' ' A' ' 13' ' ' GLU . 59.1 mp0 -69.88 126.92 31.14 Favored 'General case' 0 N--CA 1.488 1.433 0 CA-C-O 121.765 0.793 . . . . 0.0 110.405 -179.643 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -174.26 -68.16 0.01 OUTLIER 'General case' 0 C--N 1.303 -1.445 0 N-CA-C 109.272 -0.64 . . . . 0.0 109.272 179.517 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 10.5 t -82.77 135.24 35.04 Favored 'General case' 0 N--CA 1.494 1.745 0 CA-C-O 121.704 0.764 . . . . 0.0 110.232 -179.215 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . -157.07 114.57 0.62 Allowed Glycine 0 N--CA 1.489 2.209 0 N-CA-C 110.206 -1.157 . . . . 0.0 110.206 -179.946 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 52.3 t -85.24 84.29 7.72 Favored 'General case' 0 N--CA 1.493 1.721 0 O-C-N 121.776 -0.838 . . . . 0.0 109.682 179.74 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -68.74 140.72 55.36 Favored 'General case' 0 N--CA 1.492 1.655 0 CA-C-O 121.732 0.777 . . . . 0.0 110.415 -179.728 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -70.3 120.38 9.29 Favored Glycine 0 N--CA 1.489 2.232 0 N-CA-C 110.44 -1.064 . . . . 0.0 110.44 -179.448 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 82.5 tt0 -172.03 -23.65 0.01 OUTLIER 'General case' 0 N--CA 1.488 1.465 0 O-C-N 121.974 -0.721 . . . . 0.0 109.215 179.397 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 21' ' ' ILE . . . . . . . . . . . . . 35.4 pt -81.27 141.95 14.46 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.858 0 CA-C-O 121.713 0.768 . . . . 0.0 110.326 -179.853 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . -88.64 123.11 6.63 Favored Glycine 0 N--CA 1.492 2.383 0 N-CA-C 110.542 -1.023 . . . . 0.0 110.542 -179.153 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 23' ' ' PHE . . . . . 0.422 ' O ' ' CD1' ' A' ' 23' ' ' PHE . 53.2 p90 -111.93 132.0 55.03 Favored 'General case' 0 N--CA 1.495 1.806 0 CA-C-O 121.894 0.855 . . . . 0.0 109.741 179.347 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 24' ' ' ILE . . . . . 0.546 ' C ' ' H ' ' A' ' 26' ' ' ARG . 96.4 mt -85.16 -85.64 0.08 OUTLIER 'Isoleucine or valine' 0 N--CA 1.49 1.55 0 CA-C-N 116.032 -0.531 . . . . 0.0 109.576 -179.513 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 25' ' ' ILE . . . . . 0.447 ' CG2' ' O ' ' A' ' 25' ' ' ILE . 96.2 mt 47.2 10.54 0.03 OUTLIER 'Isoleucine or valine' 0 N--CA 1.495 1.782 0 CA-C-O 121.409 0.623 . . . . 0.0 109.596 -179.554 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 26' ' ' ARG . . . . . 0.546 ' H ' ' C ' ' A' ' 24' ' ' ILE . 41.2 ttm180 -107.05 127.2 53.25 Favored 'General case' 0 N--CA 1.491 1.625 0 O-C-N 121.269 -0.895 . . . . 0.0 110.139 179.839 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 26.0 tt0 57.07 40.44 28.46 Favored 'General case' 0 N--CA 1.491 1.623 0 CA-C-O 121.627 0.727 . . . . 0.0 109.586 179.237 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . -83.24 9.88 59.93 Favored Glycine 0 N--CA 1.494 2.541 0 N-CA-C 109.61 -1.396 . . . . 0.0 109.61 -179.999 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 98.7 m-20 57.09 24.95 10.23 Favored 'General case' 0 N--CA 1.494 1.769 0 CA-C-O 121.439 0.638 . . . . 0.0 109.428 -179.887 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 44.2 p30 -162.82 26.34 0.1 Allowed 'General case' 0 N--CA 1.493 1.7 0 N-CA-C 109.007 -0.738 . . . . 0.0 109.007 178.647 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 31' ' ' VAL . . . . . 0.422 ' CG1' HH21 ' A' ' 79' ' ' ARG . 93.3 t -118.71 134.56 61.93 Favored 'Isoleucine or valine' 0 N--CA 1.499 2.016 0 CA-C-O 121.712 0.768 . . . . 0.0 109.452 -179.822 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -98.88 157.2 16.47 Favored 'General case' 0 N--CA 1.494 1.745 0 CA-C-O 121.787 0.803 . . . . 0.0 110.409 -179.019 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 33' ' ' GLU . . . . . 0.424 ' OE1' ' CD ' ' A' ' 79' ' ' ARG . 48.9 tp10 -108.03 126.0 52.22 Favored 'General case' 0 N--CA 1.493 1.7 0 CA-C-O 121.716 0.769 . . . . 0.0 110.13 -179.186 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 34' ' ' VAL . . . . . . . . . . . . . 54.0 t -124.24 133.62 68.85 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.875 0 CA-C-O 121.629 0.728 . . . . 0.0 109.626 179.635 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 74.0 p -137.03 126.91 25.72 Favored 'General case' 0 N--CA 1.494 1.752 0 CA-C-O 121.854 0.835 . . . . 0.0 110.042 179.276 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 40.0 tp -117.41 132.41 56.58 Favored 'General case' 0 N--CA 1.49 1.527 0 CA-C-O 121.665 0.745 . . . . 0.0 109.788 179.74 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 37' ' ' PHE . . . . . . . . . . . . . 90.7 t80 -109.04 131.1 55.4 Favored 'General case' 0 N--CA 1.493 1.707 0 CA-C-O 121.868 0.842 . . . . 0.0 109.582 179.99 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . -173.14 -164.23 28.15 Favored Glycine 0 N--CA 1.487 2.061 0 N-CA-C 109.867 -1.293 . . . . 0.0 109.867 -179.689 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 39' ' ' SER . . . . . 0.653 ' HG ' ' H ' ' A' ' 40' ' ' ASP . 22.9 t -62.55 -147.56 0.0 OUTLIER 'General case' 0 N--CA 1.49 1.534 0 O-C-N 121.891 -0.77 . . . . 0.0 110.726 -179.237 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 40' ' ' ASP . . . . . 0.653 ' H ' ' HG ' ' A' ' 39' ' ' SER . 44.6 p-10 -55.94 174.77 0.11 Allowed 'General case' 0 N--CA 1.488 1.444 0 CA-C-O 121.771 0.795 . . . . 0.0 110.807 -178.812 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 88.7 tttt -62.53 -41.16 98.69 Favored 'General case' 0 N--CA 1.49 1.554 0 CA-C-O 121.225 0.536 . . . . 0.0 109.868 -179.075 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -53.67 -46.83 70.76 Favored 'General case' 0 N--CA 1.492 1.647 0 O-C-N 121.897 -0.502 . . . . 0.0 109.978 -178.965 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 43' ' ' HIS . . . . . . . . . . . . . 59.1 t-80 -62.96 -40.8 98.78 Favored 'General case' 0 C--N 1.302 -1.476 0 O-C-N 121.749 -0.595 . . . . 0.0 109.462 -179.619 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 95.1 mt -63.33 -39.99 96.08 Favored 'General case' 0 N--CA 1.491 1.592 0 O-C-N 121.805 -0.559 . . . . 0.0 109.546 -179.702 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 95.1 mt-10 -61.28 -41.02 96.24 Favored 'General case' 0 N--CA 1.49 1.555 0 N-CA-C 109.262 -0.644 . . . . 0.0 109.262 -179.756 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . -61.17 -42.5 99.8 Favored Glycine 0 N--CA 1.492 2.376 0 N-CA-C 109.65 -1.38 . . . . 0.0 109.65 -179.725 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 71.2 mmtt -81.53 -21.14 38.76 Favored 'General case' 0 N--CA 1.492 1.647 0 O-C-N 121.702 -0.881 . . . . 0.0 108.953 -179.801 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 44.9 tp -63.41 -40.15 96.42 Favored 'General case' 0 N--CA 1.489 1.504 0 CA-C-O 121.308 0.575 . . . . 0.0 109.48 -179.694 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 49' ' ' ALA . . . . . . . . . . . . . . . -49.89 -38.16 34.52 Favored 'General case' 0 N--CA 1.492 1.628 0 O-C-N 121.846 -0.534 . . . . 0.0 109.933 -178.635 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 50' ' ' GLU . . . . . 0.52 ' OE1' ' N ' ' A' ' 50' ' ' GLU . 56.5 mp0 -68.01 -43.14 79.5 Favored 'General case' 0 N--CA 1.491 1.581 0 O-C-N 121.635 -0.666 . . . . 0.0 109.777 -179.929 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 10.0 m-85 -63.07 -45.48 91.97 Favored 'General case' 0 N--CA 1.492 1.635 0 N-CA-C 109.58 -0.526 . . . . 0.0 109.58 -179.337 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 52' ' ' ILE . . . . . . . . . . . . . 92.0 mt -64.97 -42.75 95.57 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.531 0 N-CA-C 109.331 -0.618 . . . . 0.0 109.331 -179.746 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 49.6 m -57.43 -41.31 80.21 Favored 'General case' 0 N--CA 1.495 1.776 0 O-C-N 121.815 -0.553 . . . . 0.0 109.608 -179.151 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 54' ' ' LEU . . . . . . . . . . . . . 82.6 mt -63.35 -40.21 96.64 Favored 'General case' 0 N--CA 1.491 1.584 0 N-CA-C 109.336 -0.616 . . . . 0.0 109.336 179.964 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -59.26 -42.77 91.96 Favored 'General case' 0 N--CA 1.489 1.484 0 N-CA-C 109.194 -0.669 . . . . 0.0 109.194 -179.417 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 56' ' ' LYS . . . . . . . . . . . . . 64.1 tttp -65.46 -41.02 93.85 Favored 'General case' 0 N--CA 1.486 1.339 0 CA-C-O 121.265 0.555 . . . . 0.0 109.624 179.984 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 16.5 tt0 -64.07 -43.75 94.5 Favored 'General case' 0 N--CA 1.491 1.58 0 O-C-N 121.76 -0.587 . . . . 0.0 109.587 -179.274 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 58' ' ' VAL . . . . . . . . . . . . . 72.1 t -65.38 -44.89 94.45 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.563 0 N-CA-C 109.561 -0.533 . . . . 0.0 109.561 -179.708 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 59' ' ' TYR . . . . . 0.417 ' O ' ' O ' ' A' ' 60' ' ' ALA . 58.4 t80 -127.12 132.33 50.61 Favored 'General case' 0 N--CA 1.498 1.945 0 CA-C-O 121.812 0.815 . . . . 0.0 109.611 -179.595 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 60' ' ' ALA . . . . . 0.417 ' O ' ' O ' ' A' ' 59' ' ' TYR . . . -42.34 -97.0 0.0 OUTLIER 'General case' 0 N--CA 1.491 1.593 0 CA-C-O 121.378 0.608 . . . . 0.0 110.739 -179.281 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 61' ' ' ASN . . . . . . . . . . . . . 20.2 t-20 -85.05 92.62 8.4 Favored 'General case' 0 N--CA 1.491 1.581 0 CA-C-O 121.713 0.768 . . . . 0.0 109.856 -178.74 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 62' ' ' VAL . . . . . . . . . . . . . 10.9 p -99.45 133.71 41.27 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.717 0 CA-C-O 121.801 0.81 . . . . 0.0 110.037 179.995 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 81.0 tt0 -105.13 143.7 32.95 Favored 'General case' 0 N--CA 1.49 1.546 0 CA-C-O 121.702 0.763 . . . . 0.0 109.283 179.979 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 64' ' ' TYR . . . . . . . . . . . . . 51.0 p90 -151.96 161.15 43.1 Favored 'General case' 0 C--N 1.303 -1.443 0 CA-C-O 121.962 0.887 . . . . 0.0 110.493 -179.594 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 47.7 tp10 -147.18 146.95 30.04 Favored 'General case' 0 N--CA 1.49 1.57 0 CA-C-O 121.729 0.776 . . . . 0.0 109.32 179.83 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 66' ' ' VAL . . . . . . . . . . . . . 88.4 t -102.57 125.13 56.91 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.707 0 CA-C-O 121.866 0.841 . . . . 0.0 109.935 -179.926 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -76.97 171.08 13.36 Favored Pre-proline 0 C--N 1.304 -1.41 0 CA-C-O 121.227 0.536 . . . . 0.0 109.935 -179.72 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 68' ' ' PRO . . . . . . . . . . . . . 51.1 Cg_exo -54.48 137.32 72.38 Favored 'Trans proline' 0 N--CA 1.496 1.62 0 C-N-CA 122.965 2.443 . . . . 0.0 113.057 -179.923 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 69' ' ' VAL . . . . . 0.481 ' C ' ' H ' ' A' ' 71' ' ' ASP . 73.2 t -128.39 131.91 68.57 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.928 0 CA-C-O 121.848 0.832 . . . . 0.0 110.087 179.963 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 70' ' ' ALA . . . . . 0.646 ' O ' ' N ' ' A' ' 72' ' ' ASN . . . -74.8 34.25 0.1 Allowed 'General case' 0 N--CA 1.491 1.6 0 CA-C-N 116.154 -0.475 . . . . 0.0 109.963 179.811 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 71' ' ' ASP . . . . . 0.481 ' H ' ' C ' ' A' ' 69' ' ' VAL . 66.4 t0 54.78 -72.52 0.01 OUTLIER 'General case' 0 N--CA 1.493 1.708 0 CA-C-O 121.448 0.642 . . . . 0.0 109.969 179.693 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 72' ' ' ASN . . . . . 0.646 ' N ' ' O ' ' A' ' 70' ' ' ALA . 63.8 t30 -84.67 12.54 6.99 Favored 'General case' 0 C--N 1.301 -1.533 0 N-CA-C 108.626 -0.879 . . . . 0.0 108.626 179.941 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 73' ' ' ALA . . . . . 0.532 ' C ' ' H ' ' A' ' 75' ' ' GLU . . . -52.16 -6.53 0.05 OUTLIER 'General case' 0 N--CA 1.497 1.902 0 N-CA-C 109.503 -0.554 . . . . 0.0 109.503 179.95 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 74' ' ' THR . . . . . 0.56 ' H ' ' C ' ' A' ' 72' ' ' ASN . 70.4 p 51.03 11.59 0.1 Allowed 'General case' 0 C--N 1.304 -1.411 0 CA-C-O 121.469 0.652 . . . . 0.0 109.296 -179.771 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 75' ' ' GLU . . . . . 0.532 ' H ' ' C ' ' A' ' 73' ' ' ALA . 81.9 tt0 -149.63 151.98 34.66 Favored 'General case' 0 C--N 1.302 -1.457 0 CA-C-O 121.666 0.746 . . . . 0.0 109.446 179.582 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 7.2 tt -128.31 131.08 48.67 Favored 'General case' 0 N--CA 1.489 1.493 0 CA-C-O 121.796 0.807 . . . . 0.0 109.798 179.848 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 77' ' ' HIS . . . . . . . . . . . . . 98.3 m-70 -101.91 128.87 48.11 Favored 'General case' 0 N--CA 1.495 1.781 0 CA-C-O 121.906 0.86 . . . . 0.0 109.92 -180.0 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -136.0 152.2 50.69 Favored 'General case' 0 N--CA 1.491 1.595 0 CA-C-O 121.674 0.749 . . . . 0.0 109.88 179.991 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 79' ' ' ARG . . . . . 0.424 ' CD ' ' OE1' ' A' ' 33' ' ' GLU . 50.1 mmm-85 -127.7 144.53 51.07 Favored 'General case' 0 N--CA 1.494 1.74 0 CA-C-O 121.755 0.788 . . . . 0.0 109.544 -179.25 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 80' ' ' PHE . . . . . . . . . . . . . 82.1 m-85 -130.6 150.78 51.64 Favored 'General case' 0 N--CA 1.494 1.741 0 CA-C-O 121.571 0.7 . . . . 0.0 109.819 -179.385 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 63.1 tttm -114.96 127.9 55.96 Favored 'General case' 0 N--CA 1.495 1.793 0 CA-C-O 121.722 0.772 . . . . 0.0 110.041 -179.514 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 82' ' ' PHE . . . . . . . . . . . . . 81.1 m-85 -129.37 143.9 51.03 Favored 'General case' 0 N--CA 1.496 1.852 0 CA-C-O 121.732 0.777 . . . . 0.0 109.904 179.579 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 6.8 pt-20 -69.39 -34.27 74.27 Favored 'General case' 0 N--CA 1.489 1.491 0 N-CA-C 109.487 -0.56 . . . . 0.0 109.487 -179.672 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 84' ' ' VAL . . . . . . . . . . . . . 26.8 m -131.37 161.03 41.86 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.924 0 CA-C-O 121.885 0.85 . . . . 0.0 110.29 -179.629 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 33.6 m -76.54 -17.48 59.22 Favored 'General case' 0 N--CA 1.492 1.653 0 CA-C-N 116.055 -0.521 . . . . 0.0 109.91 -179.209 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 86' ' ' ALA . . . . . . . . . . . . . . . -62.71 -40.83 98.38 Favored 'General case' 0 N--CA 1.491 1.61 0 N-CA-C 109.129 -0.693 . . . . 0.0 109.129 -179.435 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 97.4 mt-10 -71.69 -32.16 67.54 Favored 'General case' 0 N--CA 1.49 1.541 0 N-CA-C 109.112 -0.699 . . . . 0.0 109.112 179.889 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 88' ' ' LYS . . . . . . . . . . . . . 88.0 tttt -62.84 -47.58 82.76 Favored 'General case' 0 N--CA 1.489 1.506 0 O-C-N 121.789 -0.569 . . . . 0.0 109.51 -179.711 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 96.9 mt -63.76 -45.54 89.33 Favored 'General case' 0 N--CA 1.491 1.587 0 O-C-N 121.745 -0.597 . . . . 0.0 110.151 -179.1 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 90' ' ' ILE . . . . . . . . . . . . . 96.9 mt -68.32 -43.96 84.07 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.636 0 CA-C-O 121.399 0.619 . . . . 0.0 109.41 -179.717 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 91' ' ' PHE . . . . . . . . . . . . . 40.3 t80 -61.78 -46.95 87.37 Favored 'General case' 0 N--CA 1.489 1.486 0 N-CA-C 109.28 -0.637 . . . . 0.0 109.28 -179.512 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 92' ' ' GLU . . . . . . . . . . . . . 95.4 mt-10 -67.32 -33.76 75.94 Favored 'General case' 0 N--CA 1.489 1.477 0 N-CA-C 109.142 -0.688 . . . . 0.0 109.142 179.751 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 93' ' ' LEU . . . . . . . . . . . . . 49.4 tp -63.75 -45.68 88.74 Favored 'General case' 0 N--CA 1.487 1.379 0 CA-C-O 121.373 0.606 . . . . 0.0 109.42 -179.559 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 94' ' ' LYS . . . . . . . . . . . . . 7.9 mtpm? -66.98 -44.02 81.51 Favored 'General case' 0 N--CA 1.489 1.515 0 O-C-N 121.749 -0.595 . . . . 0.0 109.812 -179.446 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 67.0 p -67.53 -33.8 75.81 Favored 'General case' 0 N--CA 1.491 1.622 0 O-C-N 121.783 -0.573 . . . . 0.0 109.773 -179.262 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 96' ' ' ARG . . . . . . . . . . . . . 61.3 ttm-85 -62.62 -43.47 98.73 Favored 'General case' 0 N--CA 1.492 1.656 0 O-C-N 121.676 -0.64 . . . . 0.0 109.508 -179.563 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 97' ' ' ALA . . . . . . . . . . . . . . . -66.79 -34.32 77.56 Favored 'General case' 0 N--CA 1.492 1.647 0 N-CA-C 109.522 -0.547 . . . . 0.0 109.522 -179.661 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 98' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -61.86 -45.07 95.36 Favored 'General case' 0 N--CA 1.486 1.33 0 O-C-N 121.542 -0.724 . . . . 0.0 109.131 -178.955 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 99' ' ' ALA . . . . . . . . . . . . . . . -65.88 -36.2 82.77 Favored 'General case' 0 N--CA 1.492 1.626 0 CA-C-O 121.263 0.554 . . . . 0.0 109.63 -179.35 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 100' ' ' ARG . . . . . . . . . . . . . 78.1 ttt180 -68.36 -16.48 63.95 Favored 'General case' 0 N--CA 1.489 1.494 0 N-CA-C 108.692 -0.855 . . . . 0.0 108.692 -179.783 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 101' ' ' LEU . . . . . . . . . . . . . 79.5 mt 53.31 68.19 0.88 Allowed 'General case' 0 N--CA 1.488 1.431 0 CA-C-O 121.558 0.694 . . . . 0.0 109.788 179.678 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 102' ' ' GLU . . . . . . . . . . . . . 97.6 mt-10 -68.66 146.12 53.29 Favored 'General case' 0 N--CA 1.488 1.446 0 CA-C-O 121.657 0.741 . . . . 0.0 110.206 -179.985 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 103' ' ' HIS . . . . . . . . . . . . . 73.9 m80 -74.31 142.29 45.2 Favored 'General case' 0 N--CA 1.488 1.43 0 CA-C-O 121.534 0.683 . . . . 0.0 110.031 -179.547 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 104' ' ' HIS . . . . . . . . . . . . . 78.5 m80 -118.13 154.55 31.93 Favored 'General case' 0 N--CA 1.495 1.792 0 CA-C-O 121.876 0.846 . . . . 0.0 110.284 -179.751 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 105' ' ' HIS . . . . . . . . . . . . . 60.8 m170 -69.8 139.98 53.27 Favored 'General case' 0 N--CA 1.49 1.559 0 CA-C-O 121.588 0.709 . . . . 0.0 109.932 -179.398 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 106' ' ' HIS . . . . . . . . . . . . . 77.1 m80 -61.74 -41.71 98.01 Favored 'General case' 0 C--N 1.302 -1.469 0 N-CA-C 109.648 -0.501 . . . . 0.0 109.648 -179.372 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 107' ' ' HIS . . . . . . . . . . . . . 98.2 m-70 -77.87 137.83 38.59 Favored 'General case' 0 N--CA 1.492 1.665 0 CA-C-O 121.613 0.721 . . . . 0.0 110.035 -179.8 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 108' ' ' HIS . . . . . . . . . . . . . 85.9 t60 . . . . . 0 N--CA 1.491 1.618 0 CA-C-O 117.842 -1.075 . . . . 0.0 109.715 179.85 . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' A' A ' 1' ' ' MET . . . . . 0.581 ' N ' ' SD ' ' A' ' 1' ' ' MET . 0.0 OUTLIER . . . . . 0 N--CA 1.489 1.475 0 CA-C-O 121.567 0.699 . . . . 0.0 110.006 . . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 2.0 m 50.28 27.61 2.76 Favored 'General case' 0 N--CA 1.496 1.872 0 CA-C-O 121.454 0.645 . . . . 0.0 109.915 -179.624 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 3' ' ' ASN . . . . . 0.436 ' O ' ' O ' ' A' ' 4' ' ' GLN . 64.1 t30 61.75 123.95 0.01 OUTLIER 'General case' 0 N--CA 1.493 1.683 0 CA-C-O 121.573 0.701 . . . . 0.0 110.038 179.087 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 4' ' ' GLN . . . . . 0.557 ' O ' ' N ' ' A' ' 6' ' ' CYS . 88.1 mt-30 -50.88 -102.11 0.0 OUTLIER 'General case' 0 N--CA 1.49 1.535 0 CA-C-O 121.378 0.609 . . . . 0.0 109.596 -179.398 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 75.1 m 41.39 -90.17 0.01 OUTLIER 'General case' 0 N--CA 1.487 1.425 0 CA-C-O 121.376 0.608 . . . . 0.0 110.032 -179.482 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 6' ' ' CYS . . . . . 0.557 ' N ' ' O ' ' A' ' 4' ' ' GLN . 1.6 p -88.31 102.24 14.66 Favored 'General case' 0 N--CA 1.492 1.637 0 CA-C-O 121.893 0.854 . . . . 0.0 109.623 -179.69 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 7' ' ' VAL . . . . . . . . . . . . . 15.5 t -97.23 108.93 22.33 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.651 0 CA-C-O 121.766 0.793 . . . . 0.0 109.866 179.892 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 79.8 tt0 39.73 65.51 0.7 Allowed 'General case' 0 N--CA 1.496 1.835 0 CA-C-O 121.774 0.797 . . . . 0.0 109.915 179.568 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 9' ' ' ASN . . . . . 0.409 ' ND2' ' CB ' ' A' ' 6' ' ' CYS . 93.5 m-20 -80.86 -79.08 0.16 Allowed 'General case' 0 N--CA 1.494 1.747 0 O-C-N 121.547 -0.721 . . . . 0.0 109.385 -179.878 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 97.9 mt-10 44.59 -165.95 0.01 OUTLIER 'General case' 0 N--CA 1.492 1.663 0 CA-C-O 121.688 0.756 . . . . 0.0 110.609 -179.836 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 73.7 t -83.5 132.46 31.39 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.568 0 CA-C-O 121.841 0.829 . . . . 0.0 109.918 -179.315 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 2.9 p -75.01 144.96 42.84 Favored 'General case' 0 N--CA 1.489 1.499 0 CA-C-O 121.832 0.825 . . . . 0.0 110.387 -179.524 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 22.4 tp10 66.09 28.5 10.29 Favored 'General case' 0 N--CA 1.489 1.521 0 CA-C-O 121.545 0.688 . . . . 0.0 109.371 179.457 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -88.5 -6.32 57.68 Favored 'General case' 0 N--CA 1.493 1.682 0 O-C-N 121.455 -0.778 . . . . 0.0 109.055 179.749 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 28.2 p -156.95 164.18 38.31 Favored 'General case' 0 N--CA 1.491 1.615 0 CA-C-O 121.858 0.837 . . . . 0.0 110.118 179.779 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . -64.79 160.64 41.24 Favored Glycine 0 N--CA 1.491 2.311 0 N-CA-C 110.688 -0.965 . . . . 0.0 110.688 -179.179 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 93.8 m -86.76 144.19 27.19 Favored 'General case' 0 N--CA 1.493 1.68 0 O-C-N 121.86 -0.788 . . . . 0.0 110.138 -179.623 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -79.88 -7.08 58.52 Favored 'General case' 0 N--CA 1.492 1.647 0 N-CA-C 109.131 -0.692 . . . . 0.0 109.131 -179.575 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -79.0 -3.53 88.23 Favored Glycine 0 N--CA 1.493 2.452 0 N-CA-C 108.992 -1.643 . . . . 0.0 108.992 -179.936 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 79.8 mm-40 -73.86 132.67 42.77 Favored 'General case' 0 N--CA 1.493 1.712 0 O-C-N 121.642 -0.916 . . . . 0.0 110.064 -179.577 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 21' ' ' ILE . . . . . . . . . . . . . 20.0 tt -89.19 131.73 35.76 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.7 0 CA-C-O 121.959 0.885 . . . . 0.0 109.964 -179.788 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . -167.7 -109.11 0.21 Allowed Glycine 0 N--CA 1.487 2.053 0 N-CA-C 109.579 -1.409 . . . . 0.0 109.579 179.942 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 23' ' ' PHE . . . . . 0.428 ' O ' ' O ' ' A' ' 24' ' ' ILE . 76.1 m-85 -109.54 -107.17 0.35 Allowed 'General case' 0 N--CA 1.497 1.924 0 O-C-N 121.63 -0.923 . . . . 0.0 109.509 -179.232 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 24' ' ' ILE . . . . . 0.428 ' O ' ' O ' ' A' ' 23' ' ' PHE . 96.7 mt 49.42 100.43 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.49 1.543 0 CA-C-O 121.637 0.732 . . . . 0.0 109.677 -179.753 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 25' ' ' ILE . . . . . . . . . . . . . 92.0 mt -79.29 129.12 38.04 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.733 0 CA-C-O 121.937 0.875 . . . . 0.0 110.237 -179.637 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 80.5 mtp85 -99.42 9.61 42.96 Favored 'General case' 0 N--CA 1.498 1.953 0 CA-C-N 115.908 -0.587 . . . . 0.0 109.69 -179.331 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 93.5 mt-10 -74.58 51.05 0.45 Allowed 'General case' 0 N--CA 1.492 1.667 0 N-CA-C 108.644 -0.873 . . . . 0.0 108.644 179.565 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 28' ' ' GLY . . . . . 0.513 ' C ' ' H ' ' A' ' 30' ' ' ASP . . . -45.89 156.2 0.48 Allowed Glycine 0 N--CA 1.491 2.322 0 N-CA-C 109.954 -1.258 . . . . 0.0 109.954 -179.878 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 1.3 m-20 70.29 -44.05 0.56 Allowed 'General case' 0 N--CA 1.488 1.449 0 N-CA-C 108.874 -0.787 . . . . 0.0 108.874 -179.744 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 30' ' ' ASP . . . . . 0.513 ' H ' ' C ' ' A' ' 28' ' ' GLY . 96.0 m-20 -96.83 9.7 41.07 Favored 'General case' 0 N--CA 1.494 1.77 0 N-CA-C 109.13 -0.693 . . . . 0.0 109.13 179.974 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 3.8 p -129.22 154.04 39.52 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.861 0 CA-C-O 121.641 0.734 . . . . 0.0 109.799 -179.69 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -122.51 142.02 51.03 Favored 'General case' 0 N--CA 1.496 1.853 0 CA-C-O 121.937 0.875 . . . . 0.0 109.819 -179.896 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 21.9 pt-20 -94.36 138.01 32.83 Favored 'General case' 0 N--CA 1.492 1.669 0 CA-C-O 121.782 0.801 . . . . 0.0 110.444 -179.154 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 34' ' ' VAL . . . . . . . . . . . . . 55.0 t -127.01 130.83 71.32 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.834 0 CA-C-O 121.844 0.83 . . . . 0.0 109.263 179.371 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 51.1 m -133.53 128.73 35.91 Favored 'General case' 0 N--CA 1.495 1.809 0 CA-C-O 121.522 0.677 . . . . 0.0 109.315 179.355 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 74.1 mt -119.43 151.37 38.64 Favored 'General case' 0 N--CA 1.499 1.996 0 CA-C-O 121.863 0.84 . . . . 0.0 110.223 -179.39 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 37' ' ' PHE . . . . . . . . . . . . . 96.1 m-85 -124.56 137.92 54.36 Favored 'General case' 0 N--CA 1.497 1.881 0 CA-C-O 121.866 0.841 . . . . 0.0 109.702 -179.669 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . 177.2 179.89 47.73 Favored Glycine 0 N--CA 1.491 2.339 0 N-CA-C 110.296 -1.122 . . . . 0.0 110.296 -179.984 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 36.0 p -88.48 -76.69 0.39 Allowed 'General case' 0 N--CA 1.491 1.605 0 O-C-N 121.718 -0.871 . . . . 0.0 109.877 -179.705 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 40' ' ' ASP . . . . . . . . . . . . . 32.9 t70 -80.36 155.46 27.17 Favored 'General case' 0 N--CA 1.497 1.884 0 O-C-N 121.318 -0.864 . . . . 0.0 110.666 -179.2 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 88.8 tttt -63.37 -39.84 95.63 Favored 'General case' 0 N--CA 1.489 1.48 0 CA-C-O 121.107 0.479 . . . . 0.0 110.117 -179.645 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -54.93 -38.9 68.25 Favored 'General case' 0 N--CA 1.492 1.668 0 O-C-N 121.551 -0.718 . . . . 0.0 109.45 -178.951 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 43' ' ' HIS . . . . . 0.636 ' CE1' ' NZ ' ' A' ' 47' ' ' LYS . 11.5 t-160 -67.54 -42.27 82.97 Favored 'General case' 0 N--CA 1.495 1.778 0 O-C-N 121.751 -0.593 . . . . 0.0 109.409 -179.999 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 96.0 mt -63.02 -40.54 98.07 Favored 'General case' 0 N--CA 1.487 1.385 0 N-CA-C 106.527 -1.657 . . . . 0.0 106.527 178.72 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 77.0 mm-40 -64.36 -32.04 73.49 Favored 'General case' 0 N--CA 1.487 1.409 0 CA-C-N 115.726 -0.67 . . . . 0.0 109.446 179.241 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . -61.33 -50.0 71.5 Favored Glycine 0 N--CA 1.495 2.589 0 N-CA-C 109.507 -1.437 . . . . 0.0 109.507 -179.756 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 47' ' ' LYS . . . . . 0.636 ' NZ ' ' CE1' ' A' ' 43' ' ' HIS . 62.2 mttp -65.99 -38.62 88.98 Favored 'General case' 0 N--CA 1.49 1.536 0 O-C-N 121.678 -0.895 . . . . 0.0 109.039 179.561 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 61.8 tp -56.07 -34.19 65.73 Favored 'General case' 0 C--N 1.302 -1.471 0 N-CA-C 109.348 -0.612 . . . . 0.0 109.348 -179.167 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 49' ' ' ALA . . . . . . . . . . . . . . . -60.05 -38.07 81.72 Favored 'General case' 0 N--CA 1.492 1.655 0 O-C-N 121.614 -0.679 . . . . 0.0 109.183 -179.601 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 97.0 mt-10 -67.8 -38.51 83.42 Favored 'General case' 0 N--CA 1.491 1.617 0 O-C-N 121.638 -0.664 . . . . 0.0 109.308 179.786 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 8.3 m-85 -60.97 -45.5 94.5 Favored 'General case' 0 N--CA 1.493 1.676 0 N-CA-C 108.808 -0.812 . . . . 0.0 108.808 179.889 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 52' ' ' ILE . . . . . . . . . . . . . 92.0 mt -65.11 -44.63 95.55 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.557 0 N-CA-C 109.596 -0.52 . . . . 0.0 109.596 -179.828 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 66.9 m -62.9 -46.58 87.14 Favored 'General case' 0 N--CA 1.494 1.738 0 O-C-N 121.415 -0.803 . . . . 0.0 109.862 -179.459 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 54' ' ' LEU . . . . . . . . . . . . . 93.2 mt -65.94 -42.62 89.78 Favored 'General case' 0 N--CA 1.494 1.737 0 O-C-N 121.648 -0.657 . . . . 0.0 109.858 179.999 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -65.57 -38.82 90.64 Favored 'General case' 0 N--CA 1.491 1.589 0 O-C-N 121.81 -0.556 . . . . 0.0 110.015 -178.913 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 56' ' ' LYS . . . . . . . . . . . . . 66.1 tttm -64.82 -45.47 86.06 Favored 'General case' 0 N--CA 1.487 1.414 0 O-C-N 121.42 -0.8 . . . . 0.0 109.729 -179.426 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 29.0 mt-30 -66.38 -44.23 83.7 Favored 'General case' 0 N--CA 1.493 1.69 0 O-C-N 121.594 -0.692 . . . . 0.0 109.675 -179.606 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 58' ' ' VAL . . . . . . . . . . . . . 74.8 t -65.05 -44.65 95.79 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.536 0 N-CA-C 109.116 -0.698 . . . . 0.0 109.116 -179.637 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 59' ' ' TYR . . . . . . . . . . . . . 9.2 t80 -106.97 -143.5 0.38 Allowed 'General case' 0 N--CA 1.496 1.866 0 CA-C-O 121.498 0.666 . . . . 0.0 109.585 -179.676 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -164.79 125.01 1.96 Allowed 'General case' 0 N--CA 1.491 1.622 0 CA-C-O 121.851 0.834 . . . . 0.0 110.255 179.998 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 61' ' ' ASN . . . . . . . . . . . . . 30.8 t-20 57.92 36.24 26.06 Favored 'General case' 0 N--CA 1.493 1.682 0 CA-C-O 121.816 0.817 . . . . 0.0 109.127 179.738 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 62' ' ' VAL . . . . . . . . . . . . . 5.4 p -67.77 139.28 21.1 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.606 0 CA-C-O 121.776 0.798 . . . . 0.0 110.552 -179.653 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 49.9 tp10 -116.94 147.47 42.22 Favored 'General case' 0 N--CA 1.494 1.736 0 CA-C-O 121.65 0.738 . . . . 0.0 109.241 179.957 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 64' ' ' TYR . . . . . . . . . . . . . 48.3 p90 -149.39 166.18 29.83 Favored 'General case' 0 N--CA 1.49 1.556 0 CA-C-O 122.008 0.909 . . . . 0.0 110.798 -179.323 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 75.5 mm-40 -132.16 147.23 52.41 Favored 'General case' 0 N--CA 1.495 1.791 0 CA-C-O 121.496 0.665 . . . . 0.0 109.475 -179.711 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 66' ' ' VAL . . . . . . . . . . . . . 57.7 t -120.74 130.88 74.1 Favored 'Isoleucine or valine' 0 N--CA 1.5 2.058 0 CA-C-O 121.975 0.893 . . . . 0.0 109.968 -179.571 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -79.22 155.94 76.7 Favored Pre-proline 0 C--N 1.306 -1.299 0 N-CA-C 109.348 -0.612 . . . . 0.0 109.348 -179.484 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 68' ' ' PRO . . . . . . . . . . . . . 89.2 Cg_exo -45.71 127.94 10.39 Favored 'Trans proline' 0 N--CA 1.492 1.409 0 C-N-CA 122.612 2.208 . . . . 0.0 113.075 179.765 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 69' ' ' VAL . . . . . . . . . . . . . 47.9 t -130.89 132.46 63.88 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.898 0 CA-C-O 121.822 0.82 . . . . 0.0 110.057 179.807 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -73.29 151.96 41.14 Favored 'General case' 0 N--CA 1.49 1.527 0 CA-C-O 121.749 0.785 . . . . 0.0 110.146 179.328 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 71' ' ' ASP . . . . . 0.526 ' OD1' ' N ' ' A' ' 72' ' ' ASN . 41.5 p-10 -63.73 -35.11 79.5 Favored 'General case' 0 N--CA 1.489 1.505 0 O-C-N 121.769 -0.582 . . . . 0.0 109.607 -179.825 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 72' ' ' ASN . . . . . 0.526 ' N ' ' OD1' ' A' ' 71' ' ' ASP . 99.2 m-20 -95.59 15.3 20.23 Favored 'General case' 0 N--CA 1.494 1.742 0 N-CA-C 108.972 -0.751 . . . . 0.0 108.972 -179.556 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -61.09 146.93 45.6 Favored 'General case' 0 N--CA 1.498 1.954 0 CA-C-O 121.774 0.797 . . . . 0.0 110.704 -179.645 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 74' ' ' THR . . . . . . . . . . . . . 50.6 p -98.63 -1.68 40.28 Favored 'General case' 0 N--CA 1.498 1.943 0 O-C-N 121.751 -0.593 . . . . 0.0 109.467 -179.758 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 2.9 pp20? -156.13 160.1 39.61 Favored 'General case' 0 N--CA 1.495 1.78 0 O-C-N 121.243 -0.911 . . . . 0.0 110.395 179.695 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 5.4 tt -128.06 135.27 49.61 Favored 'General case' 0 N--CA 1.493 1.707 0 CA-C-O 121.565 0.697 . . . . 0.0 109.876 -179.869 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 77' ' ' HIS . . . . . . . . . . . . . 82.2 t60 -117.22 124.3 48.74 Favored 'General case' 0 N--CA 1.497 1.909 0 CA-C-O 122.143 0.973 . . . . 0.0 109.937 -179.883 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -152.62 159.65 43.22 Favored 'General case' 0 N--CA 1.49 1.565 0 CA-C-O 121.506 0.67 . . . . 0.0 109.591 179.708 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 96.5 mtt-85 -127.07 149.82 49.75 Favored 'General case' 0 N--CA 1.497 1.917 0 CA-C-O 121.553 0.692 . . . . 0.0 109.841 -179.528 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 80' ' ' PHE . . . . . . . . . . . . . 35.8 m-85 -122.9 149.68 43.91 Favored 'General case' 0 N--CA 1.497 1.902 0 CA-C-O 121.736 0.779 . . . . 0.0 109.62 -179.653 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 49.7 mtmt -108.56 115.12 29.51 Favored 'General case' 0 N--CA 1.494 1.749 0 CA-C-O 121.62 0.724 . . . . 0.0 109.437 -179.505 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 82' ' ' PHE . . . . . 0.681 ' C ' ' H ' ' A' ' 84' ' ' VAL . 53.6 m-85 -110.56 -0.7 17.21 Favored 'General case' 0 N--CA 1.497 1.889 0 N-CA-C 108.567 -0.901 . . . . 0.0 108.567 179.643 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 41.7 mm-40 63.62 -20.99 0.06 Allowed 'General case' 0 N--CA 1.492 1.657 0 N-CA-C 109.277 -0.638 . . . . 0.0 109.277 179.936 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 84' ' ' VAL . . . . . 0.681 ' H ' ' C ' ' A' ' 82' ' ' PHE . 3.3 m -133.83 133.58 56.49 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.519 0 CA-C-O 121.822 0.82 . . . . 0.0 109.674 -179.621 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 85' ' ' SER . . . . . 0.52 ' O ' ' N ' ' A' ' 88' ' ' LYS . 14.2 t -64.97 -41.0 95.82 Favored 'General case' 0 C--N 1.3 -1.581 0 CA-C-O 121.214 0.531 . . . . 0.0 110.156 179.919 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 86' ' ' ALA . . . . . 0.423 ' C ' ' O ' ' A' ' 85' ' ' SER . . . -41.15 -38.13 1.02 Allowed 'General case' 0 N--CA 1.496 1.854 0 O-C-N 121.514 -0.742 . . . . 0.0 110.121 -178.802 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -69.95 -32.88 71.36 Favored 'General case' 0 N--CA 1.489 1.5 0 O-C-N 121.481 -0.762 . . . . 0.0 109.517 -179.886 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 88' ' ' LYS . . . . . 0.52 ' N ' ' O ' ' A' ' 85' ' ' SER . 64.3 tttm -61.67 -47.19 86.49 Favored 'General case' 0 C--N 1.3 -1.569 0 O-C-N 121.845 -0.534 . . . . 0.0 109.88 -178.937 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 96.0 mt -64.76 -47.92 76.4 Favored 'General case' 0 N--CA 1.493 1.703 0 O-C-N 121.67 -0.644 . . . . 0.0 110.464 -178.94 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 90' ' ' ILE . . . . . . . . . . . . . 96.3 mt -69.6 -43.97 79.95 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.647 0 O-C-N 121.637 -0.665 . . . . 0.0 109.64 -179.887 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 91' ' ' PHE . . . . . . . . . . . . . 82.6 t80 -62.26 -44.74 95.85 Favored 'General case' 0 N--CA 1.493 1.717 0 O-C-N 121.59 -0.694 . . . . 0.0 109.354 -179.979 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 92' ' ' GLU . . . . . . . . . . . . . 81.4 tt0 -63.55 -43.12 97.99 Favored 'General case' 0 N--CA 1.489 1.507 0 N-CA-C 109.309 -0.626 . . . . 0.0 109.309 -179.576 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 93' ' ' LEU . . . . . . . . . . . . . 2.8 tt -63.26 -47.26 83.14 Favored 'General case' 0 N--CA 1.489 1.498 0 CA-C-O 121.667 0.746 . . . . 0.0 109.624 -179.119 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 94' ' ' LYS . . . . . . . . . . . . . 55.2 mtpt -63.9 -44.97 91.4 Favored 'General case' 0 N--CA 1.49 1.559 0 O-C-N 121.492 -0.755 . . . . 0.0 109.792 -179.177 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 14.4 p -66.48 -39.86 89.0 Favored 'General case' 0 N--CA 1.492 1.625 0 O-C-N 121.794 -0.566 . . . . 0.0 110.037 -179.539 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 96' ' ' ARG . . . . . . . . . . . . . 16.1 tpt85 -70.77 -17.99 62.77 Favored 'General case' 0 C--N 1.3 -1.555 0 O-C-N 121.562 -0.711 . . . . 0.0 109.788 -179.484 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 97' ' ' ALA . . . . . . . . . . . . . . . -78.87 -43.69 24.46 Favored 'General case' 0 N--CA 1.491 1.604 0 O-C-N 121.624 -0.673 . . . . 0.0 109.761 -179.25 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 98' ' ' LEU . . . . . . . . . . . . . 2.2 pp -88.81 -18.29 28.0 Favored 'General case' 0 N--CA 1.493 1.689 0 N-CA-C 109.201 -0.666 . . . . 0.0 109.201 -179.302 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 99' ' ' ALA . . . . . . . . . . . . . . . -84.19 -40.66 17.87 Favored 'General case' 0 N--CA 1.492 1.675 0 O-C-N 121.623 -0.673 . . . . 0.0 109.441 -179.062 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 100' ' ' ARG . . . . . . . . . . . . . 9.5 ptm180 -64.34 -31.92 73.31 Favored 'General case' 0 N--CA 1.492 1.647 0 N-CA-C 108.953 -0.758 . . . . 0.0 108.953 -179.9 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 101' ' ' LEU . . . . . . . . . . . . . 96.9 mt -71.73 145.98 48.44 Favored 'General case' 0 N--CA 1.492 1.663 0 CA-C-O 121.651 0.738 . . . . 0.0 110.139 -179.556 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 102' ' ' GLU . . . . . 0.497 ' O ' ' N ' ' A' ' 104' ' ' HIS . 83.4 tt0 -159.45 116.21 2.62 Favored 'General case' 0 N--CA 1.492 1.666 0 CA-C-O 121.753 0.787 . . . . 0.0 109.672 179.809 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 103' ' ' HIS . . . . . . . . . . . . . 92.6 m-70 41.42 -92.59 0.01 OUTLIER 'General case' 0 N--CA 1.494 1.73 0 CA-C-O 121.458 0.647 . . . . 0.0 110.166 179.964 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 104' ' ' HIS . . . . . 0.617 ' CG ' ' H ' ' A' ' 105' ' ' HIS . 0.3 OUTLIER 44.45 -114.69 0.4 Allowed 'General case' 0 N--CA 1.493 1.676 0 CA-C-O 121.262 0.553 . . . . 0.0 110.017 -179.866 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 105' ' ' HIS . . . . . 0.617 ' H ' ' CG ' ' A' ' 104' ' ' HIS . 60.2 t-80 53.72 -80.61 0.01 OUTLIER 'General case' 0 N--CA 1.489 1.521 0 CA-C-O 121.364 0.602 . . . . 0.0 109.985 -179.69 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 106' ' ' HIS . . . . . 0.567 ' N ' ' O ' ' A' ' 104' ' ' HIS . 94.9 m-70 56.42 90.1 0.04 OUTLIER 'General case' 0 C--N 1.302 -1.496 0 CA-C-O 121.721 0.772 . . . . 0.0 109.97 -179.786 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 107' ' ' HIS . . . . . 0.402 ' O ' ' O ' ' A' ' 106' ' ' HIS . 98.7 m-70 46.28 -175.72 0.01 OUTLIER 'General case' 0 N--CA 1.492 1.672 0 CA-C-O 121.766 0.793 . . . . 0.0 110.888 179.608 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 108' ' ' HIS . . . . . . . . . . . . . 41.2 p-80 . . . . . 0 N--CA 1.488 1.437 0 CA-C-O 117.909 -1.044 . . . . 0.0 109.396 -179.732 . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 97.4 mmm . . . . . 0 N--CA 1.49 1.54 0 CA-C-O 121.359 0.599 . . . . 0.0 109.97 . . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 51.0 m -61.9 -36.54 81.61 Favored 'General case' 0 N--CA 1.494 1.73 0 CA-C-O 121.232 0.539 . . . . 0.0 109.741 -179.579 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 3' ' ' ASN . . . . . . . . . . . . . 9.4 m120 -62.42 -39.56 93.68 Favored 'General case' 0 N--CA 1.494 1.729 0 N-CA-C 109.105 -0.702 . . . . 0.0 109.105 -179.638 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 77.9 mt-30 57.88 24.28 10.72 Favored 'General case' 0 N--CA 1.493 1.689 0 N-CA-C 109.122 -0.696 . . . . 0.0 109.122 -179.847 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -56.22 98.83 0.03 OUTLIER 'General case' 0 N--CA 1.491 1.582 0 CA-C-O 121.958 0.885 . . . . 0.0 109.626 -179.673 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 1.7 p -83.6 -70.06 0.59 Allowed 'General case' 0 N--CA 1.49 1.554 0 N-CA-C 109.367 -0.605 . . . . 0.0 109.367 179.964 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 7' ' ' VAL . . . . . . . . . . . . . 88.8 t -105.87 -45.25 8.34 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.84 0 O-C-N 121.729 -0.607 . . . . 0.0 109.504 -179.33 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 44.5 tp10 51.44 93.3 0.02 OUTLIER 'General case' 0 N--CA 1.496 1.84 0 CA-C-O 121.609 0.719 . . . . 0.0 109.613 -179.843 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 52.5 t30 -87.72 111.78 21.69 Favored 'General case' 0 N--CA 1.494 1.752 0 CA-C-O 121.692 0.758 . . . . 0.0 110.137 -179.713 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 96.8 mt-10 -64.43 148.89 49.54 Favored 'General case' 0 N--CA 1.493 1.701 0 CA-C-O 121.756 0.789 . . . . 0.0 110.198 -179.737 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 58.0 t -104.78 127.51 59.19 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.859 0 CA-C-O 121.809 0.814 . . . . 0.0 109.759 -179.31 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 10.7 t -89.69 122.41 32.78 Favored 'General case' 0 N--CA 1.493 1.711 0 CA-C-O 121.665 0.745 . . . . 0.0 110.212 -179.626 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 13' ' ' GLU . . . . . 0.543 ' O ' ' N ' ' A' ' 15' ' ' CYS . 79.8 mm-40 -92.93 -10.17 37.45 Favored 'General case' 0 N--CA 1.493 1.692 0 N-CA-C 108.748 -0.834 . . . . 0.0 108.748 179.228 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . 45.48 13.84 0.01 OUTLIER 'General case' 0 N--CA 1.496 1.858 0 CA-C-O 121.327 0.584 . . . . 0.0 109.848 179.974 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 15' ' ' CYS . . . . . 0.543 ' N ' ' O ' ' A' ' 13' ' ' GLU . 5.4 t -71.83 -31.37 66.47 Favored 'General case' 0 N--CA 1.49 1.558 0 O-C-N 121.822 -0.549 . . . . 0.0 109.524 179.903 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . -81.38 -4.21 90.48 Favored Glycine 0 N--CA 1.492 2.432 0 N-CA-C 109.313 -1.515 . . . . 0.0 109.313 -179.37 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 74.1 m -81.16 57.93 3.34 Favored 'General case' 0 N--CA 1.492 1.66 0 O-C-N 121.707 -0.879 . . . . 0.0 109.497 -179.678 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -170.75 100.46 0.23 Allowed 'General case' 0 N--CA 1.489 1.496 0 CA-C-O 121.764 0.792 . . . . 0.0 109.793 179.24 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 71.0 -175.33 38.89 Favored Glycine 0 N--CA 1.493 2.461 0 N-CA-C 111.05 -0.82 . . . . 0.0 111.05 178.938 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 97.9 mt-10 -70.28 131.18 43.78 Favored 'General case' 0 N--CA 1.491 1.604 0 CA-C-O 121.8 0.809 . . . . 0.0 109.878 -179.754 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 21' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -92.15 133.95 31.93 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.715 0 CA-C-O 121.822 0.82 . . . . 0.0 110.273 -179.333 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 80.7 20.44 65.94 Favored Glycine 0 N--CA 1.493 2.454 0 N-CA-C 109.318 -1.513 . . . . 0.0 109.318 179.434 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 23' ' ' PHE . . . . . . . . . . . . . 89.5 t80 -96.11 -10.77 27.49 Favored 'General case' 0 N--CA 1.494 1.763 0 O-C-N 121.683 -0.892 . . . . 0.0 109.541 -179.584 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 16.9 tt -82.99 -16.62 11.35 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.788 0 O-C-N 121.473 -0.767 . . . . 0.0 109.436 179.822 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 25' ' ' ILE . . . . . . . . . . . . . 96.6 mt -64.54 -42.94 96.62 Favored 'Isoleucine or valine' 0 N--CA 1.499 2.004 0 O-C-N 121.419 -0.801 . . . . 0.0 109.229 179.922 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 84.2 mtp180 56.09 174.48 0.03 OUTLIER 'General case' 0 N--CA 1.494 1.744 0 CA-C-O 121.716 0.77 . . . . 0.0 111.059 -179.95 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 82.8 tt0 -69.28 84.04 0.37 Allowed 'General case' 0 N--CA 1.494 1.77 0 CA-C-O 121.71 0.767 . . . . 0.0 110.204 -179.066 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . -84.71 173.58 49.36 Favored Glycine 0 N--CA 1.492 2.372 0 N-CA-C 110.147 -1.181 . . . . 0.0 110.147 179.73 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 99.2 m-20 -69.23 -26.64 64.9 Favored 'General case' 0 N--CA 1.491 1.616 0 O-C-N 121.904 -0.763 . . . . 0.0 109.434 179.975 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 38.3 p30 -97.96 23.91 7.55 Favored 'General case' 0 N--CA 1.495 1.78 0 N-CA-C 108.822 -0.807 . . . . 0.0 108.822 -179.888 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 53.3 t -115.99 133.59 61.97 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.9 0 CA-C-O 121.795 0.807 . . . . 0.0 109.41 179.934 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -97.98 154.18 17.86 Favored 'General case' 0 N--CA 1.494 1.744 0 CA-C-O 121.871 0.843 . . . . 0.0 110.135 -179.47 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 33' ' ' GLU . . . . . 0.508 ' OE2' ' NE2' ' A' ' 77' ' ' HIS . 49.7 tp10 -101.58 124.21 46.87 Favored 'General case' 0 N--CA 1.492 1.645 0 CA-C-O 121.515 0.674 . . . . 0.0 109.528 -179.667 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 34' ' ' VAL . . . . . . . . . . . . . 55.7 t -124.24 131.99 72.02 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.791 0 CA-C-O 121.889 0.852 . . . . 0.0 109.689 179.774 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 38.1 t -136.11 138.78 42.41 Favored 'General case' 0 N--CA 1.492 1.637 0 CA-C-O 121.545 0.688 . . . . 0.0 109.35 179.498 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 47.2 tp -126.89 139.33 53.16 Favored 'General case' 0 N--CA 1.493 1.719 0 CA-C-O 121.795 0.807 . . . . 0.0 110.076 -179.664 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 37' ' ' PHE . . . . . . . . . . . . . 96.9 m-85 -112.36 144.77 41.23 Favored 'General case' 0 N--CA 1.496 1.828 0 CA-C-O 121.797 0.808 . . . . 0.0 109.694 179.917 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . -171.0 176.35 44.41 Favored Glycine 0 N--CA 1.489 2.226 0 N-CA-C 110.23 -1.148 . . . . 0.0 110.23 -179.909 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 1.7 m -83.55 -71.59 0.5 Allowed 'General case' 0 N--CA 1.489 1.482 0 O-C-N 121.854 -0.792 . . . . 0.0 109.751 -179.758 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 40' ' ' ASP . . . . . . . . . . . . . 37.0 t70 -98.78 159.06 15.22 Favored 'General case' 0 N--CA 1.498 1.96 0 CA-C-O 121.952 0.882 . . . . 0.0 110.65 -179.223 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 41' ' ' LYS . . . . . 0.43 ' O ' ' OE1' ' A' ' 45' ' ' GLU . 64.5 tttm -62.79 -42.26 99.63 Favored 'General case' 0 N--CA 1.491 1.587 0 CA-C-N 116.091 -0.504 . . . . 0.0 110.213 -179.971 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -49.88 -43.08 49.15 Favored 'General case' 0 N--CA 1.493 1.71 0 O-C-N 121.591 -0.693 . . . . 0.0 109.747 -178.828 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 43' ' ' HIS . . . . . . . . . . . . . 79.7 m-70 -67.47 -42.42 83.04 Favored 'General case' 0 N--CA 1.49 1.527 0 O-C-N 121.701 -0.624 . . . . 0.0 109.506 -179.933 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 81.8 mt -64.27 -44.0 93.07 Favored 'General case' 0 N--CA 1.494 1.737 0 O-C-N 121.742 -0.599 . . . . 0.0 109.792 -179.633 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 45' ' ' GLU . . . . . 0.503 ' OE1' ' N ' ' A' ' 45' ' ' GLU . 2.7 mp0 -66.7 -40.51 88.51 Favored 'General case' 0 N--CA 1.488 1.474 0 O-C-N 121.69 -0.631 . . . . 0.0 109.352 -179.799 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . -60.72 -44.73 97.59 Favored Glycine 0 N--CA 1.492 2.397 0 N-CA-C 109.699 -1.36 . . . . 0.0 109.699 -179.189 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 54.9 mtpt -71.16 -25.6 62.62 Favored 'General case' 0 N--CA 1.49 1.532 0 O-C-N 121.781 -0.835 . . . . 0.0 109.102 179.843 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -61.52 -44.86 96.29 Favored 'General case' 0 C--N 1.303 -1.434 0 O-C-N 121.572 -0.705 . . . . 0.0 109.353 -179.102 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 49' ' ' ALA . . . . . . . . . . . . . . . -53.83 -35.85 61.9 Favored 'General case' 0 N--CA 1.493 1.721 0 O-C-N 121.442 -0.786 . . . . 0.0 109.488 -179.328 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 72.9 mm-40 -69.16 -37.28 78.13 Favored 'General case' 0 N--CA 1.491 1.597 0 N-CA-C 109.258 -0.645 . . . . 0.0 109.258 -179.983 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 4.4 m-85 -63.46 -39.37 94.28 Favored 'General case' 0 N--CA 1.496 1.859 0 O-C-N 121.669 -0.644 . . . . 0.0 109.496 -179.458 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 52' ' ' ILE . . . . . . . . . . . . . 31.9 mm -64.07 -44.28 97.68 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.611 0 O-C-N 121.634 -0.666 . . . . 0.0 109.626 -179.424 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 66.9 m -60.55 -41.62 94.91 Favored 'General case' 0 N--CA 1.493 1.7 0 O-C-N 121.815 -0.553 . . . . 0.0 109.574 -179.696 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 54' ' ' LEU . . . . . . . . . . . . . 95.4 mt -64.04 -40.49 96.42 Favored 'General case' 0 N--CA 1.492 1.634 0 O-C-N 121.658 -0.651 . . . . 0.0 109.315 -179.926 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -57.92 -46.47 84.95 Favored 'General case' 0 N--CA 1.491 1.619 0 CA-C-O 121.148 0.499 . . . . 0.0 110.147 -178.984 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 56' ' ' LYS . . . . . . . . . . . . . 62.7 mttp -64.59 -41.53 96.18 Favored 'General case' 0 N--CA 1.491 1.584 0 O-C-N 121.631 -0.668 . . . . 0.0 109.955 -179.742 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 88.2 mt-30 -64.66 -43.65 92.93 Favored 'General case' 0 N--CA 1.491 1.598 0 O-C-N 121.499 -0.751 . . . . 0.0 109.287 -179.726 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 58' ' ' VAL . . . . . . . . . . . . . 77.9 t -65.92 -44.54 92.47 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.619 0 O-C-N 121.742 -0.599 . . . . 0.0 109.419 -179.881 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 59' ' ' TYR . . . . . 0.404 ' O ' ' O ' ' A' ' 60' ' ' ALA . 75.8 t80 -137.47 151.56 48.6 Favored 'General case' 0 N--CA 1.496 1.861 0 CA-C-O 121.913 0.863 . . . . 0.0 110.318 -179.521 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 60' ' ' ALA . . . . . 0.538 ' O ' ' N ' ' A' ' 62' ' ' VAL . . . -59.85 -143.3 0.0 OUTLIER 'General case' 0 N--CA 1.491 1.587 0 CA-C-O 121.449 0.642 . . . . 0.0 110.693 -179.298 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 61' ' ' ASN . . . . . . . . . . . . . 99.3 m-20 -43.67 91.6 0.0 OUTLIER 'General case' 0 N--CA 1.495 1.802 0 CA-C-O 121.85 0.834 . . . . 0.0 109.879 -178.836 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 62' ' ' VAL . . . . . 0.538 ' N ' ' O ' ' A' ' 60' ' ' ALA . 13.2 p -99.42 132.58 44.58 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.503 0 CA-C-O 121.897 0.856 . . . . 0.0 110.279 -179.438 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 63' ' ' GLU . . . . . 0.533 ' OE1' ' N ' ' A' ' 63' ' ' GLU . 57.1 mp0 -105.42 136.51 44.84 Favored 'General case' 0 N--CA 1.492 1.637 0 CA-C-O 121.726 0.774 . . . . 0.0 109.44 -179.764 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 64' ' ' TYR . . . . . . . . . . . . . 53.5 p90 -149.6 161.84 41.38 Favored 'General case' 0 N--CA 1.491 1.584 0 CA-C-O 121.778 0.799 . . . . 0.0 110.246 -179.516 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 48.7 tp10 -143.39 144.76 32.18 Favored 'General case' 0 N--CA 1.493 1.703 0 CA-C-O 121.736 0.779 . . . . 0.0 109.266 179.412 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 66' ' ' VAL . . . . . . . . . . . . . 14.7 p -121.27 129.95 75.13 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.713 0 CA-C-O 121.866 0.841 . . . . 0.0 109.893 -179.852 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -77.76 159.85 75.63 Favored Pre-proline 0 N--CA 1.49 1.55 0 N-CA-C 109.398 -0.593 . . . . 0.0 109.398 -179.699 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 68' ' ' PRO . . . . . . . . . . . . . 17.9 Cg_endo -59.58 140.28 93.07 Favored 'Trans proline' 0 C--N 1.309 -1.545 0 C-N-CA 122.579 2.186 . . . . 0.0 112.57 179.41 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 69' ' ' VAL . . . . . . . . . . . . . 49.6 t -133.8 136.21 54.3 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.787 0 CA-C-O 121.835 0.826 . . . . 0.0 110.074 -179.723 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -76.69 165.52 24.63 Favored 'General case' 0 N--CA 1.492 1.654 0 CA-C-O 121.875 0.845 . . . . 0.0 110.504 -179.953 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 62.0 t0 -63.14 -44.45 95.51 Favored 'General case' 0 N--CA 1.489 1.487 0 CA-C-O 121.224 0.535 . . . . 0.0 109.926 -179.614 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 72' ' ' ASN . . . . . . . . . . . . . 98.5 m-20 -99.75 24.91 7.75 Favored 'General case' 0 N--CA 1.494 1.768 0 N-CA-C 109.347 -0.612 . . . . 0.0 109.347 -179.146 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 73' ' ' ALA . . . . . 0.589 ' C ' ' H ' ' A' ' 75' ' ' GLU . . . -64.47 -26.11 68.3 Favored 'General case' 0 N--CA 1.492 1.666 0 O-C-N 121.607 -0.683 . . . . 0.0 109.228 179.825 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 74' ' ' THR . . . . . 0.48 ' OG1' ' O ' ' A' ' 73' ' ' ALA . 63.0 p 53.35 4.04 0.04 OUTLIER 'General case' 0 N--CA 1.493 1.683 0 CA-C-O 121.256 0.55 . . . . 0.0 109.625 -179.347 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 75' ' ' GLU . . . . . 0.589 ' H ' ' C ' ' A' ' 73' ' ' ALA . 96.5 mt-10 -144.69 156.83 44.28 Favored 'General case' 0 N--CA 1.491 1.605 0 CA-C-O 121.975 0.893 . . . . 0.0 110.135 179.85 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 4.1 tt -141.24 141.09 34.03 Favored 'General case' 0 C--N 1.304 -1.405 0 CA-C-O 121.622 0.725 . . . . 0.0 109.857 -179.907 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 77' ' ' HIS . . . . . 0.508 ' NE2' ' OE2' ' A' ' 33' ' ' GLU . 63.1 t-80 -120.38 128.48 53.26 Favored 'General case' 0 N--CA 1.494 1.735 0 CA-C-O 121.928 0.87 . . . . 0.0 109.763 -179.978 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -150.16 155.21 39.37 Favored 'General case' 0 N--CA 1.49 1.536 0 CA-C-O 121.688 0.756 . . . . 0.0 109.696 179.937 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 33.2 ptt-85 -135.03 153.16 52.16 Favored 'General case' 0 N--CA 1.495 1.778 0 CA-C-O 121.814 0.816 . . . . 0.0 109.845 -179.778 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 80' ' ' PHE . . . . . . . . . . . . . 45.5 m-85 -133.16 153.38 51.58 Favored 'General case' 0 N--CA 1.495 1.821 0 CA-C-O 121.694 0.759 . . . . 0.0 110.175 -179.265 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 64.2 tttm -107.4 125.66 51.5 Favored 'General case' 0 N--CA 1.496 1.841 0 CA-C-O 121.595 0.712 . . . . 0.0 109.366 179.968 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 82' ' ' PHE . . . . . . . . . . . . . 63.1 m-85 -123.21 146.51 47.76 Favored 'General case' 0 N--CA 1.495 1.821 0 CA-C-O 121.615 0.721 . . . . 0.0 109.936 -179.896 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 81.3 tt0 -69.04 -37.88 78.83 Favored 'General case' 0 N--CA 1.491 1.595 0 N-CA-C 109.222 -0.658 . . . . 0.0 109.222 -179.579 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 84' ' ' VAL . . . . . . . . . . . . . 35.1 m -135.79 159.11 39.72 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.926 0 CA-C-O 121.889 0.852 . . . . 0.0 109.984 -179.933 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 85' ' ' SER . . . . . 0.481 ' O ' ' N ' ' A' ' 88' ' ' LYS . 11.2 t -63.62 -42.61 98.19 Favored 'General case' 0 N--CA 1.49 1.563 0 CA-C-O 121.193 0.521 . . . . 0.0 110.08 -179.775 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 86' ' ' ALA . . . . . . . . . . . . . . . -41.23 -40.95 1.73 Allowed 'General case' 0 N--CA 1.494 1.752 0 CA-C-O 121.278 0.561 . . . . 0.0 110.07 -178.976 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 96.6 mt-10 -67.52 -33.17 74.53 Favored 'General case' 0 N--CA 1.491 1.577 0 O-C-N 121.677 -0.64 . . . . 0.0 109.64 -179.829 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 88' ' ' LYS . . . . . 0.481 ' N ' ' O ' ' A' ' 85' ' ' SER . 64.4 tttm -62.37 -45.61 92.38 Favored 'General case' 0 N--CA 1.493 1.677 0 O-C-N 121.645 -0.659 . . . . 0.0 109.673 -179.627 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 89' ' ' LEU . . . . . 0.489 ' CD2' ' N ' ' A' ' 89' ' ' LEU . 3.8 mm? -64.3 -42.05 96.56 Favored 'General case' 0 N--CA 1.492 1.633 0 O-C-N 121.519 -0.738 . . . . 0.0 109.796 -179.447 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 90' ' ' ILE . . . . . . . . . . . . . 95.3 mt -65.99 -44.23 92.36 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.669 0 CA-C-O 121.325 0.583 . . . . 0.0 109.934 -179.398 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 91' ' ' PHE . . . . . . . . . . . . . 71.3 t80 -61.97 -45.58 93.01 Favored 'General case' 0 N--CA 1.493 1.707 0 O-C-N 121.689 -0.632 . . . . 0.0 109.993 -179.18 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 92' ' ' GLU . . . . . 0.555 ' N ' ' OE1' ' A' ' 92' ' ' GLU . 1.9 mp0 -64.8 -37.98 89.44 Favored 'General case' 0 N--CA 1.491 1.592 0 O-C-N 121.555 -0.716 . . . . 0.0 110.175 -178.976 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 93' ' ' LEU . . . . . . . . . . . . . 5.1 tt -62.11 -45.17 94.66 Favored 'General case' 0 C--N 1.299 -1.599 0 O-C-N 121.472 -0.767 . . . . 0.0 109.958 -178.845 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 94' ' ' LYS . . . . . . . . . . . . . 98.8 mttt -66.14 -43.13 87.95 Favored 'General case' 0 N--CA 1.493 1.694 0 O-C-N 121.826 -0.546 . . . . 0.0 110.045 -179.508 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 21.2 p -67.94 -38.08 82.41 Favored 'General case' 0 N--CA 1.493 1.708 0 O-C-N 121.557 -0.714 . . . . 0.0 109.629 -179.217 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 96' ' ' ARG . . . . . . . . . . . . . 73.6 mmt-85 -64.47 -40.86 96.49 Favored 'General case' 0 C--N 1.301 -1.502 0 O-C-N 121.592 -0.692 . . . . 0.0 109.639 -179.891 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 97' ' ' ALA . . . . . . . . . . . . . . . -63.47 -47.88 80.0 Favored 'General case' 0 C--N 1.302 -1.472 0 N-CA-C 108.994 -0.743 . . . . 0.0 108.994 -179.93 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 98' ' ' LEU . . . . . . . . . . . . . 88.8 mt -65.25 -42.08 93.67 Favored 'General case' 0 N--CA 1.488 1.466 0 N-CA-C 108.852 -0.796 . . . . 0.0 108.852 179.889 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 99' ' ' ALA . . . . . . . . . . . . . . . -65.01 -38.28 90.4 Favored 'General case' 0 N--CA 1.489 1.475 0 N-CA-C 109.515 -0.55 . . . . 0.0 109.515 -179.7 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 100' ' ' ARG . . . . . 0.435 ' O ' ' O ' ' A' ' 101' ' ' LEU . 84.4 mmt-85 -87.9 -6.24 58.16 Favored 'General case' 0 N--CA 1.493 1.714 0 O-C-N 121.499 -0.751 . . . . 0.0 109.003 179.98 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 101' ' ' LEU . . . . . 0.435 ' O ' ' O ' ' A' ' 100' ' ' ARG . 75.9 mt 58.39 126.09 0.01 OUTLIER 'General case' 0 N--CA 1.491 1.612 0 CA-C-O 121.904 0.859 . . . . 0.0 110.545 179.581 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 102' ' ' GLU . . . . . . . . . . . . . 47.7 tp10 -66.27 135.65 54.74 Favored 'General case' 0 C--N 1.303 -1.436 0 CA-C-O 121.805 0.812 . . . . 0.0 109.902 -179.225 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 103' ' ' HIS . . . . . . . . . . . . . 60.0 t-80 -145.41 133.34 21.3 Favored 'General case' 0 N--CA 1.49 1.57 0 CA-C-O 121.711 0.767 . . . . 0.0 109.921 179.688 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 104' ' ' HIS . . . . . 0.514 ' N ' ' HD1' ' A' ' 104' ' ' HIS . 0.0 OUTLIER -173.4 81.96 0.04 OUTLIER 'General case' 0 N--CA 1.49 1.573 0 CA-C-O 121.488 0.661 . . . . 0.0 109.32 179.443 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 105' ' ' HIS . . . . . 0.402 ' C ' ' O ' ' A' ' 104' ' ' HIS . 98.7 m-70 37.82 90.27 0.01 OUTLIER 'General case' 0 N--CA 1.5 2.027 0 CA-C-O 121.763 0.792 . . . . 0.0 110.661 179.879 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 106' ' ' HIS . . . . . 0.486 ' CG ' ' N ' ' A' ' 107' ' ' HIS . 52.1 p-80 -64.71 -43.47 93.35 Favored 'General case' 0 C--N 1.305 -1.362 0 N-CA-C 109.087 -0.709 . . . . 0.0 109.087 179.856 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 107' ' ' HIS . . . . . 0.486 ' N ' ' CG ' ' A' ' 106' ' ' HIS . 36.5 t-80 -79.22 130.63 35.66 Favored 'General case' 0 N--CA 1.493 1.698 0 CA-C-O 121.939 0.876 . . . . 0.0 110.11 -179.536 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 108' ' ' HIS . . . . . . . . . . . . . 63.2 t-80 . . . . . 0 N--CA 1.489 1.488 0 CA-C-O 117.799 -1.096 . . . . 0.0 109.797 179.779 . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 97.5 mmm . . . . . 0 N--CA 1.489 1.497 0 CA-C-O 121.487 0.661 . . . . 0.0 109.862 . . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 25.5 p -155.24 161.95 41.03 Favored 'General case' 0 N--CA 1.495 1.776 0 CA-C-O 121.719 0.771 . . . . 0.0 110.11 179.933 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 3' ' ' ASN . . . . . . . . . . . . . 54.6 p30 -106.56 12.03 29.92 Favored 'General case' 0 N--CA 1.497 1.895 0 N-CA-C 109.065 -0.717 . . . . 0.0 109.065 -179.807 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 26.3 mt-30 -73.12 124.78 26.25 Favored 'General case' 0 N--CA 1.493 1.697 0 CA-C-O 121.658 0.742 . . . . 0.0 109.703 -179.69 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 57.5 p -90.69 134.01 34.72 Favored 'General case' 0 N--CA 1.494 1.729 0 CA-C-O 121.691 0.758 . . . . 0.0 109.925 -179.664 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 1.1 t -64.91 -40.4 95.01 Favored 'General case' 0 N--CA 1.489 1.503 0 CA-C-O 121.288 0.566 . . . . 0.0 109.677 -179.913 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 7' ' ' VAL . . . . . . . . . . . . . 4.4 m -86.67 131.72 34.08 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.605 0 CA-C-O 121.695 0.76 . . . . 0.0 110.09 -179.039 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 82.0 tt0 -161.36 -75.79 0.05 Allowed 'General case' 0 N--CA 1.489 1.478 0 N-CA-C 109.264 -0.643 . . . . 0.0 109.264 179.79 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 9' ' ' ASN . . . . . 0.587 ' ND2' ' SG ' ' A' ' 12' ' ' CYS . 13.9 t-20 58.45 37.32 25.7 Favored 'General case' 0 N--CA 1.492 1.634 0 CA-C-O 121.466 0.65 . . . . 0.0 109.377 -179.773 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 83.8 tt0 -102.17 -22.26 14.23 Favored 'General case' 0 N--CA 1.494 1.771 0 N-CA-C 109.17 -0.678 . . . . 0.0 109.17 179.922 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 33.1 m -89.78 -5.94 10.74 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.674 0 N-CA-C 108.934 -0.765 . . . . 0.0 108.934 -179.892 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 12' ' ' CYS . . . . . 0.587 ' SG ' ' ND2' ' A' ' 9' ' ' ASN . 16.2 p -83.91 134.28 34.68 Favored 'General case' 0 N--CA 1.492 1.633 0 CA-C-O 121.692 0.758 . . . . 0.0 110.126 179.753 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 16.2 pt-20 -159.1 -24.85 0.07 Allowed 'General case' 0 N--CA 1.49 1.547 0 N-CA-C 109.05 -0.722 . . . . 0.0 109.05 179.756 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -84.23 -7.46 59.34 Favored 'General case' 0 N--CA 1.493 1.691 0 N-CA-C 108.792 -0.818 . . . . 0.0 108.792 -179.812 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 61.3 m -125.88 107.52 10.57 Favored 'General case' 0 N--CA 1.499 1.995 0 CA-C-O 121.784 0.802 . . . . 0.0 109.749 179.82 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . -89.19 -83.6 1.3 Allowed Glycine 0 N--CA 1.491 2.355 0 N-CA-C 109.813 -1.315 . . . . 0.0 109.813 -179.992 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 1.2 t -66.2 -38.91 89.13 Favored 'General case' 0 N--CA 1.493 1.719 0 O-C-N 121.819 -0.812 . . . . 0.0 109.757 -179.464 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . 53.68 34.93 19.93 Favored 'General case' 0 N--CA 1.491 1.608 0 CA-C-O 121.414 0.626 . . . . 0.0 109.422 -179.672 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -81.19 -5.05 90.35 Favored Glycine 0 N--CA 1.491 2.326 0 N-CA-C 109.311 -1.516 . . . . 0.0 109.311 179.961 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 84.7 tt0 -73.34 125.36 27.65 Favored 'General case' 0 N--CA 1.494 1.739 0 O-C-N 121.727 -0.866 . . . . 0.0 109.838 -179.645 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 21' ' ' ILE . . . . . . . . . . . . . 38.9 mm -57.52 -81.02 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.49 1.542 0 N-CA-C 109.515 -0.55 . . . . 0.0 109.515 -179.774 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 41.63 86.4 0.01 OUTLIER Glycine 0 N--CA 1.497 2.711 0 N-CA-C 109.946 -1.262 . . . . 0.0 109.946 -179.843 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 23' ' ' PHE . . . . . . . . . . . . . 49.5 t80 -62.36 -47.51 83.89 Favored 'General case' 0 N--CA 1.489 1.492 0 O-C-N 121.849 -0.795 . . . . 0.0 109.999 -179.66 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 24' ' ' ILE . . . . . 0.435 ' O ' ' O ' ' A' ' 25' ' ' ILE . 10.3 tp -171.53 130.38 0.14 Allowed 'Isoleucine or valine' 0 N--CA 1.49 1.544 0 O-C-N 121.671 -0.643 . . . . 0.0 110.396 179.964 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 25' ' ' ILE . . . . . 0.435 ' O ' ' O ' ' A' ' 24' ' ' ILE . 96.5 mt 41.61 95.02 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.494 1.751 0 CA-C-O 121.519 0.676 . . . . 0.0 110.127 179.635 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 9.6 ptm180 -76.77 156.04 32.67 Favored 'General case' 0 N--CA 1.495 1.81 0 CA-C-O 121.782 0.801 . . . . 0.0 110.766 -179.289 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 27' ' ' GLU . . . . . 0.478 ' CD ' ' N ' ' A' ' 28' ' ' GLY . 15.6 tm-20 -48.64 147.02 2.74 Favored 'General case' 0 N--CA 1.492 1.64 0 CA-C-O 121.838 0.827 . . . . 0.0 110.819 -179.268 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 28' ' ' GLY . . . . . 0.478 ' N ' ' CD ' ' A' ' 27' ' ' GLU . . . 88.7 -153.3 23.83 Favored Glycine 0 N--CA 1.49 2.272 0 N-CA-C 110.344 -1.102 . . . . 0.0 110.344 179.404 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 96.9 m-20 58.15 34.25 23.97 Favored 'General case' 0 N--CA 1.492 1.63 0 CA-C-O 121.316 0.579 . . . . 0.0 109.86 -179.714 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 34.8 t0 62.9 59.37 1.38 Allowed 'General case' 0 N--CA 1.491 1.608 0 CA-C-O 121.505 0.669 . . . . 0.0 109.513 179.391 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 53.6 t -117.79 133.93 63.01 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.802 0 CA-C-O 121.854 0.835 . . . . 0.0 109.276 179.989 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 32' ' ' ALA . . . . . 0.62 ' CB ' ' HZ3' ' A' ' 88' ' ' LYS . . . -99.22 151.67 20.76 Favored 'General case' 0 N--CA 1.49 1.528 0 CA-C-O 121.698 0.761 . . . . 0.0 109.838 -179.637 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 33' ' ' GLU . . . . . 0.552 ' H ' ' HZ2' ' A' ' 88' ' ' LYS . 57.4 mp0 -110.17 120.04 41.2 Favored 'General case' 0 N--CA 1.492 1.675 0 CA-C-O 121.619 0.723 . . . . 0.0 109.442 -179.853 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 34' ' ' VAL . . . . . . . . . . . . . 55.0 t -125.42 133.8 68.37 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.73 0 CA-C-O 121.88 0.848 . . . . 0.0 109.605 179.996 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 15.6 m -153.87 138.94 17.33 Favored 'General case' 0 N--CA 1.49 1.532 0 CA-C-O 121.768 0.794 . . . . 0.0 109.425 179.412 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 8.2 mp -107.73 152.95 23.65 Favored 'General case' 0 N--CA 1.495 1.797 0 CA-C-O 121.823 0.821 . . . . 0.0 109.833 -179.628 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 37' ' ' PHE . . . . . . . . . . . . . 91.8 m-85 -127.67 149.14 50.34 Favored 'General case' 0 N--CA 1.491 1.58 0 CA-C-O 121.929 0.871 . . . . 0.0 109.962 -179.518 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 38' ' ' GLY . . . . . 0.426 ' O ' ' O ' ' A' ' 39' ' ' SER . . . 84.63 178.17 51.23 Favored Glycine 0 N--CA 1.487 2.084 0 N-CA-C 110.396 -1.082 . . . . 0.0 110.396 179.442 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 39' ' ' SER . . . . . 0.433 ' OG ' ' ND1' ' A' ' 43' ' ' HIS . 0.3 OUTLIER 55.66 159.78 0.01 OUTLIER 'General case' 0 N--CA 1.488 1.467 0 CA-C-O 121.659 0.743 . . . . 0.0 110.483 179.819 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 40' ' ' ASP . . . . . . . . . . . . . 54.9 p-10 -79.94 174.26 11.77 Favored 'General case' 0 N--CA 1.489 1.492 0 CA-C-O 121.906 0.86 . . . . 0.0 110.785 -179.11 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 41' ' ' LYS . . . . . 0.424 ' O ' ' OE1' ' A' ' 45' ' ' GLU . 21.1 tptm -59.48 -45.54 91.36 Favored 'General case' 0 C--N 1.306 -1.306 0 CA-C-N 116.022 -0.536 . . . . 0.0 110.105 -179.362 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -57.65 -47.32 82.6 Favored 'General case' 0 N--CA 1.492 1.645 0 O-C-N 121.735 -0.603 . . . . 0.0 109.886 -178.828 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 43' ' ' HIS . . . . . 0.433 ' ND1' ' OG ' ' A' ' 39' ' ' SER . 58.7 t-80 -68.33 -35.77 78.26 Favored 'General case' 0 N--CA 1.49 1.572 0 O-C-N 121.628 -0.67 . . . . 0.0 109.683 -179.736 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 13.9 mt -61.94 -42.53 99.21 Favored 'General case' 0 N--CA 1.492 1.67 0 O-C-N 121.625 -0.672 . . . . 0.0 109.386 -179.013 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 45' ' ' GLU . . . . . 0.512 ' OE1' ' N ' ' A' ' 45' ' ' GLU . 1.2 mp0 -63.32 -46.57 86.06 Favored 'General case' 0 N--CA 1.485 1.323 0 O-C-N 121.681 -0.637 . . . . 0.0 109.389 -179.587 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . -61.81 -44.22 98.17 Favored Glycine 0 N--CA 1.49 2.279 0 N-CA-C 109.044 -1.622 . . . . 0.0 109.044 -179.602 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 41.3 tptt -67.22 -35.41 79.54 Favored 'General case' 0 N--CA 1.485 1.315 0 O-C-N 121.834 -0.804 . . . . 0.0 109.039 179.887 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 27.1 tp -58.17 -29.99 66.05 Favored 'General case' 0 N--CA 1.492 1.638 0 N-CA-C 108.805 -0.813 . . . . 0.0 108.805 -179.394 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 49' ' ' ALA . . . . . . . . . . . . . . . -49.62 -27.93 5.18 Favored 'General case' 0 N--CA 1.492 1.651 0 CA-C-O 121.154 0.502 . . . . 0.0 109.988 -179.33 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 50' ' ' GLU . . . . . 0.507 ' CG ' ' N ' ' A' ' 51' ' ' TYR . 16.4 pt-20 -69.41 -42.36 75.15 Favored 'General case' 0 N--CA 1.489 1.514 0 CA-C-O 121.647 0.737 . . . . 0.0 109.281 -179.875 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 51' ' ' TYR . . . . . 0.507 ' N ' ' CG ' ' A' ' 50' ' ' GLU . 22.4 m-85 -60.91 -48.89 79.75 Favored 'General case' 0 N--CA 1.488 1.468 0 O-C-N 121.733 -0.605 . . . . 0.0 109.787 -178.638 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 52' ' ' ILE . . . . . . . . . . . . . 94.6 mt -66.5 -43.39 90.87 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.637 0 CA-C-O 121.201 0.525 . . . . 0.0 109.817 -179.479 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 68.3 m -59.78 -58.18 9.67 Favored 'General case' 0 N--CA 1.493 1.714 0 O-C-N 121.762 -0.587 . . . . 0.0 110.047 -178.567 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 54' ' ' LEU . . . . . 0.425 ' N ' ' CD2' ' A' ' 54' ' ' LEU . 4.1 mm? -64.03 -40.84 97.21 Favored 'General case' 0 C--N 1.301 -1.512 0 O-C-N 121.717 -0.614 . . . . 0.0 109.943 -179.724 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -60.05 -43.07 95.62 Favored 'General case' 0 N--CA 1.489 1.523 0 N-CA-C 109.508 -0.553 . . . . 0.0 109.508 -179.126 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 56' ' ' LYS . . . . . . . . . . . . . 65.8 tttm -65.36 -43.4 90.93 Favored 'General case' 0 C--N 1.307 -1.276 0 O-C-N 121.713 -0.617 . . . . 0.0 109.534 -179.981 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 87.7 mt-30 -65.21 -44.24 88.99 Favored 'General case' 0 N--CA 1.491 1.62 0 O-C-N 121.841 -0.537 . . . . 0.0 109.693 -179.393 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 58' ' ' VAL . . . . . . . . . . . . . 77.3 t -64.47 -44.8 97.0 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.536 0 N-CA-C 109.143 -0.688 . . . . 0.0 109.143 -179.667 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 59' ' ' TYR . . . . . 0.434 ' CE1' ' O ' ' A' ' 60' ' ' ALA . 54.5 t80 -130.58 120.25 23.74 Favored 'General case' 0 N--CA 1.495 1.806 0 CA-C-O 121.829 0.823 . . . . 0.0 109.727 -179.874 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 60' ' ' ALA . . . . . 0.434 ' O ' ' CE1' ' A' ' 59' ' ' TYR . . . -69.2 145.71 52.98 Favored 'General case' 0 N--CA 1.489 1.487 0 CA-C-O 121.623 0.725 . . . . 0.0 110.55 -179.771 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 61' ' ' ASN . . . . . . . . . . . . . 32.2 t-20 57.82 42.24 23.62 Favored 'General case' 0 N--CA 1.494 1.765 0 CA-C-O 121.325 0.583 . . . . 0.0 109.745 179.643 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 62' ' ' VAL . . . . . . . . . . . . . 12.6 p -68.87 137.85 23.52 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.628 0 CA-C-O 121.551 0.691 . . . . 0.0 110.179 179.959 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 63' ' ' GLU . . . . . 0.541 ' OE1' ' N ' ' A' ' 63' ' ' GLU . 57.1 mp0 -112.06 137.71 49.71 Favored 'General case' 0 N--CA 1.494 1.769 0 CA-C-O 121.81 0.814 . . . . 0.0 109.587 -179.752 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 64' ' ' TYR . . . . . . . . . . . . . 55.5 p90 -155.8 164.84 38.03 Favored 'General case' 0 N--CA 1.487 1.417 0 CA-C-O 121.931 0.872 . . . . 0.0 110.413 -179.693 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 83.0 tt0 -142.5 153.69 43.84 Favored 'General case' 0 N--CA 1.491 1.622 0 CA-C-O 121.56 0.695 . . . . 0.0 109.318 179.832 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 66' ' ' VAL . . . . . . . . . . . . . 2.9 p -123.53 132.32 71.58 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.794 0 CA-C-O 122.085 0.945 . . . . 0.0 109.887 -179.744 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -85.89 160.23 53.05 Favored Pre-proline 0 N--CA 1.491 1.585 0 N-CA-C 109.221 -0.659 . . . . 0.0 109.221 179.945 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 68' ' ' PRO . . . . . . . . . . . . . 28.4 Cg_endo -59.83 134.67 58.56 Favored 'Trans proline' 0 C--N 1.307 -1.631 0 C-N-CA 122.728 2.286 . . . . 0.0 112.593 179.666 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 69' ' ' VAL . . . . . . . . . . . . . 99.5 t -138.63 139.15 41.67 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.8 0 CA-C-O 121.766 0.793 . . . . 0.0 110.442 179.82 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -67.08 154.64 40.7 Favored 'General case' 0 N--CA 1.488 1.47 0 CA-C-O 121.794 0.807 . . . . 0.0 110.018 179.787 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 71' ' ' ASP . . . . . 0.545 ' OD1' ' N ' ' A' ' 72' ' ' ASN . 42.3 p-10 -63.92 -34.44 77.96 Favored 'General case' 0 C--N 1.302 -1.465 0 CA-C-O 121.424 0.631 . . . . 0.0 109.45 -179.597 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 72' ' ' ASN . . . . . 0.545 ' N ' ' OD1' ' A' ' 71' ' ' ASP . 8.1 m120 -104.28 28.32 6.97 Favored 'General case' 0 N--CA 1.494 1.773 0 N-CA-C 109.114 -0.699 . . . . 0.0 109.114 -179.474 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 73' ' ' ALA . . . . . 0.487 ' C ' ' H ' ' A' ' 75' ' ' GLU . . . -70.43 -11.54 60.99 Favored 'General case' 0 N--CA 1.493 1.695 0 N-CA-C 109.135 -0.691 . . . . 0.0 109.135 -179.88 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 74' ' ' THR . . . . . 0.453 ' OG1' ' O ' ' A' ' 73' ' ' ALA . 47.5 p 52.4 10.31 0.13 Allowed 'General case' 0 N--CA 1.493 1.697 0 CA-C-O 121.27 0.557 . . . . 0.0 109.513 179.854 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 75' ' ' GLU . . . . . 0.487 ' H ' ' C ' ' A' ' 73' ' ' ALA . 15.3 pt-20 -153.01 179.91 8.26 Favored 'General case' 0 N--CA 1.49 1.571 0 CA-C-O 121.806 0.812 . . . . 0.0 110.095 179.834 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 7.3 tp -146.06 133.48 20.75 Favored 'General case' 0 C--N 1.303 -1.422 0 CA-C-O 121.708 0.766 . . . . 0.0 109.988 179.878 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 77' ' ' HIS . . . . . . . . . . . . . 97.8 m-70 -116.53 118.32 32.32 Favored 'General case' 0 N--CA 1.493 1.717 0 CA-C-O 121.854 0.835 . . . . 0.0 109.438 179.533 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -151.25 161.53 42.54 Favored 'General case' 0 N--CA 1.49 1.547 0 CA-C-O 121.657 0.742 . . . . 0.0 109.871 -179.885 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 81.0 mtp85 -130.31 150.61 51.47 Favored 'General case' 0 N--CA 1.495 1.789 0 CA-C-O 121.695 0.759 . . . . 0.0 109.803 -179.631 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 80' ' ' PHE . . . . . . . . . . . . . 28.9 m-85 -126.17 150.77 48.07 Favored 'General case' 0 N--CA 1.496 1.847 0 CA-C-O 121.574 0.702 . . . . 0.0 109.852 -179.711 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 88.4 tttt -113.66 126.8 55.66 Favored 'General case' 0 N--CA 1.494 1.755 0 CA-C-O 121.738 0.78 . . . . 0.0 109.593 -179.835 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 82' ' ' PHE . . . . . 0.524 ' CG ' ' OE2' ' A' ' 87' ' ' GLU . 73.0 m-85 -125.41 148.77 48.67 Favored 'General case' 0 N--CA 1.495 1.813 0 CA-C-O 121.796 0.808 . . . . 0.0 109.996 179.907 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 45.6 tp10 -70.51 -33.75 71.54 Favored 'General case' 0 N--CA 1.488 1.462 0 N-CA-C 109.346 -0.613 . . . . 0.0 109.346 -179.586 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 84' ' ' VAL . . . . . . . . . . . . . 33.1 m -131.68 162.52 39.33 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.936 0 CA-C-O 121.965 0.888 . . . . 0.0 110.411 -179.12 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 69.3 m -88.25 -15.65 35.29 Favored 'General case' 0 N--CA 1.492 1.672 0 N-CA-C 109.578 -0.527 . . . . 0.0 109.578 -179.643 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 86' ' ' ALA . . . . . . . . . . . . . . . -60.11 -46.23 90.3 Favored 'General case' 0 N--CA 1.492 1.642 0 O-C-N 121.444 -0.785 . . . . 0.0 109.475 -179.234 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 87' ' ' GLU . . . . . 0.524 ' OE2' ' CG ' ' A' ' 82' ' ' PHE . 2.9 pp20? -67.33 -30.68 70.58 Favored 'General case' 0 N--CA 1.488 1.45 0 O-C-N 121.738 -0.601 . . . . 0.0 109.411 -179.715 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 88' ' ' LYS . . . . . 0.62 ' HZ3' ' CB ' ' A' ' 32' ' ' ALA . 56.8 tttp -62.79 -45.54 92.17 Favored 'General case' 0 N--CA 1.491 1.582 0 O-C-N 121.73 -0.606 . . . . 0.0 109.379 -179.58 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 96.0 mt -62.89 -50.46 70.79 Favored 'General case' 0 N--CA 1.492 1.641 0 O-C-N 121.852 -0.53 . . . . 0.0 110.025 -179.036 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 90' ' ' ILE . . . . . 0.416 HD12 HG23 ' A' ' 90' ' ' ILE . 93.5 mt -69.77 -43.79 79.63 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.591 0 O-C-N 121.731 -0.605 . . . . 0.0 110.013 -179.971 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 91' ' ' PHE . . . . . . . . . . . . . 74.6 t80 -62.6 -45.81 91.15 Favored 'General case' 0 N--CA 1.491 1.614 0 O-C-N 121.57 -0.707 . . . . 0.0 109.799 -179.052 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 92' ' ' GLU . . . . . 0.54 ' CG ' ' NH1' ' A' ' 96' ' ' ARG . 82.1 tt0 -66.12 -40.65 90.83 Favored 'General case' 0 N--CA 1.491 1.599 0 O-C-N 121.662 -0.649 . . . . 0.0 109.332 -179.64 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 93' ' ' LEU . . . . . . . . . . . . . 4.7 tp -65.45 -43.35 90.63 Favored 'General case' 0 N--CA 1.489 1.495 0 O-C-N 121.584 -0.697 . . . . 0.0 109.749 -179.868 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 94' ' ' LYS . . . . . . . . . . . . . 6.9 ttpm? -68.58 -36.61 78.98 Favored 'General case' 0 N--CA 1.491 1.62 0 CA-C-O 121.24 0.543 . . . . 0.0 110.099 -179.073 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 7.0 p -62.02 -50.5 71.8 Favored 'General case' 0 N--CA 1.491 1.606 0 O-C-N 121.64 -0.663 . . . . 0.0 109.824 -178.802 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 96' ' ' ARG . . . . . 0.54 ' NH1' ' CG ' ' A' ' 92' ' ' GLU . 72.5 mtt85 -64.62 -39.61 94.02 Favored 'General case' 0 N--CA 1.488 1.449 0 N-CA-C 108.864 -0.791 . . . . 0.0 108.864 179.39 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 97' ' ' ALA . . . . . . . . . . . . . . . -61.59 -39.35 90.87 Favored 'General case' 0 N--CA 1.488 1.444 0 N-CA-C 108.995 -0.743 . . . . 0.0 108.995 179.995 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 98' ' ' LEU . . . . . . . . . . . . . 3.6 tt -63.66 -44.07 94.86 Favored 'General case' 0 N--CA 1.488 1.442 0 N-CA-C 108.934 -0.765 . . . . 0.0 108.934 -179.823 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 99' ' ' ALA . . . . . . . . . . . . . . . -64.42 -40.15 95.21 Favored 'General case' 0 N--CA 1.491 1.582 0 O-C-N 121.612 -0.68 . . . . 0.0 109.521 -179.393 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 100' ' ' ARG . . . . . . . . . . . . . 79.7 mtp85 -63.99 -41.9 97.37 Favored 'General case' 0 N--CA 1.491 1.6 0 O-C-N 121.769 -0.582 . . . . 0.0 109.453 -179.877 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 101' ' ' LEU . . . . . . . . . . . . . 11.1 mp -92.72 120.33 33.0 Favored 'General case' 0 N--CA 1.494 1.753 0 CA-C-O 121.687 0.756 . . . . 0.0 109.23 -179.935 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 102' ' ' GLU . . . . . . . . . . . . . 79.5 mm-40 -141.64 106.02 4.83 Favored 'General case' 0 N--CA 1.495 1.814 0 CA-C-O 121.701 0.762 . . . . 0.0 109.744 -179.956 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 103' ' ' HIS . . . . . . . . . . . . . 98.6 m-70 -111.75 124.49 52.44 Favored 'General case' 0 N--CA 1.499 2.02 0 CA-C-O 121.858 0.837 . . . . 0.0 109.948 179.98 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 104' ' ' HIS . . . . . . . . . . . . . 79.0 m80 -82.32 125.49 31.06 Favored 'General case' 0 N--CA 1.492 1.638 0 CA-C-O 121.713 0.768 . . . . 0.0 109.817 -179.831 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 105' ' ' HIS . . . . . . . . . . . . . 78.3 m80 -67.11 -42.22 84.91 Favored 'General case' 0 N--CA 1.491 1.599 0 N-CA-C 109.477 -0.564 . . . . 0.0 109.477 -179.459 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 106' ' ' HIS . . . . . . . . . . . . . 25.6 p80 -107.44 124.98 50.65 Favored 'General case' 0 N--CA 1.497 1.914 0 CA-C-O 121.741 0.782 . . . . 0.0 110.167 -179.611 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 107' ' ' HIS . . . . . . . . . . . . . 94.7 m-70 -66.74 -40.15 88.23 Favored 'General case' 0 N--CA 1.49 1.549 0 N-CA-C 109.025 -0.731 . . . . 0.0 109.025 179.996 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 108' ' ' HIS . . . . . . . . . . . . . 86.4 t60 . . . . . 0 N--CA 1.491 1.583 0 CA-C-O 118.301 -0.857 . . . . 0.0 109.621 179.839 . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 95.4 mtp . . . . . 0 N--CA 1.489 1.525 0 CA-C-O 121.702 0.763 . . . . 0.0 109.003 . . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 11.3 m -70.86 152.36 43.78 Favored 'General case' 0 N--CA 1.489 1.479 0 CA-C-O 121.985 0.898 . . . . 0.0 110.718 -179.57 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 3' ' ' ASN . . . . . . . . . . . . . 99.9 m-20 47.88 -169.74 0.02 OUTLIER 'General case' 0 N--CA 1.489 1.488 0 CA-C-O 121.811 0.815 . . . . 0.0 110.787 179.742 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 78.2 mt-30 -71.84 -166.95 0.24 Allowed 'General case' 0 C--N 1.304 -1.402 0 CA-C-O 121.908 0.861 . . . . 0.0 110.45 -179.415 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 97.3 m 50.1 93.03 0.02 OUTLIER 'General case' 0 N--CA 1.489 1.506 0 CA-C-O 121.858 0.837 . . . . 0.0 110.147 -179.835 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 6' ' ' CYS . . . . . 0.414 ' O ' ' SG ' ' A' ' 6' ' ' CYS . 28.1 p -171.17 67.12 0.04 OUTLIER 'General case' 0 N--CA 1.489 1.511 0 N-CA-C 108.693 -0.854 . . . . 0.0 108.693 179.574 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 7' ' ' VAL . . . . . . . . . . . . . 2.6 m -90.92 122.76 42.64 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.692 0 CA-C-O 121.746 0.784 . . . . 0.0 109.98 -179.48 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 15.1 pt-20 -94.92 -7.6 39.54 Favored 'General case' 0 N--CA 1.492 1.632 0 N-CA-C 108.715 -0.846 . . . . 0.0 108.715 179.334 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 9.2 m120 -70.71 148.38 48.06 Favored 'General case' 0 N--CA 1.494 1.769 0 O-C-N 121.462 -0.774 . . . . 0.0 110.67 -178.969 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 51.0 tp10 -156.63 114.44 3.23 Favored 'General case' 0 N--CA 1.492 1.645 0 O-C-N 121.441 -0.787 . . . . 0.0 109.534 179.684 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 14.5 p -72.1 136.22 26.16 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.697 0 CA-C-O 121.603 0.716 . . . . 0.0 110.101 -179.856 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 12' ' ' CYS . . . . . 0.48 ' SG ' ' N ' ' A' ' 13' ' ' GLU . 48.2 t -149.9 166.87 28.27 Favored 'General case' 0 N--CA 1.49 1.529 0 O-C-N 121.371 -0.831 . . . . 0.0 109.421 179.945 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 13' ' ' GLU . . . . . 0.544 ' O ' ' N ' ' A' ' 15' ' ' CYS . 43.7 tp10 -151.04 66.79 0.91 Allowed 'General case' 0 N--CA 1.491 1.608 0 O-C-N 121.474 -0.766 . . . . 0.0 109.227 -179.851 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . 44.1 16.13 0.01 OUTLIER 'General case' 0 N--CA 1.494 1.768 0 CA-C-O 121.653 0.74 . . . . 0.0 110.045 -179.779 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 15' ' ' CYS . . . . . 0.544 ' N ' ' O ' ' A' ' 13' ' ' GLU . 7.7 t -144.92 137.13 25.99 Favored 'General case' 0 N--CA 1.49 1.551 0 O-C-N 121.237 -0.915 . . . . 0.0 110.066 -179.959 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 76.21 21.17 76.3 Favored Glycine 0 N--CA 1.492 2.389 0 N-CA-C 109.542 -1.423 . . . . 0.0 109.542 -179.992 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 97.4 m -64.28 -40.42 95.93 Favored 'General case' 0 N--CA 1.491 1.601 0 O-C-N 121.361 -1.082 . . . . 0.0 109.528 179.897 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -71.31 143.04 50.43 Favored 'General case' 0 N--CA 1.493 1.721 0 O-C-N 121.215 -0.928 . . . . 0.0 110.535 -179.781 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 170.88 42.96 0.03 OUTLIER Glycine 0 N--CA 1.491 2.304 0 N-CA-C 108.822 -1.711 . . . . 0.0 108.822 179.626 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 20' ' ' GLU . . . . . 0.583 ' H ' ' CD ' ' A' ' 20' ' ' GLU . 1.7 pm0 -61.1 147.46 43.81 Favored 'General case' 0 N--CA 1.494 1.765 0 O-C-N 121.439 -1.036 . . . . 0.0 110.009 -179.521 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 21' ' ' ILE . . . . . . . . . . . . . 5.1 mp -97.29 126.18 50.18 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.691 0 O-C-N 121.359 -0.838 . . . . 0.0 110.359 -179.366 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 169.25 -113.86 0.53 Allowed Glycine 0 N--CA 1.487 2.033 0 N-CA-C 109.656 -1.378 . . . . 0.0 109.656 179.918 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 23' ' ' PHE . . . . . . . . . . . . . 94.9 m-85 -101.58 148.86 24.73 Favored 'General case' 0 N--CA 1.498 1.943 0 O-C-N 121.401 -1.058 . . . . 0.0 110.417 -179.525 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 19.9 tt -162.19 121.22 0.22 Allowed 'Isoleucine or valine' 0 N--CA 1.489 1.493 0 O-C-N 121.44 -0.787 . . . . 0.0 109.678 -179.757 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 25' ' ' ILE . . . . . . . . . . . . . 95.3 mt -83.22 -75.41 0.22 Allowed 'Isoleucine or valine' 0 N--CA 1.491 1.612 0 O-C-N 121.583 -0.698 . . . . 0.0 109.726 -179.88 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 26' ' ' ARG . . . . . 0.434 ' O ' ' O ' ' A' ' 27' ' ' GLU . 78.6 ttt180 -156.02 -17.95 0.1 Allowed 'General case' 0 N--CA 1.491 1.621 0 O-C-N 121.201 -0.937 . . . . 0.0 109.212 -179.609 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 27' ' ' GLU . . . . . 0.434 ' O ' ' O ' ' A' ' 26' ' ' ARG . 97.7 mt-10 56.07 159.46 0.01 OUTLIER 'General case' 0 N--CA 1.496 1.868 0 CA-C-O 121.474 0.654 . . . . 0.0 110.42 179.605 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . 117.26 -169.67 13.22 Favored Glycine 0 N--CA 1.498 2.778 0 N-CA-C 110.826 -0.909 . . . . 0.0 110.826 179.284 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 99.3 m-20 -70.53 -16.91 62.93 Favored 'General case' 0 N--CA 1.493 1.677 0 O-C-N 121.821 -0.811 . . . . 0.0 108.926 179.67 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 90.1 m-20 -82.88 -0.1 46.68 Favored 'General case' 0 N--CA 1.489 1.481 0 N-CA-C 108.414 -0.958 . . . . 0.0 108.414 179.463 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 52.2 t -126.64 135.38 63.9 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.9 0 N-CA-C 109.109 -0.7 . . . . 0.0 109.109 179.827 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -112.25 155.83 23.39 Favored 'General case' 0 N--CA 1.495 1.777 0 CA-C-O 121.629 0.728 . . . . 0.0 109.906 -179.378 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 83.6 tt0 -107.07 123.05 47.66 Favored 'General case' 0 N--CA 1.494 1.757 0 O-C-N 121.647 -0.658 . . . . 0.0 109.614 -179.578 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 34' ' ' VAL . . . . . . . . . . . . . 55.0 t -127.51 132.92 68.81 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.727 0 CA-C-O 121.681 0.753 . . . . 0.0 109.436 179.757 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 37.3 t -148.71 141.0 24.11 Favored 'General case' 0 N--CA 1.49 1.529 0 N-CA-C 109.143 -0.688 . . . . 0.0 109.143 179.61 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 4.9 mp -130.74 151.12 51.52 Favored 'General case' 0 N--CA 1.494 1.766 0 CA-C-O 121.76 0.79 . . . . 0.0 109.928 -179.683 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 37' ' ' PHE . . . . . . . . . . . . . 32.4 p90 -143.69 159.73 41.95 Favored 'General case' 0 C--N 1.301 -1.501 0 CA-C-O 121.551 0.691 . . . . 0.0 109.656 -179.733 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . 114.33 152.96 10.66 Favored Glycine 0 N--CA 1.493 2.475 0 N-CA-C 110.263 -1.135 . . . . 0.0 110.263 179.6 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 39' ' ' SER . . . . . 0.561 ' OG ' ' N ' ' A' ' 40' ' ' ASP . 16.8 t 52.59 -169.24 0.04 OUTLIER 'General case' 0 N--CA 1.491 1.598 0 CA-C-O 122.019 0.914 . . . . 0.0 110.883 179.622 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 40' ' ' ASP . . . . . 0.561 ' N ' ' OG ' ' A' ' 39' ' ' SER . 54.5 p-10 -85.42 178.48 7.43 Favored 'General case' 0 C--N 1.306 -1.318 0 CA-C-O 121.654 0.74 . . . . 0.0 110.178 -179.606 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 88.5 tttt -62.35 -39.0 91.69 Favored 'General case' 0 N--CA 1.49 1.559 0 CA-C-O 121.393 0.616 . . . . 0.0 110.32 -179.577 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -53.31 -41.91 66.13 Favored 'General case' 0 N--CA 1.493 1.714 0 O-C-N 121.286 -0.884 . . . . 0.0 109.825 -179.437 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 43' ' ' HIS . . . . . . . . . . . . . 86.5 t60 -66.76 -41.25 88.05 Favored 'General case' 0 N--CA 1.493 1.712 0 O-C-N 121.242 -0.911 . . . . 0.0 109.488 179.513 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 96.7 mt -63.18 -40.07 96.47 Favored 'General case' 0 N--CA 1.495 1.78 0 O-C-N 121.327 -0.858 . . . . 0.0 109.216 -180.0 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 97.1 mt-10 -61.23 -39.41 90.2 Favored 'General case' 0 N--CA 1.493 1.714 0 O-C-N 121.439 -0.788 . . . . 0.0 109.724 -179.921 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . -60.43 -49.12 82.06 Favored Glycine 0 N--CA 1.492 2.394 0 N-CA-C 109.814 -1.314 . . . . 0.0 109.814 179.96 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 52.1 mtpt -65.9 -37.91 87.35 Favored 'General case' 0 C--N 1.301 -1.526 0 O-C-N 121.429 -1.042 . . . . 0.0 109.565 179.62 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -62.58 -44.39 96.44 Favored 'General case' 0 C--N 1.302 -1.486 0 O-C-N 121.324 -0.86 . . . . 0.0 109.596 -178.805 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 49' ' ' ALA . . . . . . . . . . . . . . . -62.23 -41.76 98.69 Favored 'General case' 0 C--N 1.299 -1.601 0 O-C-N 121.069 -1.019 . . . . 0.0 109.471 -179.617 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 77.1 tt0 -69.47 -36.83 76.93 Favored 'General case' 0 C--N 1.306 -1.316 0 O-C-N 121.419 -0.8 . . . . 0.0 109.199 179.718 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 3.1 m-85 -61.98 -43.49 98.73 Favored 'General case' 0 N--CA 1.496 1.828 0 O-C-N 121.579 -0.701 . . . . 0.0 109.361 -179.996 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 52' ' ' ILE . . . . . . . . . . . . . 76.7 mt -63.66 -43.19 98.02 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.606 0 O-C-N 121.539 -0.726 . . . . 0.0 109.726 -179.883 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 78.1 p -61.13 -41.71 97.21 Favored 'General case' 0 N--CA 1.493 1.687 0 O-C-N 121.423 -0.798 . . . . 0.0 110.19 -179.253 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 54' ' ' LEU . . . . . . . . . . . . . 93.6 mt -64.98 -42.48 94.51 Favored 'General case' 0 N--CA 1.494 1.737 0 O-C-N 121.264 -0.897 . . . . 0.0 109.4 179.822 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -67.07 -37.06 83.34 Favored 'General case' 0 N--CA 1.491 1.596 0 O-C-N 121.504 -0.748 . . . . 0.0 109.568 179.799 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 56' ' ' LYS . . . . . . . . . . . . . 56.4 tttp -63.27 -43.97 96.43 Favored 'General case' 0 N--CA 1.487 1.377 0 O-C-N 121.491 -0.756 . . . . 0.0 109.568 -179.718 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 77.5 mt-30 -66.13 -44.4 84.35 Favored 'General case' 0 N--CA 1.493 1.687 0 O-C-N 121.324 -0.86 . . . . 0.0 109.433 179.898 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 58' ' ' VAL . . . . . . . . . . . . . 72.3 t -65.18 -45.09 94.98 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.554 0 O-C-N 121.498 -0.751 . . . . 0.0 109.47 179.627 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 59' ' ' TYR . . . . . . . . . . . . . 87.1 t80 -125.05 127.45 46.96 Favored 'General case' 0 N--CA 1.497 1.901 0 CA-C-O 121.748 0.785 . . . . 0.0 109.666 -179.653 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -66.17 148.74 51.38 Favored 'General case' 0 N--CA 1.49 1.554 0 CA-C-O 121.829 0.824 . . . . 0.0 110.848 -179.182 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 61' ' ' ASN . . . . . . . . . . . . . 6.3 p-10 42.93 66.72 0.73 Allowed 'General case' 0 N--CA 1.493 1.71 0 CA-C-O 121.844 0.83 . . . . 0.0 109.966 179.904 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 62' ' ' VAL . . . . . . . . . . . . . 11.7 p -85.55 136.29 23.14 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.616 0 O-C-N 121.549 -0.719 . . . . 0.0 109.794 179.824 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 96.1 mt-10 -111.97 145.24 39.95 Favored 'General case' 0 N--CA 1.496 1.872 0 CA-C-O 121.734 0.778 . . . . 0.0 109.971 -179.517 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 64' ' ' TYR . . . . . . . . . . . . . 46.9 p90 -149.52 161.54 41.93 Favored 'General case' 0 N--CA 1.49 1.552 0 CA-C-O 121.798 0.809 . . . . 0.0 110.212 -179.424 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 78.4 mm-40 -141.19 146.18 36.6 Favored 'General case' 0 N--CA 1.494 1.734 0 N-CA-C 109.034 -0.728 . . . . 0.0 109.034 179.851 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 66' ' ' VAL . . . . . . . . . . . . . 8.8 p -127.2 131.45 70.64 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.967 0 CA-C-O 121.608 0.718 . . . . 0.0 110.184 -179.744 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -78.95 167.18 36.95 Favored Pre-proline 0 C--N 1.305 -1.356 0 N-CA-C 109.155 -0.683 . . . . 0.0 109.155 -179.95 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 68' ' ' PRO . . . . . . . . . . . . . 53.0 Cg_exo -52.27 127.49 23.96 Favored 'Trans proline' 0 N--CA 1.495 1.57 0 C-N-CA 122.383 2.055 . . . . 0.0 112.905 179.573 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 69' ' ' VAL . . . . . . . . . . . . . 70.9 t -132.5 133.27 59.9 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.845 0 O-C-N 121.541 -0.724 . . . . 0.0 109.621 179.482 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -82.04 157.86 24.0 Favored 'General case' 0 C--N 1.302 -1.495 0 O-C-N 121.607 -0.683 . . . . 0.0 109.951 179.637 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 43.4 t0 -64.01 -37.98 89.42 Favored 'General case' 0 N--CA 1.493 1.696 0 CA-C-O 121.606 0.717 . . . . 0.0 109.697 179.552 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 72' ' ' ASN . . . . . . . . . . . . . 11.4 m120 -92.45 12.9 21.24 Favored 'General case' 0 N--CA 1.494 1.743 0 O-C-N 121.422 -0.799 . . . . 0.0 109.467 -179.567 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -64.25 146.51 54.22 Favored 'General case' 0 N--CA 1.496 1.83 0 O-C-N 121.19 -0.944 . . . . 0.0 110.406 -179.551 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 74' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -101.08 -4.35 27.53 Favored 'General case' 0 N--CA 1.494 1.748 0 O-C-N 121.515 -0.741 . . . . 0.0 109.69 179.819 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 82.9 tt0 -144.13 148.02 34.5 Favored 'General case' 0 N--CA 1.497 1.91 0 O-C-N 120.901 -1.125 . . . . 0.0 109.748 179.898 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 3.5 tt -126.17 135.31 51.49 Favored 'General case' 0 N--CA 1.49 1.573 0 CA-C-O 121.502 0.668 . . . . 0.0 109.549 -179.925 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 77' ' ' HIS . . . . . . . . . . . . . 99.1 m-70 -107.78 129.63 55.04 Favored 'General case' 0 N--CA 1.494 1.727 0 CA-C-O 121.578 0.704 . . . . 0.0 109.705 -179.519 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -148.03 153.99 39.67 Favored 'General case' 0 N--CA 1.49 1.529 0 O-C-N 121.587 -0.696 . . . . 0.0 109.438 -179.866 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 79.7 mtp85 -132.74 149.36 52.29 Favored 'General case' 0 N--CA 1.494 1.726 0 CA-C-O 121.393 0.616 . . . . 0.0 109.387 -179.817 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 80' ' ' PHE . . . . . . . . . . . . . 61.8 m-85 -127.53 150.63 49.6 Favored 'General case' 0 N--CA 1.495 1.802 0 CA-C-O 121.536 0.684 . . . . 0.0 109.455 -179.872 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 53.7 tttp -110.5 112.85 25.05 Favored 'General case' 0 N--CA 1.493 1.678 0 CA-C-O 121.569 0.7 . . . . 0.0 109.35 179.874 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 82' ' ' PHE . . . . . . . . . . . . . 59.1 m-85 -111.24 145.22 39.12 Favored 'General case' 0 N--CA 1.495 1.788 0 CA-C-O 121.598 0.713 . . . . 0.0 109.71 179.915 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 46.2 tp10 -66.46 -38.65 87.81 Favored 'General case' 0 C--N 1.301 -1.505 0 O-C-N 121.692 -0.63 . . . . 0.0 109.904 -179.818 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 84' ' ' VAL . . . . . 0.431 ' CG2' ' OE2' ' A' ' 87' ' ' GLU . 16.6 m -136.17 161.24 37.88 Favored 'Isoleucine or valine' 0 N--CA 1.499 1.994 0 O-C-N 121.322 -0.861 . . . . 0.0 110.52 -179.421 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 33.9 m -70.57 -16.54 62.87 Favored 'General case' 0 N--CA 1.49 1.556 0 CA-C-O 121.367 0.604 . . . . 0.0 109.883 -179.902 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 86' ' ' ALA . . . . . . . . . . . . . . . -60.78 -42.37 97.38 Favored 'General case' 0 N--CA 1.493 1.724 0 O-C-N 121.188 -0.945 . . . . 0.0 109.567 -179.876 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 87' ' ' GLU . . . . . 0.551 ' N ' ' OE1' ' A' ' 87' ' ' GLU . 0.4 OUTLIER -70.36 -34.06 72.16 Favored 'General case' 0 N--CA 1.491 1.605 0 O-C-N 121.33 -0.856 . . . . 0.0 109.224 179.858 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 88' ' ' LYS . . . . . . . . . . . . . 88.5 tttt -61.79 -47.07 86.79 Favored 'General case' 0 N--CA 1.49 1.53 0 O-C-N 121.293 -0.88 . . . . 0.0 109.77 -179.921 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 56.6 tp -63.38 -45.77 89.57 Favored 'General case' 0 N--CA 1.489 1.515 0 O-C-N 121.288 -0.883 . . . . 0.0 109.715 -179.489 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 90' ' ' ILE . . . . . . . . . . . . . 96.5 mt -66.04 -44.54 92.03 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.611 0 O-C-N 121.508 -0.745 . . . . 0.0 109.839 -179.832 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 91' ' ' PHE . . . . . . . . . . . . . 54.1 t80 -62.98 -43.95 97.38 Favored 'General case' 0 N--CA 1.492 1.629 0 CA-C-O 121.64 0.733 . . . . 0.0 109.799 -179.636 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 92' ' ' GLU . . . . . . . . . . . . . 40.6 tp10 -56.28 -58.98 5.66 Favored 'General case' 0 N--CA 1.493 1.682 0 O-C-N 121.461 -0.775 . . . . 0.0 110.444 -178.897 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 93' ' ' LEU . . . . . . . . . . . . . 10.8 mp -64.53 -39.27 93.46 Favored 'General case' 0 N--CA 1.495 1.778 0 O-C-N 121.266 -0.896 . . . . 0.0 110.553 -179.444 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 94' ' ' LYS . . . . . . . . . . . . . 38.6 ttmt -61.73 -46.96 87.41 Favored 'General case' 0 N--CA 1.493 1.719 0 O-C-N 120.997 -1.064 . . . . 0.0 110.639 -178.764 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 21.0 p -69.0 -40.6 78.61 Favored 'General case' 0 N--CA 1.493 1.719 0 O-C-N 120.887 -1.133 . . . . 0.0 109.686 -179.667 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 96' ' ' ARG . . . . . . . . . . . . . 82.6 mtp180 -64.89 -40.61 95.37 Favored 'General case' 0 N--CA 1.491 1.603 0 O-C-N 121.395 -0.816 . . . . 0.0 109.337 179.52 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 97' ' ' ALA . . . . . . . . . . . . . . . -61.65 -36.83 81.94 Favored 'General case' 0 N--CA 1.49 1.559 0 O-C-N 121.448 -0.783 . . . . 0.0 109.518 179.907 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 98' ' ' LEU . . . . . . . . . . . . . 5.3 tt -62.62 -45.06 94.61 Favored 'General case' 0 N--CA 1.491 1.587 0 CA-C-O 121.698 0.761 . . . . 0.0 109.442 -179.932 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 99' ' ' ALA . . . . . . . . . . . . . . . -67.13 -20.85 65.83 Favored 'General case' 0 N--CA 1.491 1.613 0 O-C-N 121.468 -0.77 . . . . 0.0 109.59 -179.895 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 100' ' ' ARG . . . . . . . . . . . . . 99.2 mtt180 -82.26 3.71 26.45 Favored 'General case' 0 N--CA 1.49 1.539 0 O-C-N 121.409 -0.807 . . . . 0.0 109.38 179.653 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 101' ' ' LEU . . . . . . . . . . . . . 91.6 mt -85.67 -4.52 59.19 Favored 'General case' 0 N--CA 1.493 1.685 0 O-C-N 121.339 -0.851 . . . . 0.0 108.865 179.583 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 102' ' ' GLU . . . . . . . . . . . . . 71.3 mm-40 -59.57 133.7 56.34 Favored 'General case' 0 N--CA 1.491 1.593 0 CA-C-O 121.818 0.818 . . . . 0.0 110.229 -179.628 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 103' ' ' HIS . . . . . . . . . . . . . 57.8 t-80 -101.97 60.26 0.86 Allowed 'General case' 0 N--CA 1.492 1.628 0 O-C-N 121.641 -0.662 . . . . 0.0 109.404 179.938 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 104' ' ' HIS . . . . . 0.498 ' C ' ' H ' ' A' ' 106' ' ' HIS . 74.6 m80 -125.91 6.48 7.32 Favored 'General case' 0 N--CA 1.498 1.953 0 N-CA-C 108.686 -0.857 . . . . 0.0 108.686 179.611 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 105' ' ' HIS . . . . . . . . . . . . . 78.8 m80 52.15 9.63 0.1 Allowed 'General case' 0 N--CA 1.496 1.831 0 O-C-N 121.499 -0.75 . . . . 0.0 109.64 -179.945 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 106' ' ' HIS . . . . . 0.498 ' H ' ' C ' ' A' ' 104' ' ' HIS . 95.6 m-70 -133.61 145.42 50.0 Favored 'General case' 0 N--CA 1.496 1.842 0 O-C-N 121.392 -0.818 . . . . 0.0 109.963 179.862 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 107' ' ' HIS . . . . . . . . . . . . . 94.1 m-70 -66.77 -38.84 87.37 Favored 'General case' 0 N--CA 1.49 1.564 0 CA-C-O 121.52 0.676 . . . . 0.0 109.675 179.718 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 108' ' ' HIS . . . . . . . . . . . . . 85.4 t60 . . . . . 0 N--CA 1.492 1.64 0 CA-C-O 118.019 -0.991 . . . . 0.0 109.691 -179.948 . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 38.2 ttm . . . . . 0 N--CA 1.489 1.493 0 N-CA-C 108.984 -0.747 . . . . 0.0 108.984 . . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 12.4 p 52.49 51.02 16.98 Favored 'General case' 0 N--CA 1.493 1.686 0 CA-C-O 121.66 0.743 . . . . 0.0 109.774 179.913 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 3' ' ' ASN . . . . . . . . . . . . . 54.3 t-20 -64.02 -40.46 96.39 Favored 'General case' 0 N--CA 1.493 1.694 0 CA-C-O 121.575 0.702 . . . . 0.0 109.879 179.552 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 14.4 mm100 -70.41 127.79 33.94 Favored 'General case' 0 N--CA 1.494 1.732 0 O-C-N 121.469 -0.769 . . . . 0.0 109.872 -179.278 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 81.5 p -78.06 165.51 23.93 Favored 'General case' 0 N--CA 1.492 1.652 0 CA-C-O 121.566 0.698 . . . . 0.0 110.364 -179.529 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 28.0 p -129.72 128.03 41.66 Favored 'General case' 0 N--CA 1.498 1.933 0 CA-C-O 121.72 0.771 . . . . 0.0 109.799 -179.571 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 7' ' ' VAL . . . . . . . . . . . . . 71.6 t -92.22 131.08 40.28 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.684 0 CA-C-O 122.016 0.912 . . . . 0.0 110.443 -179.408 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 98.0 mt-10 46.53 85.31 0.02 OUTLIER 'General case' 0 N--CA 1.489 1.509 0 CA-C-O 121.734 0.778 . . . . 0.0 110.179 179.804 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 9' ' ' ASN . . . . . 0.505 ' N ' ' OE2' ' A' ' 10' ' ' GLU . 54.4 p30 -89.79 -6.44 55.95 Favored 'General case' 0 N--CA 1.493 1.686 0 CA-C-O 121.321 0.582 . . . . 0.0 109.478 179.744 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 10' ' ' GLU . . . . . 0.512 ' H ' ' CD ' ' A' ' 10' ' ' GLU . 2.3 pm0 -94.08 -5.6 47.0 Favored 'General case' 0 N--CA 1.497 1.88 0 O-C-N 121.397 -0.815 . . . . 0.0 109.362 -179.998 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 7.0 p -73.83 128.35 36.2 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.711 0 O-C-N 121.405 -0.809 . . . . 0.0 109.971 -179.497 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 38.1 m -98.14 81.6 2.83 Favored 'General case' 0 N--CA 1.495 1.785 0 CA-C-O 121.589 0.709 . . . . 0.0 109.7 -179.579 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 48.3 tp10 -82.44 135.99 35.02 Favored 'General case' 0 N--CA 1.494 1.729 0 CA-C-O 121.733 0.778 . . . . 0.0 110.081 -179.727 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -82.3 112.81 19.62 Favored 'General case' 0 N--CA 1.494 1.747 0 CA-C-O 121.669 0.747 . . . . 0.0 110.396 -179.565 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 66.5 m -142.09 155.57 45.37 Favored 'General case' 0 N--CA 1.496 1.855 0 CA-C-O 121.645 0.735 . . . . 0.0 109.902 -179.948 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 16' ' ' GLY . . . . . 0.453 ' O ' ' O ' ' A' ' 17' ' ' CYS . . . 89.36 -6.74 83.13 Favored Glycine 0 N--CA 1.493 2.455 0 N-CA-C 109.901 -1.279 . . . . 0.0 109.901 179.903 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 17' ' ' CYS . . . . . 0.453 ' O ' ' O ' ' A' ' 16' ' ' GLY . 62.1 m 37.51 97.0 0.0 OUTLIER 'General case' 0 N--CA 1.5 2.058 0 CA-C-O 121.731 0.776 . . . . 0.0 110.724 179.892 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -56.23 139.77 46.78 Favored 'General case' 0 N--CA 1.492 1.654 0 CA-C-O 121.708 0.766 . . . . 0.0 110.462 -179.481 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -166.35 69.93 0.18 Allowed Glycine 0 N--CA 1.491 2.306 0 N-CA-C 109.31 -1.516 . . . . 0.0 109.31 179.959 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 20' ' ' GLU . . . . . 0.425 ' C ' ' H ' ' A' ' 22' ' ' GLY . 74.7 mm-40 55.43 35.66 25.51 Favored 'General case' 0 N--CA 1.494 1.735 0 O-C-N 121.716 -0.873 . . . . 0.0 109.462 179.812 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 21' ' ' ILE . . . . . . . . . . . . . 95.9 mt -67.82 0.05 1.02 Allowed 'Isoleucine or valine' 0 N--CA 1.49 1.531 0 CA-C-O 121.756 0.789 . . . . 0.0 109.333 179.522 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 22' ' ' GLY . . . . . 0.425 ' H ' ' C ' ' A' ' 20' ' ' GLU . . . 89.57 70.67 1.24 Allowed Glycine 0 N--CA 1.493 2.437 0 N-CA-C 109.888 -1.285 . . . . 0.0 109.888 179.765 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 23' ' ' PHE . . . . . . . . . . . . . 55.6 p90 -82.45 15.84 2.34 Favored 'General case' 0 N--CA 1.492 1.645 0 O-C-N 121.673 -0.898 . . . . 0.0 109.243 179.681 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 16.3 pt -76.9 139.66 18.42 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.775 0 CA-C-O 121.65 0.738 . . . . 0.0 110.472 -179.717 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 25' ' ' ILE . . . . . 0.414 HG21 HD13 ' A' ' 25' ' ' ILE . 92.0 mt -99.0 131.74 45.67 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.623 0 CA-C-O 121.73 0.776 . . . . 0.0 110.443 -179.622 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 25.6 mmt85 -63.35 142.42 58.4 Favored 'General case' 0 C--N 1.302 -1.458 0 CA-C-O 122.11 0.957 . . . . 0.0 110.362 -179.514 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 27' ' ' GLU . . . . . 0.563 ' CD ' ' H ' ' A' ' 27' ' ' GLU . 2.1 pm0 -73.73 164.84 26.12 Favored 'General case' 0 C--N 1.3 -1.585 0 CA-C-O 121.835 0.826 . . . . 0.0 110.664 -179.253 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 28' ' ' GLY . . . . . 0.446 ' O ' ' OD1' ' A' ' 29' ' ' ASP . . . 91.53 -157.87 24.94 Favored Glycine 0 N--CA 1.49 2.29 0 N-CA-C 110.486 -1.046 . . . . 0.0 110.486 179.528 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 29' ' ' ASP . . . . . 0.446 ' OD1' ' O ' ' A' ' 28' ' ' GLY . 7.1 p-10 40.32 -145.98 0.03 OUTLIER 'General case' 0 N--CA 1.49 1.55 0 CA-C-O 121.86 0.838 . . . . 0.0 111.126 179.969 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 30' ' ' ASP . . . . . 0.429 ' OD1' ' N ' ' A' ' 30' ' ' ASP . 9.0 p-10 -82.74 72.74 9.81 Favored 'General case' 0 C--N 1.303 -1.451 0 O-C-N 121.596 -0.69 . . . . 0.0 109.777 -179.302 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 31' ' ' VAL . . . . . 0.583 ' CG1' HH11 ' A' ' 79' ' ' ARG . 53.5 t -124.96 135.33 64.42 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.881 0 CA-C-O 121.426 0.632 . . . . 0.0 109.433 179.858 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -130.56 140.98 50.46 Favored 'General case' 0 N--CA 1.494 1.759 0 CA-C-O 121.585 0.707 . . . . 0.0 109.471 -179.915 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 22.2 pt-20 -96.01 140.36 30.86 Favored 'General case' 0 N--CA 1.493 1.686 0 CA-C-O 121.501 0.667 . . . . 0.0 110.055 -179.495 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 34' ' ' VAL . . . . . . . . . . . . . 55.4 t -127.0 132.8 69.58 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.763 0 CA-C-O 121.513 0.673 . . . . 0.0 109.304 179.885 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 39.4 t -140.35 128.27 21.99 Favored 'General case' 0 N--CA 1.493 1.701 0 CA-C-O 121.506 0.669 . . . . 0.0 109.724 -179.968 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 11.0 mp -111.25 154.06 24.99 Favored 'General case' 0 N--CA 1.499 2.0 0 CA-C-O 121.509 0.671 . . . . 0.0 109.434 179.977 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 37' ' ' PHE . . . . . . . . . . . . . 92.3 t80 -124.58 130.24 52.07 Favored 'General case' 0 N--CA 1.493 1.679 0 CA-C-O 121.644 0.735 . . . . 0.0 109.508 -179.794 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . -164.95 -171.34 31.07 Favored Glycine 0 N--CA 1.491 2.314 0 N-CA-C 110.182 -1.167 . . . . 0.0 110.182 -179.697 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 39' ' ' SER . . . . . 0.511 ' HG ' ' H ' ' A' ' 40' ' ' ASP . 14.0 p -85.99 -90.06 0.11 Allowed 'General case' 0 N--CA 1.497 1.903 0 O-C-N 121.909 -0.759 . . . . 0.0 110.738 -179.312 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 40' ' ' ASP . . . . . 0.511 ' H ' ' HG ' ' A' ' 39' ' ' SER . 52.6 p-10 -84.67 168.65 15.08 Favored 'General case' 0 N--CA 1.494 1.742 0 CA-C-O 121.777 0.799 . . . . 0.0 110.525 -178.944 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 88.9 tttt -65.2 -38.08 89.33 Favored 'General case' 0 N--CA 1.496 1.874 0 CA-C-O 121.311 0.577 . . . . 0.0 110.584 -179.506 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -55.1 -41.7 71.97 Favored 'General case' 0 N--CA 1.498 1.933 0 O-C-N 121.358 -0.839 . . . . 0.0 110.413 -178.974 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 43' ' ' HIS . . . . . . . . . . . . . 54.8 t-80 -66.63 -42.09 87.31 Favored 'General case' 0 N--CA 1.496 1.854 0 O-C-N 121.473 -0.767 . . . . 0.0 110.258 -179.555 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 74.1 mt -63.94 -40.34 96.24 Favored 'General case' 0 N--CA 1.497 1.897 0 O-C-N 121.469 -0.769 . . . . 0.0 109.767 -179.412 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 71.7 mm-40 -61.44 -43.46 98.83 Favored 'General case' 0 N--CA 1.492 1.655 0 CA-C-O 121.54 0.686 . . . . 0.0 109.794 -179.451 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . -62.2 -48.33 83.59 Favored Glycine 0 N--CA 1.494 2.534 0 N-CA-C 110.226 -1.15 . . . . 0.0 110.226 -179.648 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 61.5 tttp -66.82 -30.2 70.33 Favored 'General case' 0 N--CA 1.495 1.786 0 O-C-N 121.527 -0.984 . . . . 0.0 109.536 179.936 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 45.3 tp -62.23 -38.24 88.45 Favored 'General case' 0 N--CA 1.491 1.624 0 CA-C-O 121.492 0.663 . . . . 0.0 109.574 -179.509 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 49' ' ' ALA . . . . . . . . . . . . . . . -51.53 -33.47 32.16 Favored 'General case' 0 N--CA 1.493 1.687 0 O-C-N 121.565 -0.71 . . . . 0.0 109.559 -179.588 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 97.8 mt-10 -63.65 -43.2 97.44 Favored 'General case' 0 N--CA 1.493 1.695 0 O-C-N 121.585 -0.697 . . . . 0.0 109.622 -179.906 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 32.8 m-85 -62.13 -46.39 89.23 Favored 'General case' 0 N--CA 1.494 1.764 0 O-C-N 121.466 -0.771 . . . . 0.0 109.706 -179.975 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 52' ' ' ILE . . . . . . . . . . . . . 96.5 mt -65.08 -43.99 95.79 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.652 0 O-C-N 121.649 -0.657 . . . . 0.0 109.871 -179.444 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 9.7 t -63.01 -46.63 86.72 Favored 'General case' 0 N--CA 1.495 1.807 0 O-C-N 121.48 -0.762 . . . . 0.0 109.656 -179.701 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 54' ' ' LEU . . . . . . . . . . . . . 91.0 mt -67.32 -40.0 85.92 Favored 'General case' 0 N--CA 1.494 1.732 0 CA-C-O 121.743 0.782 . . . . 0.0 109.181 179.54 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -58.83 -46.33 87.91 Favored 'General case' 0 N--CA 1.494 1.735 0 CA-C-O 121.46 0.648 . . . . 0.0 109.858 -179.447 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 56' ' ' LYS . . . . . . . . . . . . . 68.0 mttm -64.2 -41.21 97.16 Favored 'General case' 0 N--CA 1.492 1.668 0 O-C-N 121.537 -0.727 . . . . 0.0 109.647 179.834 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 67.2 tp60 -65.41 -46.1 81.32 Favored 'General case' 0 N--CA 1.491 1.608 0 O-C-N 121.591 -0.693 . . . . 0.0 109.506 -179.739 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 58' ' ' VAL . . . . . . . . . . . . . 71.5 t -65.89 -44.08 92.78 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.568 0 O-C-N 121.622 -0.673 . . . . 0.0 109.441 -179.98 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 59' ' ' TYR . . . . . 0.412 ' O ' ' O ' ' A' ' 60' ' ' ALA . 52.8 t80 -125.37 133.1 52.66 Favored 'General case' 0 N--CA 1.498 1.964 0 CA-C-O 121.799 0.809 . . . . 0.0 109.758 -179.874 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 60' ' ' ALA . . . . . 0.412 ' O ' ' O ' ' A' ' 59' ' ' TYR . . . -46.45 -100.04 0.0 OUTLIER 'General case' 0 N--CA 1.494 1.733 0 CA-C-O 121.562 0.696 . . . . 0.0 111.042 -179.471 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 61' ' ' ASN . . . . . . . . . . . . . 10.7 m120 -86.01 90.09 8.0 Favored 'General case' 0 N--CA 1.491 1.612 0 CA-C-O 121.805 0.812 . . . . 0.0 109.79 -178.676 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 62' ' ' VAL . . . . . . . . . . . . . 9.6 p -90.89 140.45 15.96 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.587 0 CA-C-O 121.488 0.661 . . . . 0.0 109.952 179.947 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 76.1 mm-40 -112.67 134.44 54.19 Favored 'General case' 0 N--CA 1.494 1.741 0 CA-C-O 121.589 0.709 . . . . 0.0 109.445 -179.809 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 64' ' ' TYR . . . . . . . . . . . . . 47.0 p90 -148.9 162.5 39.73 Favored 'General case' 0 N--CA 1.492 1.661 0 CA-C-O 121.718 0.771 . . . . 0.0 110.078 -179.333 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 15.7 pt-20 -143.18 154.37 43.8 Favored 'General case' 0 N--CA 1.494 1.732 0 N-CA-C 109.2 -0.667 . . . . 0.0 109.2 179.905 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 66' ' ' VAL . . . . . . . . . . . . . 77.3 t -119.83 130.42 74.2 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.878 0 CA-C-O 121.686 0.755 . . . . 0.0 109.856 -179.569 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -84.36 170.99 12.12 Favored Pre-proline 0 N--CA 1.49 1.559 0 N-CA-C 109.423 -0.584 . . . . 0.0 109.423 -179.932 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 68' ' ' PRO . . . . . . . . . . . . . 62.9 Cg_exo -52.01 131.47 38.97 Favored 'Trans proline' 0 N--CA 1.496 1.659 0 C-N-CA 122.699 2.266 . . . . 0.0 112.971 -179.806 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 69' ' ' VAL . . . . . . . . . . . . . 53.3 t -132.33 131.99 60.6 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.897 0 CA-C-O 121.651 0.738 . . . . 0.0 109.896 179.838 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -74.9 152.72 38.84 Favored 'General case' 0 N--CA 1.491 1.59 0 CA-C-O 121.731 0.776 . . . . 0.0 110.021 179.625 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 53.3 m-20 -64.11 -36.0 82.6 Favored 'General case' 0 N--CA 1.493 1.677 0 CA-C-O 121.541 0.686 . . . . 0.0 109.267 179.969 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 72' ' ' ASN . . . . . . . . . . . . . 63.2 t30 -94.58 13.37 24.35 Favored 'General case' 0 N--CA 1.494 1.745 0 O-C-N 121.279 -0.888 . . . . 0.0 109.279 179.977 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -58.05 145.38 36.58 Favored 'General case' 0 N--CA 1.497 1.889 0 CA-C-O 121.74 0.781 . . . . 0.0 110.806 -179.273 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 74' ' ' THR . . . . . . . . . . . . . 41.0 p -98.45 -1.03 42.34 Favored 'General case' 0 N--CA 1.493 1.717 0 N-CA-C 109.309 -0.626 . . . . 0.0 109.309 179.6 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 18.9 pt-20 -154.3 163.04 40.76 Favored 'General case' 0 N--CA 1.494 1.747 0 O-C-N 121.259 -0.9 . . . . 0.0 109.912 179.887 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 5.3 tt -126.41 127.81 46.02 Favored 'General case' 0 N--CA 1.494 1.738 0 CA-C-O 121.574 0.702 . . . . 0.0 109.728 -179.855 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 77' ' ' HIS . . . . . . . . . . . . . 60.6 t-80 -97.83 124.01 42.04 Favored 'General case' 0 N--CA 1.491 1.606 0 CA-C-O 121.775 0.798 . . . . 0.0 109.88 -179.765 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -142.75 158.03 44.05 Favored 'General case' 0 N--CA 1.491 1.618 0 N-CA-C 108.881 -0.785 . . . . 0.0 108.881 179.693 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 79' ' ' ARG . . . . . 0.583 HH11 ' CG1' ' A' ' 31' ' ' VAL . 63.2 ttm-85 -128.83 137.67 51.62 Favored 'General case' 0 N--CA 1.493 1.693 0 CA-C-O 121.536 0.684 . . . . 0.0 109.551 -179.685 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 80' ' ' PHE . . . . . . . . . . . . . 59.3 m-85 -123.78 146.67 48.16 Favored 'General case' 0 N--CA 1.496 1.844 0 CA-C-O 121.521 0.677 . . . . 0.0 109.524 -179.803 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 81' ' ' LYS . . . . . 0.413 ' HZ1' ' CG ' ' A' ' 30' ' ' ASP . 63.6 tttp -115.76 128.91 56.21 Favored 'General case' 0 N--CA 1.496 1.845 0 N-CA-C 109.115 -0.698 . . . . 0.0 109.115 -179.859 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 82' ' ' PHE . . . . . 0.402 ' O ' ' OD2' ' A' ' 30' ' ' ASP . 94.4 m-85 -122.55 -122.01 0.28 Allowed 'General case' 0 N--CA 1.499 1.979 0 CA-C-O 121.346 0.593 . . . . 0.0 109.902 -179.413 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 52.8 tp10 -150.71 -39.84 0.13 Allowed 'General case' 0 N--CA 1.489 1.521 0 N-CA-C 108.747 -0.834 . . . . 0.0 108.747 -179.544 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 84' ' ' VAL . . . . . . . . . . . . . 25.6 m -137.12 157.7 35.48 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.888 0 O-C-N 121.469 -0.77 . . . . 0.0 109.686 179.928 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 85' ' ' SER . . . . . 0.482 ' O ' ' N ' ' A' ' 88' ' ' LYS . 11.3 t -64.08 -42.03 97.11 Favored 'General case' 0 N--CA 1.494 1.726 0 CA-C-O 121.33 0.586 . . . . 0.0 110.329 -179.979 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 86' ' ' ALA . . . . . 0.42 ' C ' ' O ' ' A' ' 85' ' ' SER . . . -39.22 -46.06 1.45 Allowed 'General case' 0 N--CA 1.5 2.026 0 CA-C-O 121.45 0.643 . . . . 0.0 110.587 -179.01 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 96.1 mt-10 -62.73 -33.94 76.16 Favored 'General case' 0 N--CA 1.494 1.73 0 O-C-N 121.469 -0.769 . . . . 0.0 110.008 -179.779 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 88' ' ' LYS . . . . . 0.482 ' N ' ' O ' ' A' ' 85' ' ' SER . 88.2 tttt -63.02 -43.11 99.62 Favored 'General case' 0 N--CA 1.492 1.664 0 O-C-N 121.414 -0.804 . . . . 0.0 109.648 -179.802 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 89' ' ' LEU . . . . . 0.447 ' CD1' ' N ' ' A' ' 89' ' ' LEU . 10.6 mp -63.47 -48.47 77.53 Favored 'General case' 0 N--CA 1.495 1.788 0 O-C-N 121.604 -0.685 . . . . 0.0 110.371 -179.093 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 90' ' ' ILE . . . . . 0.506 ' CD1' ' N ' ' A' ' 90' ' ' ILE . 1.4 mp -69.67 -43.65 80.03 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.756 0 O-C-N 121.355 -0.84 . . . . 0.0 108.972 179.962 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 91' ' ' PHE . . . . . . . . . . . . . 88.3 t80 -59.2 -47.6 84.74 Favored 'General case' 0 C--N 1.302 -1.478 0 CA-C-O 121.725 0.774 . . . . 0.0 109.184 -179.585 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 92' ' ' GLU . . . . . . . . . . . . . 84.2 tt0 -69.97 -31.83 69.74 Favored 'General case' 0 N--CA 1.49 1.56 0 CA-C-O 121.533 0.682 . . . . 0.0 109.431 179.681 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 93' ' ' LEU . . . . . . . . . . . . . 61.6 tp -62.99 -45.46 92.3 Favored 'General case' 0 N--CA 1.492 1.651 0 O-C-N 121.328 -0.857 . . . . 0.0 109.754 -179.455 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 94' ' ' LYS . . . . . . . . . . . . . 52.4 mtmt -65.24 -42.38 93.43 Favored 'General case' 0 N--CA 1.491 1.6 0 CA-C-O 121.467 0.651 . . . . 0.0 110.088 -179.386 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 34.2 p -67.02 -38.35 85.79 Favored 'General case' 0 N--CA 1.492 1.669 0 O-C-N 121.514 -0.741 . . . . 0.0 110.193 -179.325 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 96' ' ' ARG . . . . . . . . . . . . . 77.8 mmt-85 -66.19 -39.02 89.38 Favored 'General case' 0 N--CA 1.493 1.686 0 O-C-N 121.302 -0.874 . . . . 0.0 109.563 -179.954 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 97' ' ' ALA . . . . . . . . . . . . . . . -64.83 -41.67 95.55 Favored 'General case' 0 C--N 1.301 -1.535 0 CA-C-O 121.635 0.731 . . . . 0.0 109.187 179.997 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 98' ' ' LEU . . . . . . . . . . . . . 81.6 mt -64.64 -42.79 95.21 Favored 'General case' 0 N--CA 1.492 1.661 0 CA-C-O 121.548 0.689 . . . . 0.0 109.665 179.865 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 99' ' ' ALA . . . . . . . . . . . . . . . -71.82 -47.41 53.42 Favored 'General case' 0 N--CA 1.493 1.689 0 CA-C-O 121.602 0.715 . . . . 0.0 109.909 -179.792 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 100' ' ' ARG . . . . . . . . . . . . . 94.9 mtt-85 -66.17 -43.09 87.88 Favored 'General case' 0 N--CA 1.492 1.671 0 O-C-N 121.561 -0.712 . . . . 0.0 110.018 -179.637 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 101' ' ' LEU . . . . . . . . . . . . . 69.2 mt -100.61 130.46 46.67 Favored 'General case' 0 N--CA 1.495 1.799 0 O-C-N 121.409 -0.807 . . . . 0.0 109.901 -179.448 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 102' ' ' GLU . . . . . . . . . . . . . 81.5 tt0 -90.01 -12.17 39.41 Favored 'General case' 0 N--CA 1.488 1.464 0 N-CA-C 109.153 -0.684 . . . . 0.0 109.153 179.814 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 103' ' ' HIS . . . . . . . . . . . . . 41.9 p-80 -150.9 162.46 40.75 Favored 'General case' 0 N--CA 1.498 1.932 0 O-C-N 121.212 -0.93 . . . . 0.0 110.191 179.949 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 104' ' ' HIS . . . . . . . . . . . . . 97.5 m-70 -88.85 118.63 28.69 Favored 'General case' 0 N--CA 1.493 1.724 0 CA-C-O 121.758 0.79 . . . . 0.0 110.011 -179.801 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 105' ' ' HIS . . . . . 0.469 ' HD1' ' N ' ' A' ' 106' ' ' HIS . 0.0 OUTLIER -97.31 10.09 40.51 Favored 'General case' 0 N--CA 1.493 1.7 0 CA-C-O 121.605 0.717 . . . . 0.0 109.103 179.707 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 106' ' ' HIS . . . . . 0.469 ' N ' ' HD1' ' A' ' 105' ' ' HIS . 70.8 m80 -61.77 -39.08 90.39 Favored 'General case' 0 N--CA 1.492 1.663 0 CA-C-O 121.563 0.697 . . . . 0.0 109.26 179.435 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 107' ' ' HIS . . . . . . . . . . . . . 78.8 m80 -71.9 134.3 45.95 Favored 'General case' 0 N--CA 1.49 1.55 0 CA-C-O 121.74 0.781 . . . . 0.0 109.924 -179.442 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 108' ' ' HIS . . . . . . . . . . . . . 51.1 p-80 . . . . . 0 N--CA 1.494 1.752 0 CA-C-O 118.04 -0.981 . . . . 0.0 109.644 -179.815 . . . . . . . . 0 0 . 1 . 011 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 65.3 ttp . . . . . 0 N--CA 1.49 1.57 0 CA-C-O 121.493 0.663 . . . . 0.0 109.455 . . . . . . . . . 0 0 . 1 . 011 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 97.3 p -157.98 163.51 37.72 Favored 'General case' 0 N--CA 1.494 1.744 0 CA-C-O 121.703 0.763 . . . . 0.0 110.233 -179.954 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 3' ' ' ASN . . . . . . . . . . . . . 11.1 p30 -87.32 117.15 25.89 Favored 'General case' 0 N--CA 1.495 1.775 0 CA-C-O 121.51 0.672 . . . . 0.0 109.604 -179.815 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 7.2 pt20 -87.02 -2.25 58.49 Favored 'General case' 0 N--CA 1.495 1.788 0 N-CA-C 108.996 -0.742 . . . . 0.0 108.996 -179.68 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 70.7 p 46.53 -141.99 0.38 Allowed 'General case' 0 N--CA 1.494 1.744 0 CA-C-O 121.537 0.684 . . . . 0.0 110.582 179.656 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 21.1 p -158.67 177.35 11.29 Favored 'General case' 0 C--N 1.303 -1.434 0 CA-C-O 121.558 0.694 . . . . 0.0 110.03 -179.482 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 7' ' ' VAL . . . . . . . . . . . . . 78.0 t -71.22 -21.96 22.21 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.593 0 N-CA-C 109.29 -0.633 . . . . 0.0 109.29 -179.278 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 97.9 mt-10 -83.97 120.24 25.87 Favored 'General case' 0 N--CA 1.492 1.665 0 CA-C-O 121.585 0.707 . . . . 0.0 109.753 -179.929 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 66.1 t30 -151.91 -49.18 0.11 Allowed 'General case' 0 N--CA 1.492 1.639 0 O-C-N 121.556 -0.715 . . . . 0.0 109.074 179.522 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 98.1 mt-10 -72.87 150.17 42.87 Favored 'General case' 0 N--CA 1.496 1.868 0 CA-C-O 121.68 0.753 . . . . 0.0 110.812 -179.219 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 78.1 t -73.41 132.92 32.69 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.71 0 CA-C-O 121.728 0.775 . . . . 0.0 110.416 -179.308 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 47.6 m -94.63 143.02 26.78 Favored 'General case' 0 N--CA 1.493 1.685 0 CA-C-O 121.805 0.812 . . . . 0.0 110.428 -179.349 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 83.2 tt0 -161.61 83.79 0.61 Allowed 'General case' 0 N--CA 1.49 1.549 0 CA-C-O 121.513 0.673 . . . . 0.0 109.478 179.682 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -83.89 106.47 15.59 Favored 'General case' 0 N--CA 1.494 1.73 0 CA-C-O 121.629 0.728 . . . . 0.0 109.811 179.68 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 58.5 m 41.11 57.0 2.93 Favored 'General case' 0 N--CA 1.492 1.673 0 CA-C-O 121.496 0.665 . . . . 0.0 109.795 179.928 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . -66.98 141.22 39.37 Favored Glycine 0 N--CA 1.492 2.419 0 N-CA-C 110.577 -1.009 . . . . 0.0 110.577 -179.449 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 14.9 p -90.15 142.12 28.03 Favored 'General case' 0 N--CA 1.489 1.515 0 CA-C-O 121.615 0.721 . . . . 0.0 109.881 179.892 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -77.84 -78.11 0.14 Allowed 'General case' 0 C--N 1.3 -1.567 0 N-CA-C 109.4 -0.593 . . . . 0.0 109.4 179.859 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -84.84 135.23 13.33 Favored Glycine 0 N--CA 1.494 2.562 0 N-CA-C 111.146 -0.782 . . . . 0.0 111.146 -178.924 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 20' ' ' GLU . . . . . 0.418 ' HG3' ' H ' ' A' ' 22' ' ' GLY . 27.9 tp10 -71.51 153.03 42.5 Favored 'General case' 0 N--CA 1.488 1.437 0 CA-C-O 121.669 0.747 . . . . 0.0 109.998 179.835 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 21' ' ' ILE . . . . . . . . . . . . . 37.1 pt -91.36 -4.25 10.72 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.747 0 N-CA-C 109.087 -0.708 . . . . 0.0 109.087 -179.791 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 22' ' ' GLY . . . . . 0.418 ' H ' ' HG3' ' A' ' 20' ' ' GLU . . . 63.71 107.26 0.01 OUTLIER Glycine 0 N--CA 1.494 2.516 0 N-CA-C 110.846 -0.901 . . . . 0.0 110.846 179.113 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 23' ' ' PHE . . . . . . . . . . . . . 86.0 m-85 -76.95 -178.18 4.8 Favored 'General case' 0 N--CA 1.493 1.696 0 CA-C-O 121.611 0.719 . . . . 0.0 110.366 179.732 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 38.3 mm -65.12 -43.68 95.7 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.61 0 O-C-N 121.72 -0.613 . . . . 0.0 109.655 -179.233 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 25' ' ' ILE . . . . . . . . . . . . . 96.6 mt -79.91 125.38 38.86 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.688 0 CA-C-O 121.928 0.87 . . . . 0.0 109.687 -179.573 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 73.9 ttp85 -77.53 132.72 38.5 Favored 'General case' 0 N--CA 1.493 1.694 0 CA-C-O 121.809 0.814 . . . . 0.0 110.68 -178.81 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 15.1 pt-20 -77.87 147.21 35.22 Favored 'General case' 0 N--CA 1.49 1.537 0 CA-C-O 121.813 0.816 . . . . 0.0 110.496 179.987 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . -175.91 -172.58 40.83 Favored Glycine 0 N--CA 1.487 2.1 0 N-CA-C 110.25 -1.14 . . . . 0.0 110.25 179.702 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 98.8 m-20 -68.15 -16.05 63.84 Favored 'General case' 0 N--CA 1.489 1.504 0 O-C-N 121.95 -0.735 . . . . 0.0 109.114 -179.575 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 39.1 p-10 -88.5 2.16 53.42 Favored 'General case' 0 N--CA 1.494 1.743 0 O-C-N 121.729 -0.607 . . . . 0.0 109.366 -179.776 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 50.3 t -123.64 133.6 68.76 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.955 0 CA-C-O 121.602 0.715 . . . . 0.0 109.985 179.519 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 32' ' ' ALA . . . . . 0.588 ' CB ' ' HZ1' ' A' ' 88' ' ' LYS . . . -116.96 150.6 38.28 Favored 'General case' 0 N--CA 1.497 1.919 0 CA-C-O 121.977 0.894 . . . . 0.0 110.113 179.825 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 16.4 pt-20 -98.34 142.23 30.24 Favored 'General case' 0 N--CA 1.494 1.727 0 CA-C-O 121.615 0.722 . . . . 0.0 110.118 -179.821 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 34' ' ' VAL . . . . . . . . . . . . . 53.0 t -125.96 134.5 66.4 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.833 0 CA-C-O 121.789 0.804 . . . . 0.0 109.459 179.881 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 34.7 p -137.87 129.51 28.22 Favored 'General case' 0 N--CA 1.494 1.742 0 CA-C-O 121.726 0.774 . . . . 0.0 110.15 179.825 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 25.6 tp -127.99 139.83 52.34 Favored 'General case' 0 N--CA 1.492 1.64 0 CA-C-O 121.725 0.774 . . . . 0.0 109.574 179.656 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 37' ' ' PHE . . . . . . . . . . . . . 46.8 p90 -139.7 148.23 42.05 Favored 'General case' 0 N--CA 1.492 1.663 0 CA-C-O 121.902 0.858 . . . . 0.0 110.109 179.934 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . 155.31 128.52 1.15 Allowed Glycine 0 N--CA 1.49 2.234 0 N-CA-C 109.831 -1.308 . . . . 0.0 109.831 179.796 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 14.7 m 47.84 -146.6 0.25 Allowed 'General case' 0 N--CA 1.488 1.45 0 O-C-N 121.75 -0.853 . . . . 0.0 110.205 179.625 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 40' ' ' ASP . . . . . . . . . . . . . 56.1 p30 -86.94 -177.74 6.13 Favored 'General case' 0 N--CA 1.492 1.666 0 CA-C-O 121.606 0.717 . . . . 0.0 110.451 -178.903 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 88.8 tttt -62.66 -42.03 99.39 Favored 'General case' 0 N--CA 1.494 1.733 0 O-C-N 121.93 -0.481 . . . . 0.0 110.085 -179.091 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -49.86 -41.76 46.07 Favored 'General case' 0 N--CA 1.495 1.825 0 O-C-N 121.662 -0.648 . . . . 0.0 109.738 -178.645 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 43' ' ' HIS . . . . . . . . . . . . . 50.4 t-80 -64.01 -41.55 97.42 Favored 'General case' 0 N--CA 1.491 1.614 0 CA-C-O 121.353 0.597 . . . . 0.0 109.619 -179.809 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 49.8 mt -64.11 -40.11 95.5 Favored 'General case' 0 N--CA 1.492 1.64 0 O-C-N 121.628 -0.67 . . . . 0.0 109.627 -179.467 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 79.6 mm-40 -62.93 -39.59 95.05 Favored 'General case' 0 N--CA 1.493 1.68 0 O-C-N 121.769 -0.582 . . . . 0.0 109.474 -179.263 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . -62.34 -42.4 99.71 Favored Glycine 0 N--CA 1.492 2.383 0 N-CA-C 109.604 -1.398 . . . . 0.0 109.604 -179.646 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 55.1 mtpt -83.19 -18.24 39.99 Favored 'General case' 0 N--CA 1.491 1.594 0 O-C-N 121.661 -0.905 . . . . 0.0 109.255 -179.634 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 58.2 tp -64.13 -39.83 94.88 Favored 'General case' 0 N--CA 1.488 1.45 0 N-CA-C 108.901 -0.777 . . . . 0.0 108.901 179.719 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 49' ' ' ALA . . . . . . . . . . . . . . . -58.02 -41.2 82.65 Favored 'General case' 0 N--CA 1.494 1.758 0 N-CA-C 109.588 -0.523 . . . . 0.0 109.588 -179.018 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 79.5 mm-40 -68.92 -37.16 78.76 Favored 'General case' 0 N--CA 1.494 1.753 0 O-C-N 121.648 -0.657 . . . . 0.0 109.244 179.966 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 3.6 m-85 -61.54 -43.88 98.06 Favored 'General case' 0 N--CA 1.496 1.836 0 O-C-N 121.615 -0.678 . . . . 0.0 109.505 -179.326 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 52' ' ' ILE . . . . . . . . . . . . . 90.8 mt -64.22 -42.38 95.3 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.653 0 N-CA-C 109.0 -0.741 . . . . 0.0 109.0 -179.973 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 11.5 t -59.01 -42.69 90.73 Favored 'General case' 0 N--CA 1.489 1.523 0 N-CA-C 109.092 -0.707 . . . . 0.0 109.092 -179.017 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 54' ' ' LEU . . . . . . . . . . . . . 88.8 mt -63.15 -40.95 99.05 Favored 'General case' 0 C--N 1.301 -1.541 0 N-CA-C 109.231 -0.655 . . . . 0.0 109.231 -179.962 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -65.93 -38.86 89.75 Favored 'General case' 0 N--CA 1.494 1.758 0 O-C-N 121.939 -0.476 . . . . 0.0 110.002 -179.253 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 56' ' ' LYS . . . . . . . . . . . . . 64.7 mttm -64.81 -41.46 95.76 Favored 'General case' 0 N--CA 1.493 1.717 0 O-C-N 121.528 -0.732 . . . . 0.0 109.79 -179.821 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 87.8 mt-30 -61.66 -46.23 90.64 Favored 'General case' 0 N--CA 1.488 1.474 0 N-CA-C 109.074 -0.713 . . . . 0.0 109.074 -179.502 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 58' ' ' VAL . . . . . . . . . . . . . 76.0 t -66.41 -44.27 90.75 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.591 0 N-CA-C 109.235 -0.654 . . . . 0.0 109.235 179.794 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 59' ' ' TYR . . . . . . . . . . . . . 87.7 t80 -140.42 118.53 11.95 Favored 'General case' 0 N--CA 1.498 1.929 0 CA-C-O 121.813 0.816 . . . . 0.0 110.046 -179.844 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -70.79 149.15 47.15 Favored 'General case' 0 N--CA 1.495 1.797 0 CA-C-O 121.572 0.701 . . . . 0.0 110.895 -179.854 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 61' ' ' ASN . . . . . . . . . . . . . 50.2 t-20 61.42 42.47 11.54 Favored 'General case' 0 N--CA 1.493 1.687 0 CA-C-O 121.602 0.715 . . . . 0.0 109.089 179.671 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 62' ' ' VAL . . . . . . . . . . . . . 9.4 p -80.37 137.27 21.78 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.531 0 CA-C-O 121.636 0.731 . . . . 0.0 110.383 -179.811 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 96.6 mt-10 -111.39 146.17 37.62 Favored 'General case' 0 N--CA 1.495 1.793 0 CA-C-O 121.967 0.889 . . . . 0.0 109.932 -179.844 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 64' ' ' TYR . . . . . . . . . . . . . 55.1 p90 -151.47 161.03 43.4 Favored 'General case' 0 N--CA 1.489 1.516 0 CA-C-O 121.503 0.668 . . . . 0.0 110.023 -179.667 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 74.6 mm-40 -138.13 151.02 47.37 Favored 'General case' 0 N--CA 1.5 2.049 0 CA-C-O 121.707 0.765 . . . . 0.0 110.406 -179.481 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 66' ' ' VAL . . . . . . . . . . . . . 53.4 t -122.62 130.84 74.21 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.969 0 CA-C-O 121.923 0.868 . . . . 0.0 110.163 -179.549 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -81.41 170.28 15.88 Favored Pre-proline 0 N--CA 1.487 1.38 0 CA-C-O 121.167 0.508 . . . . 0.0 109.739 179.812 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 68' ' ' PRO . . . . . . . . . . . . . 31.5 Cg_exo -56.55 122.86 12.54 Favored 'Trans proline' 0 N--CA 1.494 1.557 0 C-N-CA 122.537 2.158 . . . . 0.0 112.601 179.922 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 69' ' ' VAL . . . . . . . . . . . . . 67.8 t -135.45 134.1 52.16 Favored 'Isoleucine or valine' 0 N--CA 1.499 1.975 0 CA-C-O 121.789 0.804 . . . . 0.0 110.379 179.903 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -71.55 151.64 43.67 Favored 'General case' 0 N--CA 1.497 1.877 0 CA-C-O 121.578 0.704 . . . . 0.0 110.583 179.934 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 98.4 m-20 -62.43 -35.93 80.81 Favored 'General case' 0 N--CA 1.493 1.722 0 N-CA-C 109.531 -0.544 . . . . 0.0 109.531 -179.537 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 72' ' ' ASN . . . . . . . . . . . . . 56.6 p30 -92.04 11.54 24.92 Favored 'General case' 0 N--CA 1.495 1.775 0 O-C-N 121.555 -0.716 . . . . 0.0 109.363 -179.288 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -66.14 144.03 56.92 Favored 'General case' 0 N--CA 1.493 1.723 0 O-C-N 121.496 -0.752 . . . . 0.0 109.736 179.833 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 74' ' ' THR . . . . . . . . . . . . . 3.8 m -99.18 -3.54 34.17 Favored 'General case' 0 N--CA 1.493 1.681 0 N-CA-C 108.697 -0.853 . . . . 0.0 108.697 -179.873 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 84.0 tt0 -135.88 150.49 49.38 Favored 'General case' 0 N--CA 1.492 1.656 0 CA-C-O 121.792 0.806 . . . . 0.0 109.522 179.977 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 4.7 tt -131.21 128.29 39.66 Favored 'General case' 0 N--CA 1.489 1.52 0 CA-C-O 121.806 0.812 . . . . 0.0 109.841 -179.725 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 77' ' ' HIS . . . . . . . . . . . . . 80.5 m80 -96.92 131.41 43.72 Favored 'General case' 0 N--CA 1.493 1.686 0 CA-C-O 121.857 0.836 . . . . 0.0 109.435 -179.805 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -147.64 155.78 42.12 Favored 'General case' 0 N--CA 1.49 1.551 0 CA-C-O 121.716 0.77 . . . . 0.0 109.995 -179.85 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 95.2 mtt180 -128.54 137.66 51.86 Favored 'General case' 0 N--CA 1.496 1.849 0 CA-C-O 121.794 0.807 . . . . 0.0 109.728 -179.881 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 80' ' ' PHE . . . . . . . . . . . . . 30.0 m-85 -129.44 147.78 51.29 Favored 'General case' 0 N--CA 1.495 1.809 0 CA-C-O 121.723 0.773 . . . . 0.0 109.629 179.885 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -124.96 146.24 49.48 Favored 'General case' 0 N--CA 1.495 1.813 0 CA-C-O 121.622 0.725 . . . . 0.0 109.774 179.902 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 82' ' ' PHE . . . . . . . . . . . . . 97.7 m-85 -132.67 -97.6 0.3 Allowed 'General case' 0 N--CA 1.496 1.873 0 CA-C-O 121.351 0.596 . . . . 0.0 109.701 -179.869 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 6.1 pt-20 -177.32 -28.87 0.01 OUTLIER 'General case' 0 N--CA 1.494 1.757 0 O-C-N 121.341 -0.85 . . . . 0.0 108.812 -179.82 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 84' ' ' VAL . . . . . . . . . . . . . 33.7 m -134.27 160.11 41.79 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.903 0 CA-C-O 121.814 0.816 . . . . 0.0 110.208 -179.918 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 35.6 m -79.61 -18.06 52.43 Favored 'General case' 0 N--CA 1.493 1.706 0 CA-C-O 121.348 0.595 . . . . 0.0 109.679 -179.711 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 86' ' ' ALA . . . . . . . . . . . . . . . -63.27 -42.93 99.19 Favored 'General case' 0 N--CA 1.493 1.712 0 O-C-N 121.519 -0.738 . . . . 0.0 109.515 -179.337 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 92.5 mt-10 -67.31 -29.64 69.27 Favored 'General case' 0 N--CA 1.493 1.708 0 O-C-N 121.523 -0.736 . . . . 0.0 109.471 -179.701 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 88' ' ' LYS . . . . . 0.588 ' HZ1' ' CB ' ' A' ' 32' ' ' ALA . 64.6 tttp -63.22 -46.06 88.74 Favored 'General case' 0 N--CA 1.489 1.498 0 O-C-N 121.681 -0.637 . . . . 0.0 109.531 -179.413 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 96.6 mt -64.14 -48.87 74.36 Favored 'General case' 0 N--CA 1.491 1.606 0 O-C-N 121.685 -0.634 . . . . 0.0 110.095 -178.965 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 90' ' ' ILE . . . . . 0.514 ' CD1' ' N ' ' A' ' 90' ' ' ILE . 1.3 mp -68.68 -44.21 82.6 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.612 0 O-C-N 121.766 -0.584 . . . . 0.0 109.735 179.904 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 91' ' ' PHE . . . . . . . . . . . . . 85.7 t80 -61.81 -44.73 96.28 Favored 'General case' 0 C--N 1.301 -1.542 0 N-CA-C 108.723 -0.843 . . . . 0.0 108.723 -178.972 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 92' ' ' GLU . . . . . . . . . . . . . 50.8 tp10 -63.16 -37.52 87.54 Favored 'General case' 0 C--N 1.302 -1.463 0 N-CA-C 109.28 -0.637 . . . . 0.0 109.28 -179.628 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 93' ' ' LEU . . . . . . . . . . . . . 6.3 tt -63.27 -46.6 86.06 Favored 'General case' 0 N--CA 1.489 1.511 0 CA-C-O 121.426 0.631 . . . . 0.0 109.677 -179.43 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 94' ' ' LYS . . . . . . . . . . . . . 67.8 mttm -66.5 -44.84 81.46 Favored 'General case' 0 N--CA 1.491 1.589 0 O-C-N 121.792 -0.568 . . . . 0.0 110.262 -179.408 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 22.3 p -69.13 -41.77 76.91 Favored 'General case' 0 N--CA 1.494 1.765 0 O-C-N 121.518 -0.738 . . . . 0.0 109.847 -179.188 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 96' ' ' ARG . . . . . . . . . . . . . 64.0 ttm-85 -68.23 -42.3 79.97 Favored 'General case' 0 N--CA 1.491 1.623 0 O-C-N 121.536 -0.727 . . . . 0.0 109.042 -179.818 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 97' ' ' ALA . . . . . . . . . . . . . . . -63.7 -41.42 98.13 Favored 'General case' 0 N--CA 1.49 1.526 0 N-CA-C 109.217 -0.661 . . . . 0.0 109.217 -179.499 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 98' ' ' LEU . . . . . . . . . . . . . 3.1 tt -63.66 -40.66 97.39 Favored 'General case' 0 C--N 1.303 -1.452 0 CA-C-O 121.672 0.748 . . . . 0.0 109.026 -179.568 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 99' ' ' ALA . . . . . . . . . . . . . . . -61.44 -35.72 78.37 Favored 'General case' 0 C--N 1.301 -1.533 0 O-C-N 121.501 -0.749 . . . . 0.0 109.348 -179.1 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 100' ' ' ARG . . . . . . . . . . . . . 27.1 mmt180 -61.42 -44.94 96.26 Favored 'General case' 0 N--CA 1.492 1.675 0 O-C-N 121.748 -0.595 . . . . 0.0 110.416 -179.164 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 101' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -102.36 123.93 47.03 Favored 'General case' 0 N--CA 1.497 1.916 0 CA-C-O 121.729 0.776 . . . . 0.0 109.633 -179.728 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 102' ' ' GLU . . . . . 0.542 ' CD ' ' H ' ' A' ' 102' ' ' GLU . 0.8 OUTLIER -93.99 118.9 32.15 Favored 'General case' 0 N--CA 1.495 1.793 0 CA-C-O 121.952 0.882 . . . . 0.0 110.189 -179.986 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 103' ' ' HIS . . . . . . . . . . . . . 52.1 m170 -67.41 -39.45 85.52 Favored 'General case' 0 N--CA 1.488 1.466 0 N-CA-C 109.002 -0.74 . . . . 0.0 109.002 179.446 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 104' ' ' HIS . . . . . . . . . . . . . 77.6 m80 -78.3 154.0 31.28 Favored 'General case' 0 N--CA 1.492 1.649 0 CA-C-O 121.753 0.787 . . . . 0.0 110.346 -179.501 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 105' ' ' HIS . . . . . . . . . . . . . 78.4 m80 45.59 48.69 11.19 Favored 'General case' 0 N--CA 1.49 1.564 0 CA-C-O 121.626 0.727 . . . . 0.0 109.388 -179.747 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 106' ' ' HIS . . . . . . . . . . . . . 84.6 t60 -63.9 -41.68 97.63 Favored 'General case' 0 N--CA 1.489 1.479 0 N-CA-C 109.3 -0.63 . . . . 0.0 109.3 179.703 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 107' ' ' HIS . . . . . . . . . . . . . 84.2 t60 -64.34 -44.79 90.38 Favored 'General case' 0 N--CA 1.492 1.625 0 O-C-N 121.634 -0.666 . . . . 0.0 109.843 -179.44 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 108' ' ' HIS . . . . . . . . . . . . . 85.3 t60 . . . . . 0 N--CA 1.494 1.744 0 CA-C-O 117.7 -1.143 . . . . 0.0 109.8 -179.487 . . . . . . . . 0 0 . 1 . 012 nuclear orig full ' A' A ' 1' ' ' MET . . . . . 0.483 ' N ' ' SD ' ' A' ' 1' ' ' MET . 4.3 mpp? . . . . . 0 N--CA 1.492 1.626 0 CA-C-O 121.792 0.806 . . . . 0.0 109.196 . . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 42.8 t -68.16 145.17 54.6 Favored 'General case' 0 N--CA 1.491 1.592 0 CA-C-O 121.682 0.754 . . . . 0.0 110.466 -179.251 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 3' ' ' ASN . . . . . . . . . . . . . 51.8 p30 -92.83 169.08 10.74 Favored 'General case' 0 N--CA 1.49 1.543 0 CA-C-O 121.8 0.809 . . . . 0.0 110.401 -179.767 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 99.4 mt-30 45.57 -168.36 0.01 OUTLIER 'General case' 0 N--CA 1.49 1.548 0 CA-C-O 121.904 0.859 . . . . 0.0 110.749 179.93 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 5' ' ' THR . . . . . 0.45 ' CG2' ' H ' ' A' ' 6' ' ' CYS . 3.5 m 62.35 -129.91 0.61 Allowed 'General case' 0 N--CA 1.489 1.507 0 CA-C-O 121.631 0.729 . . . . 0.0 110.965 179.802 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 6' ' ' CYS . . . . . 0.45 ' H ' ' CG2' ' A' ' 5' ' ' THR . 1.0 OUTLIER -60.42 -28.08 67.98 Favored 'General case' 0 N--CA 1.485 1.283 0 O-C-N 121.631 -0.668 . . . . 0.0 109.444 -179.501 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 7' ' ' VAL . . . . . . . . . . . . . 57.3 t -99.88 130.71 48.58 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.733 0 O-C-N 121.442 -0.787 . . . . 0.0 110.012 -179.354 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 84.1 tt0 -173.33 -44.66 0.01 OUTLIER 'General case' 0 N--CA 1.49 1.561 0 N-CA-C 109.151 -0.685 . . . . 0.0 109.151 179.427 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 63.8 t30 -79.91 -9.98 59.73 Favored 'General case' 0 N--CA 1.497 1.878 0 O-C-N 121.173 -0.954 . . . . 0.0 109.447 179.743 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 10' ' ' GLU . . . . . 0.539 ' OE1' ' N ' ' A' ' 10' ' ' GLU . 57.5 mp0 -87.2 151.23 23.35 Favored 'General case' 0 N--CA 1.494 1.738 0 O-C-N 121.329 -0.857 . . . . 0.0 110.079 -179.448 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 46.1 t -110.98 130.64 64.04 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.748 0 CA-C-O 121.97 0.89 . . . . 0.0 110.143 -179.105 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 12' ' ' CYS . . . . . 0.418 ' O ' ' C ' ' A' ' 13' ' ' GLU . 7.4 t -73.54 -74.75 0.17 Allowed 'General case' 0 N--CA 1.49 1.531 0 CA-C-N 115.954 -0.566 . . . . 0.0 110.319 -179.669 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 13' ' ' GLU . . . . . 0.418 ' C ' ' O ' ' A' ' 12' ' ' CYS . 95.7 mt-10 38.64 70.78 0.19 Allowed 'General case' 0 N--CA 1.496 1.874 0 CA-C-O 121.602 0.715 . . . . 0.0 109.899 -179.373 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -63.03 140.55 58.88 Favored 'General case' 0 N--CA 1.488 1.474 0 CA-C-O 121.716 0.769 . . . . 0.0 110.024 -179.264 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 96.9 m -100.0 147.19 25.86 Favored 'General case' 0 N--CA 1.491 1.612 0 CA-C-O 121.8 0.81 . . . . 0.0 110.085 -179.567 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . -89.09 -72.89 1.28 Allowed Glycine 0 N--CA 1.489 2.232 0 N-CA-C 110.09 -1.204 . . . . 0.0 110.09 -179.84 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 17' ' ' CYS . . . . . 0.523 ' C ' ' H ' ' A' ' 19' ' ' GLY . 96.7 m -64.63 -35.9 82.52 Favored 'General case' 0 N--CA 1.493 1.717 0 O-C-N 121.495 -1.003 . . . . 0.0 109.452 -179.837 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . 47.95 12.16 0.03 OUTLIER 'General case' 0 N--CA 1.492 1.673 0 O-C-N 121.588 -0.695 . . . . 0.0 109.738 -179.846 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 19' ' ' GLY . . . . . 0.523 ' H ' ' C ' ' A' ' 17' ' ' CYS . . . -85.28 2.53 88.1 Favored Glycine 0 N--CA 1.493 2.435 0 N-CA-C 109.2 -1.56 . . . . 0.0 109.2 179.535 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 7.1 pt-20 -43.62 95.05 0.01 OUTLIER 'General case' 0 N--CA 1.494 1.762 0 O-C-N 121.676 -0.896 . . . . 0.0 110.017 -179.702 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 21' ' ' ILE . . . . . 0.474 ' N ' ' O ' ' A' ' 19' ' ' GLY . 19.5 tt -89.8 129.72 40.26 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.583 0 CA-C-O 121.704 0.764 . . . . 0.0 110.142 -179.619 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 172.4 107.4 0.2 Allowed Glycine 0 N--CA 1.49 2.252 0 N-CA-C 109.448 -1.461 . . . . 0.0 109.448 179.664 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 23' ' ' PHE . . . . . . . . . . . . . 68.2 t80 -101.52 122.1 43.19 Favored 'General case' 0 N--CA 1.495 1.804 0 O-C-N 121.562 -0.963 . . . . 0.0 109.16 -179.913 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 3.5 pt -83.82 147.79 5.49 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.559 0 CA-C-O 121.948 0.88 . . . . 0.0 110.729 -179.311 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 25' ' ' ILE . . . . . 0.416 ' O ' ' O ' ' A' ' 26' ' ' ARG . 96.3 mt 53.39 101.67 0.02 OUTLIER 'Isoleucine or valine' 0 N--CA 1.486 1.358 0 CA-C-O 121.815 0.817 . . . . 0.0 109.785 179.864 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 26' ' ' ARG . . . . . 0.484 ' CG ' ' H ' ' A' ' 27' ' ' GLU . 11.3 tpt180 -60.21 -137.06 0.0 OUTLIER 'General case' 0 N--CA 1.491 1.6 0 CA-C-O 121.689 0.757 . . . . 0.0 110.83 -179.2 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 27' ' ' GLU . . . . . 0.484 ' H ' ' CG ' ' A' ' 26' ' ' ARG . 37.9 tp10 -132.92 58.73 1.76 Allowed 'General case' 0 N--CA 1.493 1.692 0 CA-C-O 121.649 0.738 . . . . 0.0 109.345 -179.819 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . -66.43 169.29 33.25 Favored Glycine 0 N--CA 1.492 2.376 0 N-CA-C 110.585 -1.006 . . . . 0.0 110.585 -179.857 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 29' ' ' ASP . . . . . 0.407 ' N ' ' OD1' ' A' ' 29' ' ' ASP . 37.4 p-10 -79.54 -2.63 43.19 Favored 'General case' 0 N--CA 1.489 1.515 0 O-C-N 121.72 -0.87 . . . . 0.0 109.496 179.868 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 62.3 t0 -94.36 25.96 3.61 Favored 'General case' 0 N--CA 1.492 1.662 0 N-CA-C 108.674 -0.861 . . . . 0.0 108.674 -179.95 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 4.2 p -129.25 153.98 39.45 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.804 0 CA-C-O 121.349 0.595 . . . . 0.0 109.851 -179.58 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -133.18 148.12 52.06 Favored 'General case' 0 N--CA 1.493 1.71 0 CA-C-O 121.661 0.744 . . . . 0.0 109.575 -179.953 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 33' ' ' GLU . . . . . 0.426 ' O ' ' NZ ' ' A' ' 88' ' ' LYS . 98.2 mt-10 -92.17 148.06 22.45 Favored 'General case' 0 N--CA 1.49 1.557 0 CA-C-O 121.559 0.695 . . . . 0.0 110.084 -179.877 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 34' ' ' VAL . . . . . . . . . . . . . 51.6 t -127.01 132.64 69.73 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.671 0 CA-C-O 121.556 0.693 . . . . 0.0 109.385 -179.962 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 70.7 m -125.48 122.75 37.53 Favored 'General case' 0 N--CA 1.492 1.65 0 N-CA-C 109.342 -0.614 . . . . 0.0 109.342 179.918 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 39.8 tp -120.85 133.07 55.31 Favored 'General case' 0 N--CA 1.496 1.841 0 CA-C-O 121.602 0.715 . . . . 0.0 109.336 179.741 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 37' ' ' PHE . . . . . . . . . . . . . 83.4 m-85 -93.94 147.79 22.77 Favored 'General case' 0 N--CA 1.49 1.557 0 CA-C-O 121.646 0.736 . . . . 0.0 110.083 -179.526 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . 179.96 -179.29 48.81 Favored Glycine 0 N--CA 1.487 2.045 0 N-CA-C 110.05 -1.22 . . . . 0.0 110.05 179.877 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 39' ' ' SER . . . . . 0.629 ' HG ' ' H ' ' A' ' 40' ' ' ASP . 13.3 p -82.7 -102.85 0.04 OUTLIER 'General case' 0 N--CA 1.49 1.54 0 O-C-N 121.692 -0.887 . . . . 0.0 110.325 -179.715 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 40' ' ' ASP . . . . . 0.629 ' H ' ' HG ' ' A' ' 39' ' ' SER . 52.4 p-10 -83.8 174.97 9.98 Favored 'General case' 0 N--CA 1.492 1.629 0 O-C-N 121.371 -0.83 . . . . 0.0 110.777 -179.037 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 37.5 ttmt -62.95 -39.91 96.06 Favored 'General case' 0 N--CA 1.49 1.54 0 O-C-N 121.712 -0.617 . . . . 0.0 110.63 -179.353 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -56.17 -43.32 78.26 Favored 'General case' 0 N--CA 1.495 1.815 0 O-C-N 121.223 -0.923 . . . . 0.0 109.893 -179.166 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 43' ' ' HIS . . . . . . . . . . . . . 83.2 t60 -66.9 -43.11 84.27 Favored 'General case' 0 N--CA 1.494 1.773 0 O-C-N 121.408 -0.808 . . . . 0.0 109.878 -179.853 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 47.5 mt -63.86 -40.58 96.9 Favored 'General case' 0 N--CA 1.494 1.774 0 O-C-N 121.302 -0.874 . . . . 0.0 109.939 -179.642 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 97.1 mt-10 -65.09 -36.12 83.29 Favored 'General case' 0 N--CA 1.494 1.765 0 O-C-N 121.315 -0.865 . . . . 0.0 109.662 -179.708 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . -61.02 -42.47 99.81 Favored Glycine 0 N--CA 1.492 2.395 0 N-CA-C 109.407 -1.477 . . . . 0.0 109.407 179.993 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 97.4 mttt -83.19 -17.11 44.0 Favored 'General case' 0 N--CA 1.492 1.633 0 O-C-N 121.533 -0.98 . . . . 0.0 109.308 179.548 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 51.5 tp -65.18 -39.44 92.91 Favored 'General case' 0 N--CA 1.491 1.611 0 O-C-N 121.536 -0.728 . . . . 0.0 109.697 179.954 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 49' ' ' ALA . . . . . . . . . . . . . . . -54.25 -28.59 42.52 Favored 'General case' 0 N--CA 1.491 1.618 0 O-C-N 121.591 -0.693 . . . . 0.0 109.571 -179.131 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 80.5 mm-40 -66.72 -42.75 85.83 Favored 'General case' 0 N--CA 1.492 1.638 0 O-C-N 121.384 -0.822 . . . . 0.0 109.335 179.78 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 32.0 m-85 -61.2 -44.62 96.99 Favored 'General case' 0 N--CA 1.495 1.811 0 O-C-N 121.551 -0.718 . . . . 0.0 109.891 -179.969 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 52' ' ' ILE . . . . . 0.472 ' CG2' ' HZ2' ' A' ' 56' ' ' LYS . 96.6 mt -65.28 -43.75 95.09 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.59 0 O-C-N 121.676 -0.64 . . . . 0.0 110.58 -179.208 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 5.2 t -61.06 -51.62 68.39 Favored 'General case' 0 N--CA 1.494 1.741 0 O-C-N 121.271 -0.893 . . . . 0.0 110.316 -179.037 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 54' ' ' LEU . . . . . . . . . . . . . 4.0 mm? -66.0 -38.07 87.53 Favored 'General case' 0 N--CA 1.492 1.657 0 O-C-N 121.525 -0.734 . . . . 0.0 109.886 179.716 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -55.39 -48.12 74.82 Favored 'General case' 0 N--CA 1.49 1.572 0 O-C-N 121.513 -0.742 . . . . 0.0 110.332 -179.029 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 56' ' ' LYS . . . . . 0.472 ' HZ2' ' CG2' ' A' ' 52' ' ' ILE . 61.4 mttp -65.65 -42.68 91.12 Favored 'General case' 0 N--CA 1.493 1.683 0 O-C-N 121.299 -0.876 . . . . 0.0 110.121 -179.921 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 27.4 mt-30 -65.62 -45.69 82.14 Favored 'General case' 0 N--CA 1.493 1.7 0 O-C-N 121.402 -0.811 . . . . 0.0 109.488 -179.656 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 58' ' ' VAL . . . . . . . . . . . . . 71.7 t -65.15 -45.86 92.76 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.478 0 O-C-N 121.589 -0.695 . . . . 0.0 109.343 179.783 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 59' ' ' TYR . . . . . . . . . . . . . 52.4 t80 -132.33 119.52 20.85 Favored 'General case' 0 N--CA 1.496 1.853 0 CA-C-O 121.616 0.722 . . . . 0.0 109.108 -179.979 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -70.51 144.39 51.36 Favored 'General case' 0 N--CA 1.491 1.592 0 CA-C-O 121.813 0.816 . . . . 0.0 110.913 -179.236 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 61' ' ' ASN . . . . . . . . . . . . . 40.3 t-20 57.79 41.81 24.4 Favored 'General case' 0 N--CA 1.492 1.63 0 CA-C-O 121.851 0.834 . . . . 0.0 109.349 179.926 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 62' ' ' VAL . . . . . . . . . . . . . 8.2 p -74.09 138.84 20.35 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.48 0 CA-C-O 121.631 0.729 . . . . 0.0 110.452 -179.776 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 71.7 mm-40 -112.64 137.59 50.68 Favored 'General case' 0 N--CA 1.494 1.751 0 CA-C-O 121.609 0.719 . . . . 0.0 109.402 179.968 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 64' ' ' TYR . . . . . . . . . . . . . 50.9 p90 -149.64 161.08 42.88 Favored 'General case' 0 N--CA 1.489 1.493 0 CA-C-O 121.721 0.772 . . . . 0.0 110.337 -179.585 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 50.8 tp10 -142.4 148.72 38.29 Favored 'General case' 0 N--CA 1.49 1.573 0 N-CA-C 108.997 -0.742 . . . . 0.0 108.997 179.782 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 66' ' ' VAL . . . . . . . . . . . . . 54.9 t -111.62 130.87 64.41 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.791 0 CA-C-O 121.79 0.805 . . . . 0.0 109.839 -179.59 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -82.18 158.91 66.22 Favored Pre-proline 0 N--CA 1.488 1.425 0 N-CA-C 109.605 -0.517 . . . . 0.0 109.605 -179.759 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 68' ' ' PRO . . . . . . . . . . . . . 48.6 Cg_exo -51.26 128.8 26.58 Favored 'Trans proline' 0 N--CA 1.493 1.45 0 C-N-CA 122.233 1.955 . . . . 0.0 112.178 179.039 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 69' ' ' VAL . . . . . . . . . . . . . 54.0 t -131.27 135.31 59.83 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.754 0 CA-C-O 121.649 0.738 . . . . 0.0 110.02 -179.827 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -69.71 152.47 44.62 Favored 'General case' 0 C--N 1.303 -1.451 0 CA-C-O 121.75 0.786 . . . . 0.0 110.006 179.554 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 12.9 m-20 -64.27 -34.49 78.24 Favored 'General case' 0 N--CA 1.491 1.586 0 O-C-N 121.629 -0.67 . . . . 0.0 109.424 179.886 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 72' ' ' ASN . . . . . . . . . . . . . 57.1 p30 -94.8 16.32 16.18 Favored 'General case' 0 N--CA 1.493 1.704 0 O-C-N 121.348 -0.845 . . . . 0.0 109.435 -179.445 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 73' ' ' ALA . . . . . 0.43 ' O ' ' O ' ' A' ' 39' ' ' SER . . . -66.6 144.95 56.11 Favored 'General case' 0 N--CA 1.491 1.594 0 O-C-N 121.525 -0.734 . . . . 0.0 110.059 179.964 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 74' ' ' THR . . . . . . . . . . . . . 61.4 p -101.13 -0.96 35.2 Favored 'General case' 0 N--CA 1.493 1.688 0 O-C-N 121.551 -0.718 . . . . 0.0 109.299 179.857 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 95.3 mt-10 -139.58 160.05 40.76 Favored 'General case' 0 N--CA 1.496 1.856 0 O-C-N 121.256 -0.903 . . . . 0.0 109.835 -179.856 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 6.5 tp -123.8 131.15 53.53 Favored 'General case' 0 N--CA 1.491 1.617 0 CA-C-O 121.524 0.678 . . . . 0.0 109.37 -179.95 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 77' ' ' HIS . . . . . . . . . . . . . 97.2 m-70 -106.35 126.77 52.65 Favored 'General case' 0 N--CA 1.493 1.681 0 CA-C-O 121.541 0.686 . . . . 0.0 109.689 -179.767 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -149.4 159.75 44.03 Favored 'General case' 0 N--CA 1.49 1.529 0 CA-C-O 121.507 0.67 . . . . 0.0 109.848 -179.763 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 86.4 mtm-85 -127.47 142.37 51.42 Favored 'General case' 0 N--CA 1.495 1.8 0 CA-C-O 121.508 0.671 . . . . 0.0 109.433 -179.847 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 80' ' ' PHE . . . . . . . . . . . . . 44.1 m-85 -127.87 149.47 50.28 Favored 'General case' 0 N--CA 1.498 1.931 0 CA-C-O 121.401 0.619 . . . . 0.0 109.741 -179.482 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 82.8 tttt -111.73 133.36 54.01 Favored 'General case' 0 N--CA 1.493 1.698 0 CA-C-O 121.554 0.692 . . . . 0.0 109.685 -179.861 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 82' ' ' PHE . . . . . . . . . . . . . 71.8 m-85 -137.54 -128.53 0.13 Allowed 'General case' 0 N--CA 1.494 1.73 0 CA-C-O 121.442 0.639 . . . . 0.0 109.711 -179.665 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 81.3 tt0 -149.8 -34.14 0.18 Allowed 'General case' 0 N--CA 1.489 1.489 0 O-C-N 121.519 -0.738 . . . . 0.0 109.132 -179.765 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 84' ' ' VAL . . . . . . . . . . . . . 34.8 m -135.08 158.28 41.05 Favored 'Isoleucine or valine' 0 N--CA 1.499 1.98 0 O-C-N 121.31 -0.869 . . . . 0.0 110.348 -179.971 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 82.8 p -74.07 -16.77 61.02 Favored 'General case' 0 N--CA 1.491 1.582 0 CA-C-O 121.327 0.584 . . . . 0.0 109.823 -179.952 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 86' ' ' ALA . . . . . . . . . . . . . . . -63.89 -38.2 90.22 Favored 'General case' 0 N--CA 1.492 1.667 0 O-C-N 121.367 -0.833 . . . . 0.0 109.457 -179.761 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 94.4 mt-10 -68.08 -35.05 77.56 Favored 'General case' 0 N--CA 1.491 1.624 0 O-C-N 121.499 -0.75 . . . . 0.0 109.302 179.683 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 88' ' ' LYS . . . . . 0.426 ' NZ ' ' O ' ' A' ' 33' ' ' GLU . 49.1 tptt -61.95 -44.48 96.67 Favored 'General case' 0 C--N 1.302 -1.491 0 O-C-N 121.436 -0.79 . . . . 0.0 109.211 179.82 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 42.5 tp -62.07 -50.16 73.08 Favored 'General case' 0 C--N 1.303 -1.431 0 O-C-N 121.651 -0.655 . . . . 0.0 109.817 -179.029 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 90' ' ' ILE . . . . . . . . . . . . . 96.6 mt -66.66 -43.03 90.5 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.773 0 O-C-N 121.529 -0.732 . . . . 0.0 109.878 179.929 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 91' ' ' PHE . . . . . . . . . . . . . 71.1 t80 -59.35 -46.09 89.59 Favored 'General case' 0 N--CA 1.493 1.679 0 O-C-N 121.468 -0.77 . . . . 0.0 109.649 -179.186 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 92' ' ' GLU . . . . . . . . . . . . . 9.5 tm-20 -66.98 -41.18 87.22 Favored 'General case' 0 N--CA 1.49 1.536 0 CA-C-O 121.691 0.758 . . . . 0.0 109.191 179.881 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 93' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -63.87 -47.71 79.61 Favored 'General case' 0 C--N 1.303 -1.437 0 CA-C-O 121.932 0.873 . . . . 0.0 109.651 -179.226 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 94' ' ' LYS . . . . . . . . . . . . . 54.9 mtpt -65.04 -43.52 92.05 Favored 'General case' 0 C--N 1.3 -1.567 0 O-C-N 121.411 -0.806 . . . . 0.0 109.786 -179.252 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 40.9 p -69.06 -35.56 76.69 Favored 'General case' 0 N--CA 1.491 1.6 0 O-C-N 121.608 -0.683 . . . . 0.0 109.847 -179.867 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 96' ' ' ARG . . . . . 0.475 ' NE ' HH21 ' A' ' 100' ' ' ARG . 74.1 ttt180 -64.63 -42.9 95.16 Favored 'General case' 0 N--CA 1.491 1.587 0 O-C-N 121.487 -0.758 . . . . 0.0 109.267 179.798 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 97' ' ' ALA . . . . . . . . . . . . . . . -62.24 -40.54 96.5 Favored 'General case' 0 N--CA 1.493 1.704 0 CA-C-O 121.477 0.656 . . . . 0.0 109.482 -179.946 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 98' ' ' LEU . . . . . . . . . . . . . 93.6 mt -64.26 -40.7 96.51 Favored 'General case' 0 N--CA 1.492 1.636 0 O-C-N 121.583 -0.698 . . . . 0.0 109.449 179.745 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 99' ' ' ALA . . . . . . . . . . . . . . . -83.03 -6.4 59.48 Favored 'General case' 0 N--CA 1.49 1.528 0 N-CA-C 109.19 -0.67 . . . . 0.0 109.19 179.901 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 100' ' ' ARG . . . . . 0.475 HH21 ' NE ' ' A' ' 96' ' ' ARG . 44.5 ttm180 -85.71 -15.91 40.7 Favored 'General case' 0 N--CA 1.493 1.721 0 O-C-N 121.521 -0.737 . . . . 0.0 109.022 179.71 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 101' ' ' LEU . . . . . 0.522 ' CD2' ' N ' ' A' ' 101' ' ' LEU . 3.7 mm? 59.52 121.41 0.01 OUTLIER 'General case' 0 N--CA 1.493 1.705 0 CA-C-O 121.948 0.88 . . . . 0.0 110.163 -179.701 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 102' ' ' GLU . . . . . . . . . . . . . 12.2 pt-20 -60.18 133.07 55.75 Favored 'General case' 0 N--CA 1.488 1.427 0 CA-C-O 121.546 0.689 . . . . 0.0 109.979 -179.602 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 103' ' ' HIS . . . . . . . . . . . . . 52.5 t-80 -95.3 -75.44 0.52 Allowed 'General case' 0 N--CA 1.494 1.774 0 CA-C-O 121.7 0.762 . . . . 0.0 109.437 -179.97 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 104' ' ' HIS . . . . . 0.723 ' CG ' ' H ' ' A' ' 105' ' ' HIS . 43.7 t60 42.04 -152.82 0.02 OUTLIER 'General case' 0 N--CA 1.494 1.731 0 CA-C-O 121.573 0.702 . . . . 0.0 110.404 179.994 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 105' ' ' HIS . . . . . 0.723 ' H ' ' CG ' ' A' ' 104' ' ' HIS . 1.3 p80 -150.32 165.15 33.91 Favored 'General case' 0 N--CA 1.487 1.4 0 O-C-N 121.471 -0.768 . . . . 0.0 109.579 -179.583 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 106' ' ' HIS . . . . . . . . . . . . . 80.3 t60 -75.86 131.35 39.64 Favored 'General case' 0 N--CA 1.489 1.495 0 CA-C-O 121.711 0.767 . . . . 0.0 110.484 -179.252 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 107' ' ' HIS . . . . . . . . . . . . . 45.9 p-80 -150.63 162.35 40.83 Favored 'General case' 0 N--CA 1.489 1.524 0 CA-C-O 121.536 0.684 . . . . 0.0 109.874 179.652 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 108' ' ' HIS . . . . . . . . . . . . . 42.7 p-80 . . . . . 0 N--CA 1.491 1.613 0 CA-C-O 118.004 -0.998 . . . . 0.0 109.156 179.883 . . . . . . . . 0 0 . 1 . 013 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 63.8 ttp . . . . . 0 N--CA 1.493 1.698 0 CA-C-O 121.428 0.632 . . . . 0.0 109.538 . . . . . . . . . 0 0 . 1 . 013 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 79.4 p -63.79 -33.19 75.12 Favored 'General case' 0 N--CA 1.494 1.728 0 O-C-N 121.556 -0.715 . . . . 0.0 109.67 -179.907 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 3' ' ' ASN . . . . . . . . . . . . . 98.9 m-20 -64.34 -39.76 94.55 Favored 'General case' 0 N--CA 1.493 1.705 0 O-C-N 121.455 -0.778 . . . . 0.0 109.47 179.895 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 85.9 mt-30 -81.48 119.74 24.12 Favored 'General case' 0 N--CA 1.489 1.52 0 O-C-N 121.358 -0.839 . . . . 0.0 109.736 -179.74 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 71.9 p -101.8 -10.58 19.78 Favored 'General case' 0 N--CA 1.493 1.677 0 N-CA-C 108.867 -0.79 . . . . 0.0 108.867 179.624 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 1.9 t -90.98 5.71 47.68 Favored 'General case' 0 N--CA 1.498 1.945 0 O-C-N 121.451 -0.781 . . . . 0.0 109.495 179.7 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 7' ' ' VAL . . . . . . . . . . . . . 12.9 p -67.46 136.52 26.47 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.735 0 O-C-N 121.305 -0.872 . . . . 0.0 110.489 -179.222 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 19.5 pt-20 -150.86 -159.21 1.0 Allowed 'General case' 0 N--CA 1.489 1.478 0 CA-C-O 121.443 0.64 . . . . 0.0 109.421 179.683 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 97.7 m-20 -73.1 -119.64 0.0 OUTLIER 'General case' 0 N--CA 1.491 1.614 0 CA-C-O 121.889 0.852 . . . . 0.0 110.246 -179.47 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 81.5 tt0 45.71 82.42 0.03 OUTLIER 'General case' 0 N--CA 1.489 1.493 0 O-C-N 121.537 -0.727 . . . . 0.0 109.651 -179.516 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 54.9 t -118.63 132.25 69.04 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.959 0 CA-C-O 121.777 0.798 . . . . 0.0 109.987 -179.514 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 12' ' ' CYS . . . . . 0.429 ' O ' ' N ' ' A' ' 14' ' ' ALA . 69.2 m 47.84 22.47 0.36 Allowed 'General case' 0 N--CA 1.492 1.655 0 CA-C-O 121.646 0.736 . . . . 0.0 109.786 179.974 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 79.6 mm-40 53.88 -90.42 0.02 OUTLIER 'General case' 0 N--CA 1.493 1.688 0 CA-C-O 121.591 0.71 . . . . 0.0 110.17 179.498 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 14' ' ' ALA . . . . . 0.429 ' N ' ' O ' ' A' ' 12' ' ' CYS . . . 49.85 82.39 0.05 Allowed 'General case' 0 N--CA 1.494 1.751 0 CA-C-O 121.867 0.841 . . . . 0.0 109.685 -179.508 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 54.2 m -93.46 141.99 27.84 Favored 'General case' 0 N--CA 1.494 1.734 0 CA-C-O 121.789 0.804 . . . . 0.0 110.253 -179.599 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . -83.28 37.63 2.74 Favored Glycine 0 N--CA 1.492 2.379 0 N-CA-C 109.62 -1.392 . . . . 0.0 109.62 179.656 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -61.74 -37.43 84.23 Favored 'General case' 0 N--CA 1.491 1.596 0 O-C-N 121.321 -1.105 . . . . 0.0 109.194 179.761 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -63.9 140.81 58.91 Favored 'General case' 0 N--CA 1.491 1.595 0 CA-C-O 121.88 0.848 . . . . 0.0 110.291 -178.977 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 19' ' ' GLY . . . . . 0.427 ' C ' ' N ' ' A' ' 21' ' ' ILE . . . -91.24 -6.01 66.96 Favored Glycine 0 N--CA 1.493 2.442 0 N-CA-C 109.464 -1.454 . . . . 0.0 109.464 179.754 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 20' ' ' GLU . . . . . 0.452 ' O ' ' O ' ' A' ' 21' ' ' ILE . 22.0 tp10 47.66 20.65 0.21 Allowed 'General case' 0 N--CA 1.493 1.699 0 O-C-N 121.483 -1.01 . . . . 0.0 109.238 -179.785 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 21' ' ' ILE . . . . . 0.452 ' O ' ' O ' ' A' ' 20' ' ' GLU . 93.7 mt 58.31 139.8 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.492 1.669 0 CA-C-O 122.023 0.916 . . . . 0.0 110.263 179.388 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . -72.78 -174.04 25.03 Favored Glycine 0 N--CA 1.487 2.055 0 N-CA-C 110.826 -0.91 . . . . 0.0 110.826 -179.354 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 23' ' ' PHE . . . . . . . . . . . . . 91.7 m-85 -86.32 131.21 34.27 Favored 'General case' 0 N--CA 1.491 1.58 0 O-C-N 121.689 -0.889 . . . . 0.0 110.276 -179.651 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 35.8 mm -69.38 -41.71 80.92 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.695 0 CA-C-O 121.673 0.749 . . . . 0.0 109.765 179.642 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 25' ' ' ILE . . . . . 0.404 ' O ' ' O ' ' A' ' 26' ' ' ARG . 34.1 mm -61.75 -42.29 93.84 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.68 0 O-C-N 121.274 -0.891 . . . . 0.0 109.511 -179.386 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 26' ' ' ARG . . . . . 0.404 ' O ' ' O ' ' A' ' 25' ' ' ILE . 95.9 mtt-85 59.78 121.18 0.01 OUTLIER 'General case' 0 N--CA 1.494 1.742 0 CA-C-O 121.847 0.832 . . . . 0.0 109.991 -179.971 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 97.9 mt-10 -64.21 137.56 58.0 Favored 'General case' 0 N--CA 1.491 1.623 0 CA-C-O 121.685 0.755 . . . . 0.0 110.421 -179.37 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . 156.56 -62.39 0.33 Allowed Glycine 0 N--CA 1.49 2.247 0 N-CA-C 109.544 -1.422 . . . . 0.0 109.544 179.834 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 99.3 m-20 -70.62 -168.7 0.27 Allowed 'General case' 0 N--CA 1.495 1.786 0 O-C-N 121.444 -1.033 . . . . 0.0 111.284 -179.406 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 97.3 m-20 -75.74 94.31 3.25 Favored 'General case' 0 N--CA 1.488 1.472 0 CA-C-O 121.515 0.674 . . . . 0.0 109.846 -179.415 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 8.6 p -123.13 144.62 32.06 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.708 0 CA-C-O 121.354 0.597 . . . . 0.0 109.487 179.955 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -116.71 155.46 28.82 Favored 'General case' 0 N--CA 1.495 1.781 0 CA-C-O 121.473 0.654 . . . . 0.0 109.383 -179.404 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 77.7 mm-40 -108.26 136.06 48.55 Favored 'General case' 0 N--CA 1.494 1.729 0 CA-C-O 121.598 0.713 . . . . 0.0 109.61 179.858 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 34' ' ' VAL . . . . . . . . . . . . . 56.0 t -127.26 134.38 66.02 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.874 0 CA-C-O 121.592 0.711 . . . . 0.0 109.937 -179.579 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 45.8 p -136.68 122.42 19.86 Favored 'General case' 0 N--CA 1.493 1.704 0 N-CA-C 108.73 -0.841 . . . . 0.0 108.73 179.299 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 51.0 tp -117.7 143.59 46.05 Favored 'General case' 0 N--CA 1.497 1.882 0 CA-C-O 121.645 0.736 . . . . 0.0 110.109 -179.443 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 37' ' ' PHE . . . . . . . . . . . . . 82.9 m-85 -105.84 145.62 30.98 Favored 'General case' 0 N--CA 1.494 1.752 0 CA-C-O 121.657 0.741 . . . . 0.0 109.998 -179.858 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . -173.55 175.28 46.27 Favored Glycine 0 N--CA 1.487 2.081 0 N-CA-C 109.77 -1.332 . . . . 0.0 109.77 -179.972 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 52.5 p -81.85 -92.28 0.06 Allowed 'General case' 0 N--CA 1.492 1.633 0 O-C-N 121.582 -0.952 . . . . 0.0 109.989 -179.819 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 40' ' ' ASP . . . . . . . . . . . . . 99.8 m-20 -82.24 168.82 17.25 Favored 'General case' 0 N--CA 1.495 1.779 0 O-C-N 121.225 -0.922 . . . . 0.0 110.631 -179.387 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 65.8 tttm -64.04 -38.82 92.46 Favored 'General case' 0 N--CA 1.497 1.908 0 O-C-N 121.652 -0.655 . . . . 0.0 110.514 -179.933 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -56.01 -39.21 71.55 Favored 'General case' 0 N--CA 1.494 1.766 0 O-C-N 121.314 -0.866 . . . . 0.0 109.935 -179.246 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 43' ' ' HIS . . . . . 0.624 ' CE1' ' NZ ' ' A' ' 47' ' ' LYS . 78.1 t60 -66.79 -45.2 79.16 Favored 'General case' 0 N--CA 1.494 1.743 0 O-C-N 121.315 -0.866 . . . . 0.0 109.861 -179.928 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 81.8 mt -64.69 -41.67 95.87 Favored 'General case' 0 N--CA 1.497 1.91 0 O-C-N 121.382 -0.823 . . . . 0.0 109.955 -179.69 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 71.1 mm-40 -63.91 -38.4 90.93 Favored 'General case' 0 N--CA 1.491 1.593 0 CA-C-O 121.66 0.743 . . . . 0.0 109.573 -179.81 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . -57.86 -54.81 34.45 Favored Glycine 0 N--CA 1.492 2.394 0 N-CA-C 109.823 -1.311 . . . . 0.0 109.823 -179.589 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 47' ' ' LYS . . . . . 0.624 ' NZ ' ' CE1' ' A' ' 43' ' ' HIS . 50.5 mttp -66.29 -37.8 86.27 Favored 'General case' 0 N--CA 1.494 1.755 0 O-C-N 121.497 -1.002 . . . . 0.0 109.761 179.45 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 50.5 tp -49.45 -36.17 21.71 Favored 'General case' 0 N--CA 1.492 1.632 0 O-C-N 121.497 -0.752 . . . . 0.0 109.394 -179.525 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 49' ' ' ALA . . . . . . . . . . . . . . . -55.03 -40.1 69.87 Favored 'General case' 0 N--CA 1.493 1.718 0 O-C-N 121.407 -0.808 . . . . 0.0 109.715 -179.918 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 96.8 mt-10 -67.21 -39.43 86.28 Favored 'General case' 0 N--CA 1.497 1.887 0 O-C-N 121.355 -0.84 . . . . 0.0 109.939 -179.888 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 12.4 m-85 -61.6 -47.41 85.61 Favored 'General case' 0 N--CA 1.496 1.856 0 O-C-N 121.36 -0.837 . . . . 0.0 109.918 -179.556 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 52' ' ' ILE . . . . . . . . . . . . . 96.8 mt -66.17 -43.13 92.15 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.629 0 O-C-N 121.524 -0.735 . . . . 0.0 109.884 -179.619 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 80.5 p -58.93 -43.21 91.14 Favored 'General case' 0 N--CA 1.494 1.769 0 O-C-N 121.371 -0.831 . . . . 0.0 109.498 -179.328 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 54' ' ' LEU . . . . . . . . . . . . . 79.7 mt -64.95 -39.88 94.17 Favored 'General case' 0 N--CA 1.494 1.734 0 O-C-N 121.461 -0.774 . . . . 0.0 109.366 179.358 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -58.56 -42.68 88.48 Favored 'General case' 0 N--CA 1.49 1.546 0 CA-C-O 121.535 0.683 . . . . 0.0 109.595 -179.774 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 56' ' ' LYS . . . . . . . . . . . . . 54.0 mtmt -64.9 -45.31 86.44 Favored 'General case' 0 N--CA 1.492 1.672 0 O-C-N 121.326 -0.859 . . . . 0.0 109.554 179.658 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 99.3 mm-40 -63.47 -44.13 95.33 Favored 'General case' 0 N--CA 1.494 1.736 0 O-C-N 121.589 -0.694 . . . . 0.0 109.64 -179.866 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 58' ' ' VAL . . . . . . . . . . . . . 79.4 t -65.17 -45.43 93.98 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.691 0 O-C-N 121.283 -0.885 . . . . 0.0 109.443 179.823 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 59' ' ' TYR . . . . . . . . . . . . . 82.8 t80 -140.25 120.06 13.45 Favored 'General case' 0 N--CA 1.497 1.881 0 O-C-N 121.272 -0.893 . . . . 0.0 109.589 -179.975 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -68.09 148.1 51.42 Favored 'General case' 0 N--CA 1.491 1.586 0 CA-C-O 121.819 0.818 . . . . 0.0 110.631 -179.717 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 61' ' ' ASN . . . . . . . . . . . . . 8.5 t-20 59.44 40.73 20.42 Favored 'General case' 0 N--CA 1.493 1.68 0 CA-C-O 121.689 0.757 . . . . 0.0 109.693 -179.879 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 62' ' ' VAL . . . . . . . . . . . . . 14.9 p -74.84 139.62 18.85 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.618 0 O-C-N 121.52 -0.737 . . . . 0.0 110.056 179.782 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 63' ' ' GLU . . . . . 0.548 ' OE1' ' N ' ' A' ' 63' ' ' GLU . 56.6 mp0 -109.84 137.15 48.04 Favored 'General case' 0 N--CA 1.495 1.785 0 CA-C-O 121.583 0.706 . . . . 0.0 109.474 -179.656 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 64' ' ' TYR . . . . . . . . . . . . . 53.4 p90 -148.68 163.37 37.51 Favored 'General case' 0 N--CA 1.492 1.643 0 CA-C-O 121.718 0.771 . . . . 0.0 110.252 -179.22 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 44.9 tt0 -141.96 147.81 37.59 Favored 'General case' 0 N--CA 1.494 1.762 0 N-CA-C 108.979 -0.749 . . . . 0.0 108.979 179.711 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 66' ' ' VAL . . . . . . . . . . . . . 92.1 t -120.13 130.19 74.6 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.965 0 CA-C-O 121.654 0.74 . . . . 0.0 110.204 -179.825 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -75.72 152.35 85.01 Favored Pre-proline 0 N--CA 1.485 1.319 0 N-CA-C 109.349 -0.611 . . . . 0.0 109.349 -179.888 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 68' ' ' PRO . . . . . . . . . . . . . 80.4 Cg_exo -42.44 131.39 5.09 Favored 'Trans proline' 0 C--N 1.31 -1.449 0 C-N-CA 122.637 2.224 . . . . 0.0 112.89 179.672 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 69' ' ' VAL . . . . . . . . . . . . . 88.3 t -125.32 131.21 72.58 Favored 'Isoleucine or valine' 0 N--CA 1.499 1.985 0 CA-C-O 121.722 0.772 . . . . 0.0 109.978 -179.955 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -76.98 156.33 31.98 Favored 'General case' 0 C--N 1.302 -1.495 0 CA-C-O 121.619 0.723 . . . . 0.0 110.016 179.863 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 71' ' ' ASP . . . . . 0.404 ' O ' ' OD1' ' A' ' 71' ' ' ASP . 62.9 t0 -63.13 -37.77 88.55 Favored 'General case' 0 N--CA 1.493 1.692 0 O-C-N 121.542 -0.724 . . . . 0.0 109.694 179.727 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 72' ' ' ASN . . . . . . . . . . . . . 8.5 m120 -94.23 13.05 24.62 Favored 'General case' 0 N--CA 1.496 1.846 0 O-C-N 121.226 -0.922 . . . . 0.0 109.171 -179.948 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -60.03 141.82 55.04 Favored 'General case' 0 N--CA 1.493 1.723 0 O-C-N 121.34 -0.85 . . . . 0.0 109.972 -179.696 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 74' ' ' THR . . . . . . . . . . . . . 16.4 p -104.83 0.23 27.86 Favored 'General case' 0 N--CA 1.494 1.73 0 N-CA-C 109.013 -0.736 . . . . 0.0 109.013 179.585 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 84.3 tt0 -144.46 149.84 36.65 Favored 'General case' 0 N--CA 1.494 1.772 0 O-C-N 121.143 -0.973 . . . . 0.0 109.614 179.766 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 6.3 tt -124.47 130.35 52.31 Favored 'General case' 0 N--CA 1.494 1.726 0 CA-C-O 121.325 0.583 . . . . 0.0 109.512 179.885 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 77' ' ' HIS . . . . . . . . . . . . . 96.4 m-70 -107.59 130.76 54.86 Favored 'General case' 0 N--CA 1.495 1.808 0 CA-C-O 121.655 0.74 . . . . 0.0 109.679 -179.711 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -146.15 156.82 43.69 Favored 'General case' 0 N--CA 1.49 1.561 0 O-C-N 121.6 -0.687 . . . . 0.0 109.318 -179.697 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 84.6 mtt85 -129.67 145.91 51.49 Favored 'General case' 0 N--CA 1.495 1.82 0 O-C-N 121.646 -0.659 . . . . 0.0 109.629 -179.62 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 80' ' ' PHE . . . . . . . . . . . . . 92.8 m-85 -129.64 145.92 51.47 Favored 'General case' 0 N--CA 1.495 1.816 0 O-C-N 121.637 -0.664 . . . . 0.0 109.353 -179.862 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 27.6 ttpt -117.04 121.53 41.6 Favored 'General case' 0 N--CA 1.494 1.752 0 CA-C-O 121.507 0.67 . . . . 0.0 109.721 -179.785 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 82' ' ' PHE . . . . . . . . . . . . . 68.8 m-85 -111.42 148.81 32.29 Favored 'General case' 0 N--CA 1.495 1.816 0 CA-C-O 121.637 0.732 . . . . 0.0 109.756 179.784 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 80.6 tt0 -64.16 -31.79 73.12 Favored 'General case' 0 N--CA 1.49 1.555 0 O-C-N 121.733 -0.604 . . . . 0.0 109.521 179.957 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 84' ' ' VAL . . . . . . . . . . . . . 27.6 m -134.11 156.48 40.88 Favored 'Isoleucine or valine' 0 N--CA 1.5 2.044 0 O-C-N 121.359 -0.838 . . . . 0.0 110.139 -179.853 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 78.3 p -70.26 -24.02 62.99 Favored 'General case' 0 N--CA 1.492 1.64 0 CA-C-O 121.51 0.672 . . . . 0.0 109.962 179.802 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 86' ' ' ALA . . . . . . . . . . . . . . . -59.21 -46.08 89.4 Favored 'General case' 0 N--CA 1.494 1.736 0 O-C-N 121.316 -0.865 . . . . 0.0 109.663 -179.712 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 98.4 mt-10 -70.52 -32.43 69.9 Favored 'General case' 0 N--CA 1.495 1.799 0 CA-C-O 121.742 0.782 . . . . 0.0 109.36 179.593 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 88' ' ' LYS . . . . . . . . . . . . . 14.1 tmtt? -61.98 -47.22 85.81 Favored 'General case' 0 C--N 1.301 -1.539 0 O-C-N 121.52 -0.737 . . . . 0.0 110.081 -179.713 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 95.8 mt -64.34 -43.26 95.15 Favored 'General case' 0 N--CA 1.494 1.766 0 O-C-N 121.419 -0.801 . . . . 0.0 109.639 -179.988 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 90' ' ' ILE . . . . . 0.432 HD11 HG22 ' A' ' 90' ' ' ILE . 96.9 mt -65.64 -43.54 93.86 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.667 0 CA-C-O 121.569 0.7 . . . . 0.0 109.793 -179.631 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 91' ' ' PHE . . . . . . . . . . . . . 76.5 t80 -61.4 -45.48 94.14 Favored 'General case' 0 N--CA 1.493 1.717 0 O-C-N 121.573 -0.704 . . . . 0.0 110.05 -179.465 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 92' ' ' GLU . . . . . . . . . . . . . 48.2 tp10 -66.01 -45.79 80.25 Favored 'General case' 0 N--CA 1.492 1.659 0 O-C-N 121.334 -0.854 . . . . 0.0 109.595 -179.691 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 93' ' ' LEU . . . . . . . . . . . . . 82.8 mt -64.44 -43.22 94.99 Favored 'General case' 0 N--CA 1.497 1.881 0 O-C-N 121.327 -0.858 . . . . 0.0 109.934 -179.917 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 94' ' ' LYS . . . . . . . . . . . . . 38.0 ttmt -66.57 -44.41 82.32 Favored 'General case' 0 N--CA 1.494 1.75 0 O-C-N 121.356 -0.84 . . . . 0.0 109.956 -179.824 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 20.9 p -66.35 -43.74 85.22 Favored 'General case' 0 N--CA 1.494 1.747 0 O-C-N 121.407 -0.808 . . . . 0.0 109.632 -179.716 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 96' ' ' ARG . . . . . . . . . . . . . 41.6 mmm-85 -65.94 -38.92 89.9 Favored 'General case' 0 N--CA 1.493 1.693 0 O-C-N 121.485 -0.759 . . . . 0.0 109.547 179.97 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 97' ' ' ALA . . . . . . . . . . . . . . . -64.35 -37.78 88.72 Favored 'General case' 0 N--CA 1.493 1.712 0 O-C-N 121.525 -0.734 . . . . 0.0 109.581 -179.957 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 98' ' ' LEU . . . . . . . . . . . . . 6.4 tt -63.55 -42.85 98.36 Favored 'General case' 0 C--N 1.299 -1.602 0 O-C-N 121.436 -0.79 . . . . 0.0 109.612 -179.939 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 99' ' ' ALA . . . . . . . . . . . . . . . -75.03 -42.33 57.46 Favored 'General case' 0 N--CA 1.493 1.714 0 O-C-N 121.541 -0.724 . . . . 0.0 110.079 -179.81 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 100' ' ' ARG . . . . . . . . . . . . . 41.0 ttm180 -66.17 -40.91 90.86 Favored 'General case' 0 N--CA 1.497 1.9 0 O-C-N 121.456 -0.778 . . . . 0.0 110.234 -179.575 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 101' ' ' LEU . . . . . . . . . . . . . 74.8 mt 57.67 -170.21 0.11 Allowed 'General case' 0 N--CA 1.497 1.878 0 CA-C-O 121.648 0.737 . . . . 0.0 110.62 179.911 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 102' ' ' GLU . . . . . 0.42 ' O ' ' O ' ' A' ' 103' ' ' HIS . 34.4 tp10 -105.59 53.4 0.71 Allowed 'General case' 0 N--CA 1.495 1.811 0 CA-C-O 121.529 0.68 . . . . 0.0 109.269 -179.541 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 103' ' ' HIS . . . . . 0.42 ' O ' ' O ' ' A' ' 102' ' ' GLU . 99.8 m-70 57.52 118.18 0.01 OUTLIER 'General case' 0 N--CA 1.494 1.731 0 CA-C-O 121.977 0.894 . . . . 0.0 110.681 179.642 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 104' ' ' HIS . . . . . 0.424 ' O ' ' C ' ' A' ' 105' ' ' HIS . 60.7 m170 -62.31 -47.62 83.46 Favored 'General case' 0 N--CA 1.49 1.556 0 O-C-N 121.61 -0.681 . . . . 0.0 109.59 179.779 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 105' ' ' HIS . . . . . 0.424 ' C ' ' O ' ' A' ' 104' ' ' HIS . 85.5 t60 38.62 84.38 0.02 OUTLIER 'General case' 0 N--CA 1.497 1.889 0 CA-C-O 121.703 0.764 . . . . 0.0 110.207 -179.908 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 106' ' ' HIS . . . . . . . . . . . . . 62.7 t-80 -152.13 135.48 15.95 Favored 'General case' 0 N--CA 1.491 1.593 0 O-C-N 121.346 -0.846 . . . . 0.0 109.786 -179.855 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 107' ' ' HIS . . . . . . . . . . . . . 56.8 p-80 -154.69 -7.98 0.14 Allowed 'General case' 0 N--CA 1.49 1.566 0 N-CA-C 109.015 -0.735 . . . . 0.0 109.015 179.698 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 108' ' ' HIS . . . . . . . . . . . . . 86.3 t60 . . . . . 0 N--CA 1.497 1.917 0 CA-C-O 117.942 -1.028 . . . . 0.0 109.538 179.805 . . . . . . . . 0 0 . 1 . 014 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 97.2 mmm . . . . . 0 N--CA 1.491 1.607 0 N-CA-C 109.011 -0.737 . . . . 0.0 109.011 . . . . . . . . . 0 0 . 1 . 014 nuclear orig full ' A' A ' 2' ' ' SER . . . . . 0.41 ' O ' ' CG ' ' A' ' 3' ' ' ASN . 23.2 t -156.24 39.1 0.35 Allowed 'General case' 0 N--CA 1.49 1.56 0 O-C-N 121.367 -0.833 . . . . 0.0 108.817 179.815 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 3' ' ' ASN . . . . . 0.41 ' CG ' ' O ' ' A' ' 2' ' ' SER . 16.3 p30 42.07 42.48 2.41 Favored 'General case' 0 N--CA 1.497 1.902 0 CA-C-O 121.436 0.636 . . . . 0.0 109.798 -179.695 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 4' ' ' GLN . . . . . 0.415 ' O ' ' O ' ' A' ' 5' ' ' THR . 78.2 mt-30 -60.11 -117.1 0.0 OUTLIER 'General case' 0 N--CA 1.495 1.785 0 O-C-N 121.44 -0.787 . . . . 0.0 110.034 -179.783 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 5' ' ' THR . . . . . 0.415 ' O ' ' O ' ' A' ' 4' ' ' GLN . 64.6 p 40.53 -163.58 0.0 OUTLIER 'General case' 0 N--CA 1.498 1.927 0 CA-C-O 121.589 0.709 . . . . 0.0 110.975 -179.946 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 48.4 t -79.27 136.56 37.08 Favored 'General case' 0 N--CA 1.492 1.667 0 CA-C-O 121.443 0.639 . . . . 0.0 109.861 -179.39 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 7' ' ' VAL . . . . . . . . . . . . . 26.9 m -79.32 133.33 30.12 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.697 0 O-C-N 121.218 -0.926 . . . . 0.0 109.689 -179.916 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 80.8 tt0 -66.78 128.65 37.11 Favored 'General case' 0 N--CA 1.492 1.633 0 O-C-N 121.238 -0.914 . . . . 0.0 109.529 -179.822 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 38.0 p-10 -93.03 119.55 32.4 Favored 'General case' 0 N--CA 1.494 1.767 0 O-C-N 121.225 -0.922 . . . . 0.0 109.965 -179.892 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 83.8 tt0 -98.2 -21.49 16.68 Favored 'General case' 0 N--CA 1.496 1.849 0 O-C-N 121.294 -0.879 . . . . 0.0 108.975 179.426 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 23.5 m -112.19 129.46 67.65 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.97 0 O-C-N 121.657 -0.652 . . . . 0.0 109.441 -179.963 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 39.4 m -145.07 104.45 3.97 Favored 'General case' 0 N--CA 1.494 1.762 0 O-C-N 121.29 -0.881 . . . . 0.0 109.126 179.978 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 97.5 mt-10 -82.7 -2.55 54.47 Favored 'General case' 0 N--CA 1.49 1.555 0 O-C-N 121.282 -0.886 . . . . 0.0 109.016 179.94 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . 56.31 38.62 29.92 Favored 'General case' 0 N--CA 1.49 1.567 0 O-C-N 121.578 -0.701 . . . . 0.0 109.223 -179.948 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 7.2 t -84.78 132.09 34.47 Favored 'General case' 0 N--CA 1.493 1.719 0 O-C-N 121.474 -0.766 . . . . 0.0 109.72 -179.828 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . -178.53 -105.6 0.19 Allowed Glycine 0 N--CA 1.495 2.62 0 N-CA-C 109.234 -1.546 . . . . 0.0 109.234 179.646 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 7.6 t 51.05 -176.24 0.02 OUTLIER 'General case' 0 N--CA 1.498 1.93 0 O-C-N 121.319 -1.106 . . . . 0.0 110.872 179.215 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . 44.2 59.79 3.07 Favored 'General case' 0 N--CA 1.495 1.786 0 O-C-N 121.562 -0.711 . . . . 0.0 109.315 -179.689 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -66.41 147.33 49.79 Favored Glycine 0 N--CA 1.493 2.449 0 N-CA-C 109.713 -1.355 . . . . 0.0 109.713 -179.644 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 49.8 tp10 -67.02 141.57 57.52 Favored 'General case' 0 N--CA 1.494 1.729 0 O-C-N 121.395 -1.062 . . . . 0.0 110.027 -179.657 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 21' ' ' ILE . . . . . . . . . . . . . 96.8 mt -64.12 -43.94 97.53 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.611 0 O-C-N 121.489 -0.757 . . . . 0.0 109.668 179.487 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . -88.17 99.28 2.5 Favored Glycine 0 N--CA 1.495 2.624 0 N-CA-C 110.178 -1.169 . . . . 0.0 110.178 -179.322 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 23' ' ' PHE . . . . . . . . . . . . . 91.2 t80 -173.56 -38.3 0.01 OUTLIER 'General case' 0 N--CA 1.492 1.659 0 O-C-N 121.324 -1.103 . . . . 0.0 108.838 179.246 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 24' ' ' ILE . . . . . 0.536 ' C ' ' H ' ' A' ' 26' ' ' ARG . 20.5 tt -69.37 -37.93 76.37 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.494 0 O-C-N 121.566 -0.709 . . . . 0.0 109.478 179.574 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 25' ' ' ILE . . . . . 0.413 ' O ' ' CG2' ' A' ' 25' ' ' ILE . 93.5 mt 49.09 11.0 0.04 OUTLIER 'Isoleucine or valine' 0 N--CA 1.495 1.794 0 O-C-N 121.286 -0.884 . . . . 0.0 109.153 -179.331 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 26' ' ' ARG . . . . . 0.536 ' H ' ' C ' ' A' ' 24' ' ' ILE . 99.7 mtt180 50.87 23.72 1.53 Allowed 'General case' 0 N--CA 1.492 1.664 0 O-C-N 121.216 -0.927 . . . . 0.0 109.872 179.455 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 96.8 mt-10 53.71 73.36 0.38 Allowed 'General case' 0 N--CA 1.496 1.834 0 O-C-N 121.466 -0.771 . . . . 0.0 109.776 179.586 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . -55.26 178.43 0.37 Allowed Glycine 0 N--CA 1.494 2.561 0 N-CA-C 110.46 -1.056 . . . . 0.0 110.46 -179.724 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 29' ' ' ASP . . . . . 0.443 ' O ' ' O ' ' A' ' 30' ' ' ASP . 93.5 m-20 -66.48 118.51 10.21 Favored 'General case' 0 N--CA 1.494 1.745 0 O-C-N 121.509 -0.994 . . . . 0.0 110.518 -179.337 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 30' ' ' ASP . . . . . 0.443 ' O ' ' O ' ' A' ' 29' ' ' ASP . 98.1 m-20 51.17 104.29 0.01 OUTLIER 'General case' 0 N--CA 1.493 1.683 0 CA-C-O 121.56 0.695 . . . . 0.0 110.262 179.468 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 9.8 p -128.23 139.24 52.43 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.904 0 N-CA-C 108.717 -0.846 . . . . 0.0 108.717 179.544 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -114.93 153.6 30.26 Favored 'General case' 0 N--CA 1.498 1.958 0 O-C-N 121.633 -0.667 . . . . 0.0 109.353 -179.515 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 33' ' ' GLU . . . . . 0.547 ' N ' ' OE1' ' A' ' 33' ' ' GLU . 55.7 mp0 -103.13 145.56 29.73 Favored 'General case' 0 N--CA 1.495 1.777 0 O-C-N 121.619 -0.676 . . . . 0.0 109.381 -179.438 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 34' ' ' VAL . . . . . . . . . . . . . 46.3 t -126.14 133.75 68.11 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.936 0 N-CA-C 108.85 -0.796 . . . . 0.0 108.85 179.879 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 40.8 t -129.88 131.56 46.1 Favored 'General case' 0 N--CA 1.495 1.806 0 N-CA-C 108.86 -0.793 . . . . 0.0 108.86 179.756 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 44.5 tp -126.01 131.38 52.22 Favored 'General case' 0 N--CA 1.499 2.014 0 O-C-N 121.418 -0.801 . . . . 0.0 108.967 179.717 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 37' ' ' PHE . . . . . . . . . . . . . 93.7 m-85 -115.74 144.99 43.19 Favored 'General case' 0 N--CA 1.497 1.911 0 N-CA-C 109.294 -0.632 . . . . 0.0 109.294 -179.614 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . -174.07 176.94 46.49 Favored Glycine 0 N--CA 1.491 2.301 0 N-CA-C 109.585 -1.406 . . . . 0.0 109.585 179.907 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 34.6 p -61.36 -98.98 0.0 OUTLIER 'General case' 0 C--N 1.301 -1.528 0 O-C-N 121.267 -1.137 . . . . 0.0 110.776 -179.268 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 40' ' ' ASP . . . . . 0.418 ' OD1' ' N ' ' A' ' 41' ' ' LYS . 51.4 t0 -76.84 153.43 34.83 Favored 'General case' 0 N--CA 1.494 1.727 0 CA-C-O 121.71 0.766 . . . . 0.0 110.938 -178.67 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 41' ' ' LYS . . . . . 0.418 ' N ' ' OD1' ' A' ' 40' ' ' ASP . 65.5 tttm -64.97 -35.64 81.84 Favored 'General case' 0 N--CA 1.491 1.597 0 O-C-N 121.614 -0.679 . . . . 0.0 109.978 -179.974 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -55.94 -39.53 71.83 Favored 'General case' 0 N--CA 1.492 1.659 0 O-C-N 121.276 -0.89 . . . . 0.0 109.496 -179.382 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 43' ' ' HIS . . . . . . . . . . . . . 11.7 t-160 -62.97 -38.56 91.6 Favored 'General case' 0 N--CA 1.489 1.494 0 O-C-N 121.307 -0.871 . . . . 0.0 109.127 179.865 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 46.2 mt -61.3 -40.71 95.18 Favored 'General case' 0 N--CA 1.489 1.497 0 O-C-N 121.23 -0.919 . . . . 0.0 109.299 -179.724 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 97.7 mt-10 -62.76 -36.35 82.78 Favored 'General case' 0 N--CA 1.491 1.579 0 O-C-N 121.344 -0.848 . . . . 0.0 109.306 -179.939 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . -60.86 -41.62 99.29 Favored Glycine 0 N--CA 1.492 2.402 0 N-CA-C 109.501 -1.44 . . . . 0.0 109.501 -179.902 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 97.5 mttt -77.37 -25.13 50.65 Favored 'General case' 0 N--CA 1.493 1.702 0 O-C-N 121.118 -1.225 . . . . 0.0 109.687 179.776 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 57.8 tp -61.66 -39.2 90.54 Favored 'General case' 0 N--CA 1.49 1.554 0 O-C-N 121.432 -0.793 . . . . 0.0 109.44 179.975 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 49' ' ' ALA . . . . . . . . . . . . . . . -53.66 -42.2 67.61 Favored 'General case' 0 N--CA 1.491 1.621 0 O-C-N 121.3 -0.875 . . . . 0.0 109.948 -179.315 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 50' ' ' GLU . . . . . 0.506 ' OE1' ' N ' ' A' ' 50' ' ' GLU . 58.2 mp0 -69.96 -42.35 73.31 Favored 'General case' 0 N--CA 1.494 1.742 0 O-C-N 121.236 -0.915 . . . . 0.0 109.84 -179.679 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 51' ' ' TYR . . . . . 0.461 ' CZ ' ' CG2' ' A' ' 95' ' ' THR . 4.3 m-85 -50.85 -49.11 59.63 Favored 'General case' 0 N--CA 1.489 1.516 0 O-C-N 121.138 -0.976 . . . . 0.0 108.779 -179.193 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 52' ' ' ILE . . . . . . . . . . . . . 93.6 mt -65.52 -43.57 94.26 Favored 'Isoleucine or valine' 0 C--N 1.297 -1.675 0 O-C-N 121.57 -0.706 . . . . 0.0 110.066 179.878 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 48.0 t -58.2 -49.51 76.78 Favored 'General case' 0 N--CA 1.493 1.696 0 O-C-N 121.132 -0.98 . . . . 0.0 110.503 -178.583 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 54' ' ' LEU . . . . . 0.624 ' CD1' ' HZ2' ' A' ' 94' ' ' LYS . 4.3 mm? -64.35 -41.25 96.84 Favored 'General case' 0 N--CA 1.491 1.622 0 O-C-N 121.099 -1.001 . . . . 0.0 109.105 179.554 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -62.78 -36.35 82.82 Favored 'General case' 0 N--CA 1.49 1.527 0 O-C-N 121.382 -0.823 . . . . 0.0 109.531 -179.831 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 56' ' ' LYS . . . . . . . . . . . . . 30.3 mmtm -62.27 -45.56 92.74 Favored 'General case' 0 N--CA 1.492 1.649 0 O-C-N 121.385 -0.822 . . . . 0.0 109.934 -179.963 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 58.5 tt0 -68.87 -41.78 77.92 Favored 'General case' 0 N--CA 1.49 1.554 0 O-C-N 121.242 -0.911 . . . . 0.0 109.625 -179.86 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 58' ' ' VAL . . . . . 0.478 ' CG1' ' OE1' ' A' ' 87' ' ' GLU . 66.8 t -64.09 -45.71 95.77 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.455 0 O-C-N 121.308 -0.87 . . . . 0.0 109.607 179.883 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 59' ' ' TYR . . . . . 0.44 ' O ' ' O ' ' A' ' 60' ' ' ALA . 62.9 t80 -126.89 136.22 52.02 Favored 'General case' 0 N--CA 1.5 2.032 0 O-C-N 121.494 -0.754 . . . . 0.0 109.586 -179.46 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 60' ' ' ALA . . . . . 0.44 ' O ' ' O ' ' A' ' 59' ' ' TYR . . . -48.25 -102.99 0.0 OUTLIER 'General case' 0 N--CA 1.494 1.741 0 O-C-N 121.693 -0.63 . . . . 0.0 110.867 -179.286 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 61' ' ' ASN . . . . . . . . . . . . . 83.2 m-20 -85.51 86.9 7.34 Favored 'General case' 0 N--CA 1.492 1.637 0 O-C-N 121.266 -0.896 . . . . 0.0 109.439 -179.119 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 62' ' ' VAL . . . . . . . . . . . . . 14.7 p -81.72 136.74 22.44 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.585 0 O-C-N 121.333 -0.855 . . . . 0.0 109.687 -179.927 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 96.8 mt-10 -108.45 137.09 46.99 Favored 'General case' 0 N--CA 1.5 2.05 0 O-C-N 121.407 -0.808 . . . . 0.0 108.95 179.842 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 64' ' ' TYR . . . . . . . . . . . . . 48.6 p90 -152.56 164.11 38.27 Favored 'General case' 0 N--CA 1.49 1.565 0 O-C-N 121.226 -0.921 . . . . 0.0 109.511 -179.615 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 79.7 mm-40 -138.81 154.34 48.46 Favored 'General case' 0 N--CA 1.497 1.895 0 N-CA-C 108.756 -0.831 . . . . 0.0 108.756 179.793 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 66' ' ' VAL . . . . . . . . . . . . . 2.7 p -125.75 129.07 72.61 Favored 'Isoleucine or valine' 0 N--CA 1.499 1.989 0 N-CA-C 109.088 -0.708 . . . . 0.0 109.088 -179.735 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -88.03 119.32 70.38 Favored Pre-proline 0 N--CA 1.494 1.76 0 O-C-N 121.378 -0.826 . . . . 0.0 109.014 -179.972 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 68' ' ' PRO . . . . . . . . . . . . . 84.8 Cg_exo -47.74 136.91 21.66 Favored 'Trans proline' 0 N--CA 1.499 1.847 0 C-N-CA 121.824 1.683 . . . . 0.0 112.916 179.687 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 69' ' ' VAL . . . . . . . . . . . . . 3.1 t -133.08 162.19 40.37 Favored 'Isoleucine or valine' 0 N--CA 1.503 2.182 0 O-C-N 121.601 -0.687 . . . . 0.0 109.935 -179.847 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -62.22 145.68 52.9 Favored 'General case' 0 N--CA 1.496 1.844 0 O-C-N 121.378 -0.826 . . . . 0.0 110.087 -179.734 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 90.3 m-20 -70.01 -29.96 67.15 Favored 'General case' 0 N--CA 1.491 1.591 0 O-C-N 121.429 -0.795 . . . . 0.0 109.68 179.502 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 72' ' ' ASN . . . . . . . . . . . . . 98.6 m-20 -94.21 6.07 49.79 Favored 'General case' 0 N--CA 1.491 1.614 0 O-C-N 121.596 -0.69 . . . . 0.0 109.188 -179.882 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -87.92 155.08 20.03 Favored 'General case' 0 N--CA 1.491 1.614 0 N-CA-C 108.644 -0.873 . . . . 0.0 108.644 179.583 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 74' ' ' THR . . . . . 0.64 ' OG1' ' O ' ' A' ' 74' ' ' THR . 0.0 OUTLIER -77.82 16.97 0.61 Allowed 'General case' 0 C--N 1.293 -1.881 0 CA-C-O 117.574 -1.203 . . . . 0.0 112.801 -179.808 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -158.81 165.85 33.29 Favored 'General case' 0 N--CA 1.523 3.179 0 C-N-CA 113.187 -3.405 . . . . 0.0 119.864 -175.045 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 7.5 tt -139.03 131.7 28.94 Favored 'General case' 0 C--N 1.297 -1.68 0 CA-C-N 109.348 -3.569 . . . . 0.0 104.952 -178.802 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 77' ' ' HIS . . . . . . . . . . . . . 82.9 t60 -133.76 135.09 43.69 Favored 'General case' 0 N--CA 1.506 2.332 0 O-C-N 120.476 -1.39 . . . . 0.0 107.411 179.54 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -141.19 167.65 21.67 Favored 'General case' 0 N--CA 1.496 1.845 0 O-C-N 121.223 -0.923 . . . . 0.0 109.558 -178.989 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 84.3 mtp180 -123.31 148.79 45.61 Favored 'General case' 0 N--CA 1.498 1.949 0 N-CA-C 108.625 -0.879 . . . . 0.0 108.625 179.827 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 80' ' ' PHE . . . . . . . . . . . . . 62.6 m-85 -130.06 150.27 51.4 Favored 'General case' 0 N--CA 1.5 2.042 0 N-CA-C 109.131 -0.692 . . . . 0.0 109.131 -179.565 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 35.6 ttpt -106.83 119.51 39.54 Favored 'General case' 0 N--CA 1.496 1.848 0 O-C-N 121.429 -0.794 . . . . 0.0 109.319 -179.975 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 82' ' ' PHE . . . . . . . . . . . . . 56.2 m-85 -128.65 153.23 47.5 Favored 'General case' 0 N--CA 1.501 2.078 0 O-C-N 121.606 -0.684 . . . . 0.0 109.299 -179.982 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 83' ' ' GLU . . . . . 0.431 ' O ' ' OD2' ' A' ' 30' ' ' ASP . 27.2 mm-40 -64.84 -41.96 95.3 Favored 'General case' 0 C--N 1.299 -1.594 0 O-C-N 121.51 -0.744 . . . . 0.0 109.854 -179.13 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 84' ' ' VAL . . . . . . . . . . . . . 2.9 m -136.34 160.78 37.91 Favored 'Isoleucine or valine' 0 N--CA 1.501 2.082 0 O-C-N 121.354 -0.841 . . . . 0.0 110.424 -179.145 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 85' ' ' SER . . . . . 0.522 ' O ' ' N ' ' A' ' 88' ' ' LYS . 11.6 t -63.75 -41.06 98.08 Favored 'General case' 0 N--CA 1.491 1.6 0 O-C-N 121.597 -0.689 . . . . 0.0 110.24 179.553 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 86' ' ' ALA . . . . . . . . . . . . . . . -40.75 -36.19 0.58 Allowed 'General case' 0 N--CA 1.5 2.04 0 O-C-N 121.621 -0.675 . . . . 0.0 110.02 -179.005 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 87' ' ' GLU . . . . . 0.478 ' OE1' ' CG1' ' A' ' 58' ' ' VAL . 70.3 mm-40 -65.71 -37.7 87.15 Favored 'General case' 0 C--N 1.301 -1.5 0 O-C-N 121.353 -0.842 . . . . 0.0 109.077 179.249 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 88' ' ' LYS . . . . . 0.522 ' N ' ' O ' ' A' ' 85' ' ' SER . 28.2 tptp -63.65 -46.38 85.92 Favored 'General case' 0 C--N 1.303 -1.428 0 O-C-N 121.26 -0.9 . . . . 0.0 109.398 179.875 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 89' ' ' LEU . . . . . 0.409 ' N ' ' CD1' ' A' ' 89' ' ' LEU . 10.8 mp -61.56 -46.95 87.72 Favored 'General case' 0 C--N 1.302 -1.48 0 O-C-N 121.319 -0.863 . . . . 0.0 109.465 -179.301 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 90' ' ' ILE . . . . . . . . . . . . . 96.8 mt -68.18 -44.2 84.37 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.522 0 O-C-N 121.212 -0.93 . . . . 0.0 109.668 179.81 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 91' ' ' PHE . . . . . . . . . . . . . 88.8 t80 -61.39 -46.48 90.01 Favored 'General case' 0 N--CA 1.491 1.599 0 O-C-N 121.395 -0.815 . . . . 0.0 109.54 -179.722 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 92' ' ' GLU . . . . . . . . . . . . . 84.0 tt0 -66.11 -40.02 90.4 Favored 'General case' 0 C--N 1.303 -1.441 0 O-C-N 121.272 -0.893 . . . . 0.0 109.151 179.98 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 93' ' ' LEU . . . . . . . . . . . . . 8.2 tp -62.93 -48.71 77.76 Favored 'General case' 0 N--CA 1.488 1.471 0 O-C-N 121.397 -0.814 . . . . 0.0 109.343 -179.701 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 94' ' ' LYS . . . . . 0.624 ' HZ2' ' CD1' ' A' ' 54' ' ' LEU . 17.3 ttpp -70.17 -45.36 66.87 Favored 'General case' 0 N--CA 1.491 1.609 0 O-C-N 121.475 -0.766 . . . . 0.0 109.827 179.74 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 95' ' ' THR . . . . . 0.461 ' CG2' ' CZ ' ' A' ' 51' ' ' TYR . 92.2 m -62.11 -44.26 97.04 Favored 'General case' 0 C--N 1.301 -1.523 0 O-C-N 121.558 -0.714 . . . . 0.0 109.419 -179.825 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 96' ' ' ARG . . . . . . . . . . . . . 71.1 ttp85 -57.99 -42.44 85.13 Favored 'General case' 0 N--CA 1.489 1.497 0 O-C-N 121.389 -0.819 . . . . 0.0 109.161 179.803 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 97' ' ' ALA . . . . . 0.469 ' O ' ' N ' ' A' ' 101' ' ' LEU . . . -56.39 -46.29 80.18 Favored 'General case' 0 C--N 1.301 -1.507 0 O-C-N 121.379 -0.826 . . . . 0.0 108.86 179.733 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 98' ' ' LEU . . . . . . . . . . . . . 97.8 mt -63.97 -40.18 95.82 Favored 'General case' 0 N--CA 1.489 1.5 0 O-C-N 121.487 -0.758 . . . . 0.0 109.187 179.518 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 99' ' ' ALA . . . . . . . . . . . . . . . -56.0 -49.73 72.83 Favored 'General case' 0 N--CA 1.491 1.584 0 O-C-N 121.517 -0.739 . . . . 0.0 109.777 -179.452 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 100' ' ' ARG . . . . . . . . . . . . . 25.2 mmt85 -92.36 -59.84 1.98 Allowed 'General case' 0 N--CA 1.494 1.745 0 O-C-N 121.281 -0.887 . . . . 0.0 109.478 -179.887 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 101' ' ' LEU . . . . . 0.469 ' N ' ' O ' ' A' ' 97' ' ' ALA . 54.9 tp -176.98 144.55 0.45 Allowed 'General case' 0 N--CA 1.493 1.72 0 O-C-N 121.575 -0.703 . . . . 0.0 109.49 179.882 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 102' ' ' GLU . . . . . 0.413 ' O ' ' O ' ' A' ' 103' ' ' HIS . 37.9 tp10 -82.46 -115.47 0.02 OUTLIER 'General case' 0 N--CA 1.491 1.594 0 O-C-N 121.409 -0.807 . . . . 0.0 109.44 -179.971 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 103' ' ' HIS . . . . . 0.413 ' O ' ' O ' ' A' ' 102' ' ' GLU . 99.2 m-70 41.16 -163.47 0.01 OUTLIER 'General case' 0 N--CA 1.498 1.94 0 O-C-N 121.447 -0.783 . . . . 0.0 110.636 -179.894 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 104' ' ' HIS . . . . . . . . . . . . . 98.9 m-70 -95.58 138.1 33.72 Favored 'General case' 0 N--CA 1.494 1.758 0 O-C-N 121.425 -0.797 . . . . 0.0 109.625 -179.378 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 105' ' ' HIS . . . . . . . . . . . . . 6.0 p80 -85.85 122.6 30.14 Favored 'General case' 0 N--CA 1.492 1.649 0 O-C-N 121.287 -0.883 . . . . 0.0 109.25 -179.68 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 106' ' ' HIS . . . . . . . . . . . . . 81.8 t60 -125.55 119.37 27.98 Favored 'General case' 0 N--CA 1.501 2.118 0 O-C-N 121.396 -0.815 . . . . 0.0 109.281 179.923 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 107' ' ' HIS . . . . . 0.529 ' O ' ' CG ' ' A' ' 108' ' ' HIS . 74.8 t60 -150.53 142.79 24.21 Favored 'General case' 0 N--CA 1.494 1.76 0 O-C-N 121.02 -1.05 . . . . 0.0 109.342 179.908 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 108' ' ' HIS . . . . . 0.529 ' CG ' ' O ' ' A' ' 107' ' ' HIS . 75.4 m80 . . . . . 0 N--CA 1.49 1.557 0 CA-C-O 118.095 -0.955 . . . . 0.0 109.299 179.79 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 97.0 mmm . . . . . 0 N--CA 1.489 1.495 0 CA-C-O 121.614 0.721 . . . . 0.0 109.432 . . . . . . . . . 0 0 . 1 . 015 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 20.0 m -76.93 -17.15 59.1 Favored 'General case' 0 N--CA 1.489 1.509 0 O-C-N 121.498 -0.751 . . . . 0.0 109.289 -179.641 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 3' ' ' ASN . . . . . . . . . . . . . 93.1 m-20 -63.51 -40.55 97.35 Favored 'General case' 0 N--CA 1.49 1.543 0 O-C-N 121.432 -0.793 . . . . 0.0 109.481 179.906 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 99.4 mm-40 -51.32 -85.11 0.0 OUTLIER 'General case' 0 N--CA 1.489 1.499 0 O-C-N 121.476 -0.765 . . . . 0.0 109.99 -179.471 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 60.4 m 44.28 80.28 0.04 OUTLIER 'General case' 0 N--CA 1.491 1.585 0 O-C-N 121.513 -0.742 . . . . 0.0 109.626 -179.407 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 98.9 m -137.66 148.98 46.19 Favored 'General case' 0 N--CA 1.494 1.73 0 O-C-N 121.535 -0.728 . . . . 0.0 109.706 -179.868 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 7' ' ' VAL . . . . . . . . . . . . . 98.1 t -97.65 134.17 36.76 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.722 0 O-C-N 121.332 -0.855 . . . . 0.0 110.078 -179.325 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 82.1 tt0 -56.37 140.74 44.42 Favored 'General case' 0 N--CA 1.49 1.529 0 CA-C-O 121.757 0.789 . . . . 0.0 110.669 -179.433 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 9' ' ' ASN . . . . . 0.573 ' O ' ' N ' ' A' ' 11' ' ' VAL . 95.2 m-20 43.79 -117.53 0.52 Allowed 'General case' 0 N--CA 1.492 1.664 0 O-C-N 121.677 -0.64 . . . . 0.0 110.361 179.493 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 10' ' ' GLU . . . . . 0.523 ' C ' ' H ' ' A' ' 12' ' ' CYS . 33.1 tp10 59.58 -73.03 0.03 OUTLIER 'General case' 0 N--CA 1.492 1.635 0 CA-C-O 121.324 0.583 . . . . 0.0 109.491 -179.603 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 11' ' ' VAL . . . . . 0.573 ' N ' ' O ' ' A' ' 9' ' ' ASN . 2.0 t 52.11 9.47 0.04 OUTLIER 'Isoleucine or valine' 0 N--CA 1.49 1.565 0 O-C-N 121.605 -0.684 . . . . 0.0 109.182 -179.226 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 12' ' ' CYS . . . . . 0.523 ' H ' ' C ' ' A' ' 10' ' ' GLU . 50.5 t 39.32 91.46 0.01 OUTLIER 'General case' 0 N--CA 1.493 1.715 0 CA-C-O 121.715 0.769 . . . . 0.0 110.495 -179.908 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 79.1 mm-40 55.11 79.56 0.15 Allowed 'General case' 0 N--CA 1.491 1.61 0 CA-C-O 121.658 0.742 . . . . 0.0 109.677 -179.873 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -66.91 138.66 57.46 Favored 'General case' 0 N--CA 1.489 1.487 0 CA-C-O 121.552 0.691 . . . . 0.0 110.25 -179.47 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 15' ' ' CYS . . . . . 0.456 ' O ' ' N ' ' A' ' 17' ' ' CYS . 10.5 t -145.0 135.83 24.63 Favored 'General case' 0 N--CA 1.49 1.536 0 O-C-N 121.414 -0.804 . . . . 0.0 109.483 179.389 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 48.18 -94.33 0.01 OUTLIER Glycine 0 N--CA 1.49 2.246 0 N-CA-C 110.18 -1.168 . . . . 0.0 110.18 179.329 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 17' ' ' CYS . . . . . 0.456 ' N ' ' O ' ' A' ' 15' ' ' CYS . 8.9 t 63.9 122.21 0.02 OUTLIER 'General case' 0 N--CA 1.49 1.544 0 O-C-N 121.732 -0.863 . . . . 0.0 110.315 -179.534 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -82.44 -5.75 58.87 Favored 'General case' 0 N--CA 1.488 1.468 0 N-CA-C 108.99 -0.744 . . . . 0.0 108.99 179.728 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 90.44 174.73 44.74 Favored Glycine 0 N--CA 1.492 2.408 0 N-CA-C 110.707 -0.957 . . . . 0.0 110.707 179.033 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 80.1 mm-40 -54.54 -79.94 0.02 OUTLIER 'General case' 0 N--CA 1.49 1.534 0 O-C-N 121.73 -0.865 . . . . 0.0 110.083 -179.794 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 21' ' ' ILE . . . . . . . . . . . . . 87.3 mt -102.98 129.28 54.94 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.81 0 O-C-N 121.488 -0.757 . . . . 0.0 110.433 -178.914 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . -80.89 96.7 1.71 Allowed Glycine 0 N--CA 1.487 2.09 0 N-CA-C 109.837 -1.305 . . . . 0.0 109.837 -179.986 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 23' ' ' PHE . . . . . . . . . . . . . 86.9 t80 -101.73 -3.5 28.05 Favored 'General case' 0 N--CA 1.492 1.657 0 O-C-N 121.544 -0.974 . . . . 0.0 108.42 179.227 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 40.7 pt -81.31 -15.71 12.4 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.523 0 N-CA-C 109.103 -0.703 . . . . 0.0 109.103 179.86 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 25' ' ' ILE . . . . . . . . . . . . . 96.1 mt -61.66 88.52 0.04 OUTLIER 'Isoleucine or valine' 0 C--N 1.303 -1.423 0 C-N-CA 119.943 -0.703 . . . . 0.0 110.064 -178.526 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 61.3 ttp180 -111.11 -95.1 0.43 Allowed 'General case' 0 N--CA 1.49 1.536 0 O-C-N 121.678 -0.639 . . . . 0.0 109.39 179.678 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 3.1 pp20? -89.85 148.36 23.23 Favored 'General case' 0 N--CA 1.488 1.458 0 O-C-N 121.481 -0.762 . . . . 0.0 110.563 -179.041 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . 168.33 144.59 4.24 Favored Glycine 0 N--CA 1.486 1.971 0 N-CA-C 109.985 -1.246 . . . . 0.0 109.985 179.198 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 90.5 m-20 -68.99 -17.2 63.89 Favored 'General case' 0 N--CA 1.489 1.493 0 O-C-N 121.554 -0.968 . . . . 0.0 108.998 179.444 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 30' ' ' ASP . . . . . 0.533 ' OD2' ' NZ ' ' A' ' 81' ' ' LYS . 25.9 p-10 -93.75 11.67 28.32 Favored 'General case' 0 N--CA 1.492 1.658 0 O-C-N 121.584 -0.698 . . . . 0.0 109.373 -179.853 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 53.1 t -116.7 135.28 57.54 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.845 0 CA-C-O 121.499 0.666 . . . . 0.0 109.647 -179.381 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -109.01 156.21 20.01 Favored 'General case' 0 N--CA 1.492 1.637 0 N-CA-C 109.191 -0.67 . . . . 0.0 109.191 179.92 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 99.4 mt-10 -107.1 128.15 54.13 Favored 'General case' 0 N--CA 1.496 1.825 0 O-C-N 121.551 -0.718 . . . . 0.0 110.113 -179.111 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 34' ' ' VAL . . . . . . . . . . . . . 53.2 t -123.45 135.17 64.17 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.693 0 O-C-N 121.618 -0.677 . . . . 0.0 109.343 -179.864 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 28.1 p -132.33 142.35 49.31 Favored 'General case' 0 N--CA 1.495 1.781 0 O-C-N 121.518 -0.739 . . . . 0.0 109.273 179.608 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 85.6 mt -125.43 148.9 48.63 Favored 'General case' 0 N--CA 1.496 1.854 0 O-C-N 121.651 -0.656 . . . . 0.0 109.283 179.854 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 37' ' ' PHE . . . . . . . . . . . . . 91.9 m-85 -127.07 144.94 50.9 Favored 'General case' 0 N--CA 1.493 1.686 0 O-C-N 121.757 -0.59 . . . . 0.0 109.588 -179.746 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . 164.86 -156.14 27.93 Favored Glycine 0 N--CA 1.485 1.913 0 N-CA-C 109.926 -1.27 . . . . 0.0 109.926 179.92 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 9.8 m -80.4 -141.53 0.04 OUTLIER 'General case' 0 N--CA 1.49 1.546 0 O-C-N 121.547 -0.972 . . . . 0.0 110.655 -179.325 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 40' ' ' ASP . . . . . 0.443 ' CG ' ' H ' ' A' ' 41' ' ' LYS . 44.9 t0 -54.31 179.0 0.02 OUTLIER 'General case' 0 N--CA 1.488 1.471 0 CA-C-O 121.773 0.797 . . . . 0.0 110.59 -179.008 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 41' ' ' LYS . . . . . 0.443 ' H ' ' CG ' ' A' ' 40' ' ' ASP . 26.9 ttmt -61.28 -39.84 91.91 Favored 'General case' 0 N--CA 1.49 1.566 0 O-C-N 121.702 -0.624 . . . . 0.0 110.378 -179.394 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -47.08 -49.78 21.09 Favored 'General case' 0 N--CA 1.494 1.76 0 O-C-N 121.248 -0.908 . . . . 0.0 110.289 -178.788 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 43' ' ' HIS . . . . . . . . . . . . . 6.0 t60 -61.64 -41.98 98.26 Favored 'General case' 0 N--CA 1.49 1.573 0 O-C-N 121.346 -0.846 . . . . 0.0 109.564 -179.353 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 54.8 mt -63.96 -39.03 93.21 Favored 'General case' 0 N--CA 1.49 1.554 0 O-C-N 121.415 -0.803 . . . . 0.0 109.623 -179.861 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 96.6 mt-10 -58.22 -41.23 83.6 Favored 'General case' 0 N--CA 1.489 1.488 0 O-C-N 121.319 -0.863 . . . . 0.0 109.428 -179.743 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . -62.43 -43.41 99.08 Favored Glycine 0 N--CA 1.489 2.189 0 N-CA-C 109.244 -1.542 . . . . 0.0 109.244 179.972 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 68.6 mttm -65.28 -39.82 93.09 Favored 'General case' 0 N--CA 1.489 1.506 0 O-C-N 121.364 -1.08 . . . . 0.0 109.285 179.466 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 53.5 tp -62.02 -40.37 95.47 Favored 'General case' 0 N--CA 1.489 1.519 0 O-C-N 121.477 -0.764 . . . . 0.0 109.604 -179.545 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 49' ' ' ALA . . . . . . . . . . . . . . . -57.25 -40.84 78.45 Favored 'General case' 0 N--CA 1.49 1.535 0 O-C-N 121.346 -0.846 . . . . 0.0 109.505 -179.156 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 75.4 mt-10 -68.64 -37.41 79.68 Favored 'General case' 0 N--CA 1.489 1.505 0 O-C-N 121.515 -0.741 . . . . 0.0 109.443 179.828 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 3.7 m-85 -61.78 -43.69 98.35 Favored 'General case' 0 N--CA 1.491 1.587 0 O-C-N 121.656 -0.652 . . . . 0.0 109.533 -179.34 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 52' ' ' ILE . . . . . . . . . . . . . 93.3 mt -63.71 -42.96 97.77 Favored 'Isoleucine or valine' 0 C--N 1.302 -1.46 0 N-CA-C 108.892 -0.781 . . . . 0.0 108.892 -179.904 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 25.2 m -49.75 -55.31 14.47 Favored 'General case' 0 N--CA 1.49 1.552 0 O-C-N 121.368 -0.832 . . . . 0.0 109.747 -179.529 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 54' ' ' LEU . . . . . 0.466 ' N ' ' CD2' ' A' ' 54' ' ' LEU . 4.0 mm? -65.17 -38.48 90.67 Favored 'General case' 0 N--CA 1.489 1.512 0 O-C-N 121.438 -0.789 . . . . 0.0 109.101 179.725 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -55.78 -46.82 77.88 Favored 'General case' 0 N--CA 1.488 1.429 0 O-C-N 121.487 -0.758 . . . . 0.0 109.391 -179.517 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 56' ' ' LYS . . . . . . . . . . . . . 66.0 mttm -63.65 -41.3 98.23 Favored 'General case' 0 C--N 1.303 -1.455 0 O-C-N 121.575 -0.703 . . . . 0.0 109.816 179.922 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 98.8 mm-40 -63.12 -47.21 83.75 Favored 'General case' 0 N--CA 1.487 1.417 0 O-C-N 121.448 -0.783 . . . . 0.0 109.607 -179.618 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 58' ' ' VAL . . . . . . . . . . . . . 75.1 t -66.13 -45.16 91.04 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.452 0 O-C-N 121.363 -0.836 . . . . 0.0 109.801 -179.916 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 59' ' ' TYR . . . . . . . . . . . . . 83.4 t80 -140.64 119.83 12.9 Favored 'General case' 0 N--CA 1.496 1.85 0 O-C-N 121.381 -0.825 . . . . 0.0 109.924 -179.528 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -71.66 154.66 41.23 Favored 'General case' 0 N--CA 1.491 1.608 0 O-C-N 121.629 -0.669 . . . . 0.0 110.939 -179.679 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 61' ' ' ASN . . . . . . . . . . . . . 10.4 m120 60.23 35.96 20.89 Favored 'General case' 0 N--CA 1.493 1.68 0 CA-C-O 121.465 0.65 . . . . 0.0 109.286 179.828 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 62' ' ' VAL . . . . . . . . . . . . . 12.4 p -71.89 137.88 22.73 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.491 0 O-C-N 121.548 -0.72 . . . . 0.0 109.912 -179.995 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 84.5 tt0 -113.01 146.04 39.8 Favored 'General case' 0 N--CA 1.492 1.675 0 CA-C-O 121.488 0.661 . . . . 0.0 109.397 -179.768 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 64' ' ' TYR . . . . . . . . . . . . . 53.3 p90 -150.89 162.94 39.82 Favored 'General case' 0 N--CA 1.487 1.413 0 O-C-N 121.295 -0.878 . . . . 0.0 110.047 179.964 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 65' ' ' GLU . . . . . 0.485 ' CD ' ' N ' ' A' ' 66' ' ' VAL . 9.6 tm-20 -142.6 148.8 38.08 Favored 'General case' 0 N--CA 1.489 1.523 0 N-CA-C 108.949 -0.76 . . . . 0.0 108.949 179.5 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 66' ' ' VAL . . . . . 0.485 ' N ' ' CD ' ' A' ' 65' ' ' GLU . 54.5 t -116.41 131.0 70.27 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.55 0 CA-C-O 121.741 0.782 . . . . 0.0 109.846 -179.652 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -84.76 156.65 61.33 Favored Pre-proline 0 C--N 1.306 -1.294 0 N-CA-C 108.811 -0.811 . . . . 0.0 108.811 179.526 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 68' ' ' PRO . . . . . . . . . . . . . 96.6 Cg_exo -43.03 138.72 3.94 Favored 'Trans proline' 0 N--CA 1.493 1.484 0 C-N-CA 122.588 2.192 . . . . 0.0 112.801 179.626 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 69' ' ' VAL . . . . . 0.519 ' C ' ' H ' ' A' ' 71' ' ' ASP . 67.2 t -124.42 134.06 67.71 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.735 0 CA-C-O 121.569 0.699 . . . . 0.0 109.828 -179.448 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 70' ' ' ALA . . . . . 0.655 ' O ' ' N ' ' A' ' 72' ' ' ASN . . . -73.2 35.89 0.08 Allowed 'General case' 0 N--CA 1.487 1.408 0 O-C-N 121.606 -0.684 . . . . 0.0 109.556 179.828 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 71' ' ' ASP . . . . . 0.519 ' H ' ' C ' ' A' ' 69' ' ' VAL . 97.9 m-20 53.39 -73.45 0.01 OUTLIER 'General case' 0 N--CA 1.496 1.827 0 CA-C-O 121.59 0.709 . . . . 0.0 110.059 179.76 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 72' ' ' ASN . . . . . 0.655 ' N ' ' O ' ' A' ' 70' ' ' ALA . 51.7 t30 -86.96 18.41 3.56 Favored 'General case' 0 C--N 1.299 -1.618 0 N-CA-C 108.136 -1.061 . . . . 0.0 108.136 179.492 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 73' ' ' ALA . . . . . 0.536 ' C ' ' H ' ' A' ' 75' ' ' GLU . . . -52.78 -6.96 0.06 Allowed 'General case' 0 N--CA 1.492 1.673 0 N-CA-C 109.274 -0.639 . . . . 0.0 109.274 -179.986 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 74' ' ' THR . . . . . 0.557 ' H ' ' C ' ' A' ' 72' ' ' ASN . 6.1 p 61.96 -4.65 0.18 Allowed 'General case' 0 N--CA 1.492 1.674 0 O-C-N 121.625 -0.672 . . . . 0.0 109.624 -179.866 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 75' ' ' GLU . . . . . 0.536 ' H ' ' C ' ' A' ' 73' ' ' ALA . 22.4 pt-20 -149.08 150.44 32.76 Favored 'General case' 0 N--CA 1.49 1.534 0 O-C-N 121.161 -0.962 . . . . 0.0 109.41 179.404 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 6.2 tt -122.72 129.44 51.78 Favored 'General case' 0 N--CA 1.493 1.704 0 CA-C-O 121.566 0.698 . . . . 0.0 109.49 179.647 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 77' ' ' HIS . . . . . . . . . . . . . 97.7 m-70 -97.87 130.7 44.75 Favored 'General case' 0 N--CA 1.488 1.462 0 O-C-N 121.562 -0.711 . . . . 0.0 109.651 -179.658 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -146.64 153.88 40.82 Favored 'General case' 0 N--CA 1.489 1.498 0 O-C-N 121.37 -0.831 . . . . 0.0 109.582 179.939 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 99.6 mtt180 -129.78 148.02 51.61 Favored 'General case' 0 N--CA 1.491 1.582 0 N-CA-C 109.249 -0.648 . . . . 0.0 109.249 -179.949 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 80' ' ' PHE . . . . . . . . . . . . . 30.1 m-85 -126.12 149.92 48.6 Favored 'General case' 0 N--CA 1.493 1.722 0 O-C-N 121.629 -0.669 . . . . 0.0 109.419 -179.777 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 81' ' ' LYS . . . . . 0.533 ' NZ ' ' OD2' ' A' ' 30' ' ' ASP . 63.9 tttp -105.93 124.04 48.94 Favored 'General case' 0 N--CA 1.491 1.58 0 O-C-N 121.548 -0.72 . . . . 0.0 109.323 -179.969 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 82' ' ' PHE . . . . . 0.405 ' CD1' ' OE2' ' A' ' 87' ' ' GLU . 62.2 m-85 -124.95 144.52 50.31 Favored 'General case' 0 N--CA 1.493 1.675 0 CA-C-O 121.594 0.711 . . . . 0.0 109.56 -179.876 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 83.9 tt0 -67.03 -29.22 68.98 Favored 'General case' 0 N--CA 1.488 1.429 0 O-C-N 121.61 -0.681 . . . . 0.0 109.8 -179.627 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 84' ' ' VAL . . . . . . . . . . . . . 35.0 m -131.51 150.37 34.08 Favored 'Isoleucine or valine' 0 N--CA 1.499 2.015 0 CA-C-O 121.832 0.825 . . . . 0.0 110.37 -179.483 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 36.9 m -72.6 -32.29 65.85 Favored 'General case' 0 N--CA 1.49 1.528 0 CA-C-O 121.451 0.643 . . . . 0.0 109.586 179.939 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 86' ' ' ALA . . . . . . . . . . . . . . . -54.36 -34.98 62.27 Favored 'General case' 0 N--CA 1.489 1.514 0 O-C-N 121.299 -0.875 . . . . 0.0 108.79 -179.669 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 87' ' ' GLU . . . . . 0.405 ' OE2' ' CD1' ' A' ' 82' ' ' PHE . 80.4 tt0 -65.33 -32.17 73.69 Favored 'General case' 0 C--N 1.303 -1.437 0 N-CA-C 109.096 -0.705 . . . . 0.0 109.096 179.765 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 88' ' ' LYS . . . . . . . . . . . . . 88.8 tttt -63.2 -44.33 95.67 Favored 'General case' 0 N--CA 1.49 1.551 0 O-C-N 121.373 -0.829 . . . . 0.0 109.39 179.975 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 93.9 mt -62.05 -49.27 76.67 Favored 'General case' 0 N--CA 1.491 1.607 0 O-C-N 121.39 -0.818 . . . . 0.0 110.145 -179.217 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 90' ' ' ILE . . . . . 0.501 ' CD1' ' N ' ' A' ' 90' ' ' ILE . 1.4 mp -70.32 -42.11 78.65 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.582 0 O-C-N 121.366 -0.834 . . . . 0.0 109.403 -179.971 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 91' ' ' PHE . . . . . . . . . . . . . 70.3 t80 -57.45 -45.85 84.27 Favored 'General case' 0 C--N 1.303 -1.445 0 O-C-N 121.406 -0.809 . . . . 0.0 108.886 -179.137 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 92' ' ' GLU . . . . . . . . . . . . . 98.1 mt-10 -68.23 -33.58 74.66 Favored 'General case' 0 C--N 1.301 -1.506 0 N-CA-C 109.116 -0.698 . . . . 0.0 109.116 179.263 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 93' ' ' LEU . . . . . . . . . . . . . 59.0 tp -62.82 -43.19 99.46 Favored 'General case' 0 N--CA 1.488 1.459 0 O-C-N 121.496 -0.753 . . . . 0.0 109.401 -179.736 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 94' ' ' LYS . . . . . . . . . . . . . 67.2 mmtt -65.25 -42.5 93.27 Favored 'General case' 0 N--CA 1.487 1.407 0 O-C-N 121.468 -0.77 . . . . 0.0 109.735 -179.581 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 18.0 p -66.11 -43.06 88.28 Favored 'General case' 0 N--CA 1.488 1.454 0 O-C-N 121.253 -0.904 . . . . 0.0 109.497 -179.732 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 96' ' ' ARG . . . . . . . . . . . . . 17.3 tpp180 -62.61 -44.76 95.49 Favored 'General case' 0 N--CA 1.487 1.388 0 O-C-N 121.305 -0.872 . . . . 0.0 109.396 -179.81 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 97' ' ' ALA . . . . . . . . . . . . . . . -62.81 -40.05 96.18 Favored 'General case' 0 N--CA 1.488 1.434 0 N-CA-C 108.778 -0.823 . . . . 0.0 108.778 -179.835 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 98' ' ' LEU . . . . . . . . . . . . . 6.5 tt -63.6 -43.39 97.06 Favored 'General case' 0 C--N 1.301 -1.535 0 CA-C-O 121.683 0.754 . . . . 0.0 109.027 179.558 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 99' ' ' ALA . . . . . . . . . . . . . . . -66.31 -36.17 82.25 Favored 'General case' 0 N--CA 1.489 1.511 0 O-C-N 121.775 -0.578 . . . . 0.0 109.594 -179.793 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 100' ' ' ARG . . . . . 0.541 ' O ' ' N ' ' A' ' 102' ' ' GLU . 99.8 mtt180 -78.3 -8.81 58.84 Favored 'General case' 0 N--CA 1.486 1.373 0 O-C-N 121.536 -0.728 . . . . 0.0 109.18 -179.626 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 101' ' ' LEU . . . . . . . . . . . . . 88.8 mt 42.55 -90.13 0.01 OUTLIER 'General case' 0 N--CA 1.492 1.656 0 CA-C-O 121.512 0.672 . . . . 0.0 110.589 179.625 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 102' ' ' GLU . . . . . 0.541 ' N ' ' O ' ' A' ' 100' ' ' ARG . 79.8 mm-40 -53.49 142.91 20.88 Favored 'General case' 0 N--CA 1.487 1.385 0 CA-C-O 121.837 0.827 . . . . 0.0 110.657 -178.698 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 103' ' ' HIS . . . . . . . . . . . . . 99.1 m-70 -76.09 145.29 40.16 Favored 'General case' 0 N--CA 1.487 1.395 0 CA-C-O 121.57 0.7 . . . . 0.0 110.777 -179.248 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 104' ' ' HIS . . . . . . . . . . . . . 77.3 m-70 60.99 85.17 0.12 Allowed 'General case' 0 N--CA 1.49 1.569 0 CA-C-O 121.527 0.679 . . . . 0.0 110.0 179.559 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 105' ' ' HIS . . . . . . . . . . . . . 71.6 t60 -74.23 -7.8 53.99 Favored 'General case' 0 N--CA 1.487 1.423 0 N-CA-C 108.899 -0.778 . . . . 0.0 108.899 179.553 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 106' ' ' HIS . . . . . . . . . . . . . 94.9 m-70 -71.87 136.35 46.92 Favored 'General case' 0 N--CA 1.487 1.424 0 O-C-N 121.495 -0.753 . . . . 0.0 109.973 -179.451 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 107' ' ' HIS . . . . . 0.484 ' O ' ' ND1' ' A' ' 108' ' ' HIS . 78.8 m80 -86.77 122.32 30.5 Favored 'General case' 0 N--CA 1.488 1.472 0 O-C-N 121.555 -0.716 . . . . 0.0 109.938 -179.613 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 108' ' ' HIS . . . . . 0.484 ' ND1' ' O ' ' A' ' 107' ' ' HIS . 61.3 m80 . . . . . 0 N--CA 1.487 1.412 0 CA-C-O 118.008 -0.996 . . . . 0.0 108.895 179.755 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 1' ' ' MET . . . . . 0.539 ' O ' ' N ' ' A' ' 3' ' ' ASN . 2.6 mpt? . . . . . 0 N--CA 1.491 1.62 0 N-CA-C 109.772 -0.455 . . . . 0.0 109.772 . . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 2' ' ' SER . . . . . 0.425 ' C ' ' O ' ' A' ' 1' ' ' MET . 30.5 t 35.19 -88.75 0.01 OUTLIER 'General case' 0 N--CA 1.501 2.092 0 CA-C-O 121.157 0.503 . . . . 0.0 110.849 -179.7 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 3' ' ' ASN . . . . . 0.539 ' N ' ' O ' ' A' ' 1' ' ' MET . 37.5 t30 41.95 -110.92 0.14 Allowed 'General case' 0 N--CA 1.492 1.637 0 O-C-N 121.48 -0.762 . . . . 0.0 110.56 179.953 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 4' ' ' GLN . . . . . 0.455 ' N ' ' CG ' ' A' ' 3' ' ' ASN . 95.3 mt-30 -82.35 -88.56 0.09 Allowed 'General case' 0 N--CA 1.488 1.429 0 O-C-N 121.391 -0.818 . . . . 0.0 110.191 -179.263 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 31.3 m -65.28 133.65 51.91 Favored 'General case' 0 N--CA 1.49 1.555 0 O-C-N 121.336 -0.852 . . . . 0.0 110.641 -178.835 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 13.1 p -148.05 43.09 1.05 Allowed 'General case' 0 N--CA 1.488 1.474 0 N-CA-C 108.706 -0.849 . . . . 0.0 108.706 179.331 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 7' ' ' VAL . . . . . . . . . . . . . 53.9 t -107.64 129.88 60.88 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.941 0 O-C-N 121.544 -0.722 . . . . 0.0 109.142 -179.937 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 8' ' ' GLU . . . . . 0.471 ' O ' ' CB ' ' A' ' 9' ' ' ASN . 18.9 pt-20 -173.61 139.0 0.7 Allowed 'General case' 0 N--CA 1.487 1.414 0 N-CA-C 108.723 -0.843 . . . . 0.0 108.723 179.597 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 9' ' ' ASN . . . . . 0.471 ' CB ' ' O ' ' A' ' 8' ' ' GLU . 33.3 t30 77.7 -45.52 0.44 Allowed 'General case' 0 N--CA 1.494 1.772 0 N-CA-C 109.144 -0.687 . . . . 0.0 109.144 -179.377 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 10' ' ' GLU . . . . . 0.539 ' O ' ' N ' ' A' ' 12' ' ' CYS . 17.0 mp0 -72.34 147.9 45.85 Favored 'General case' 0 C--N 1.303 -1.42 0 O-C-N 121.361 -0.837 . . . . 0.0 110.307 -179.208 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 12.8 t 60.54 -68.94 0.09 OUTLIER 'Isoleucine or valine' 0 N--CA 1.494 1.771 0 CA-C-O 121.186 0.517 . . . . 0.0 109.947 -179.979 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 12' ' ' CYS . . . . . 0.539 ' N ' ' O ' ' A' ' 10' ' ' GLU . 12.8 t -68.75 136.08 52.26 Favored 'General case' 0 N--CA 1.489 1.511 0 O-C-N 121.111 -0.993 . . . . 0.0 110.36 -179.296 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 96.3 mt-10 -52.85 142.46 19.09 Favored 'General case' 0 N--CA 1.496 1.863 0 CA-C-O 121.584 0.706 . . . . 0.0 111.439 -179.169 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -86.24 -74.01 0.43 Allowed 'General case' 0 N--CA 1.491 1.592 0 O-C-N 121.751 -0.593 . . . . 0.0 109.55 179.456 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 74.2 m -82.55 145.71 29.6 Favored 'General case' 0 N--CA 1.491 1.619 0 O-C-N 121.224 -0.923 . . . . 0.0 110.482 -179.068 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . -63.44 167.86 22.85 Favored Glycine 0 N--CA 1.491 2.342 0 N-CA-C 111.197 -0.761 . . . . 0.0 111.197 -179.107 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 38.4 t -72.52 135.9 45.76 Favored 'General case' 0 N--CA 1.489 1.499 0 O-C-N 121.666 -0.902 . . . . 0.0 110.348 -179.59 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -65.66 145.69 55.72 Favored 'General case' 0 N--CA 1.491 1.622 0 CA-C-O 121.541 0.686 . . . . 0.0 111.067 -179.218 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 83.36 19.37 62.47 Favored Glycine 0 N--CA 1.491 2.336 0 N-CA-C 109.193 -1.563 . . . . 0.0 109.193 179.797 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 50.8 tp10 -68.51 125.06 25.29 Favored 'General case' 0 N--CA 1.488 1.429 0 O-C-N 121.282 -1.128 . . . . 0.0 110.217 -179.211 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 21' ' ' ILE . . . . . . . . . . . . . 33.4 pt -96.14 -7.56 9.6 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.64 0 O-C-N 121.63 -0.669 . . . . 0.0 109.345 179.324 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 118.08 164.52 13.13 Favored Glycine 0 N--CA 1.499 2.882 0 N-CA-C 109.936 -1.266 . . . . 0.0 109.936 179.541 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 23' ' ' PHE . . . . . . . . . . . . . 77.1 t80 -113.35 136.08 53.15 Favored 'General case' 0 N--CA 1.497 1.888 0 O-C-N 121.772 -0.84 . . . . 0.0 109.841 -179.824 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 4.0 pt -78.44 151.43 5.21 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.492 0 CA-C-O 121.687 0.756 . . . . 0.0 110.617 -179.522 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 25' ' ' ILE . . . . . . . . . . . . . 96.7 mt 56.91 93.79 0.04 OUTLIER 'Isoleucine or valine' 0 N--CA 1.488 1.461 0 CA-C-O 121.452 0.644 . . . . 0.0 110.169 179.659 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 22.2 mmm180 -77.16 153.25 34.36 Favored 'General case' 0 N--CA 1.489 1.522 0 CA-C-O 121.644 0.735 . . . . 0.0 109.933 -179.683 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 27' ' ' GLU . . . . . 0.417 ' OE1' ' N ' ' A' ' 27' ' ' GLU . 60.0 mp0 -61.54 142.57 56.98 Favored 'General case' 0 N--CA 1.49 1.539 0 O-C-N 121.397 -0.814 . . . . 0.0 110.547 -178.981 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . -176.79 -170.25 39.07 Favored Glycine 0 N--CA 1.489 2.23 0 N-CA-C 110.05 -1.22 . . . . 0.0 110.05 179.837 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 29' ' ' ASP . . . . . 0.544 ' OD1' ' N ' ' A' ' 30' ' ' ASP . 49.6 p-10 -67.51 -31.4 71.49 Favored 'General case' 0 N--CA 1.494 1.765 0 O-C-N 121.454 -1.027 . . . . 0.0 110.315 -179.64 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 30' ' ' ASP . . . . . 0.544 ' N ' ' OD1' ' A' ' 29' ' ' ASP . 90.7 m-20 -82.14 2.59 30.72 Favored 'General case' 0 C--N 1.302 -1.46 0 O-C-N 121.019 -1.05 . . . . 0.0 109.651 -179.401 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 51.1 t -119.92 133.85 65.33 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.958 0 O-C-N 121.616 -0.678 . . . . 0.0 109.29 -179.828 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -126.65 149.45 49.51 Favored 'General case' 0 N--CA 1.494 1.766 0 CA-C-O 121.505 0.669 . . . . 0.0 109.603 -179.646 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 17.3 pt-20 -91.54 140.14 30.03 Favored 'General case' 0 N--CA 1.49 1.548 0 O-C-N 121.565 -0.709 . . . . 0.0 109.929 -179.577 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 34' ' ' VAL . . . . . . . . . . . . . 48.4 t -130.16 135.42 60.91 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.793 0 N-CA-C 108.566 -0.901 . . . . 0.0 108.566 179.293 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 44.8 t -134.96 142.71 46.55 Favored 'General case' 0 N--CA 1.493 1.709 0 N-CA-C 109.196 -0.668 . . . . 0.0 109.196 179.877 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 76.7 mt -119.72 156.75 29.93 Favored 'General case' 0 N--CA 1.498 1.963 0 N-CA-C 109.256 -0.646 . . . . 0.0 109.256 -179.743 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 37' ' ' PHE . . . . . . . . . . . . . 92.4 m-85 -119.48 138.82 52.9 Favored 'General case' 0 N--CA 1.494 1.772 0 N-CA-C 109.445 -0.576 . . . . 0.0 109.445 -179.582 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . -178.14 -175.62 45.43 Favored Glycine 0 N--CA 1.486 2.028 0 N-CA-C 109.781 -1.328 . . . . 0.0 109.781 -179.908 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 39' ' ' SER . . . . . 0.495 ' OG ' ' N ' ' A' ' 40' ' ' ASP . 93.7 p -98.93 -77.39 0.52 Allowed 'General case' 0 N--CA 1.494 1.739 0 O-C-N 121.643 -0.916 . . . . 0.0 109.637 179.89 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 40' ' ' ASP . . . . . 0.543 ' OD1' ' N ' ' A' ' 41' ' ' LYS . 58.3 t0 -80.59 156.44 26.43 Favored 'General case' 0 N--CA 1.49 1.558 0 O-C-N 121.322 -0.861 . . . . 0.0 110.015 -179.169 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 41' ' ' LYS . . . . . 0.543 ' N ' ' OD1' ' A' ' 40' ' ' ASP . 4.5 tmtt? -62.26 -42.13 99.06 Favored 'General case' 0 N--CA 1.488 1.44 0 O-C-N 121.316 -0.865 . . . . 0.0 109.757 -179.306 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -55.7 -41.19 73.42 Favored 'General case' 0 N--CA 1.492 1.628 0 O-C-N 120.984 -1.072 . . . . 0.0 110.291 -179.038 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 43' ' ' HIS . . . . . . . . . . . . . 82.0 t60 -61.24 -42.39 98.53 Favored 'General case' 0 C--N 1.301 -1.536 0 O-C-N 121.135 -0.978 . . . . 0.0 109.537 -179.78 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 84.0 mt -63.4 -40.06 96.19 Favored 'General case' 0 N--CA 1.49 1.534 0 O-C-N 121.346 -0.846 . . . . 0.0 109.838 -179.775 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 96.5 mt-10 -60.83 -37.22 81.29 Favored 'General case' 0 C--N 1.301 -1.516 0 O-C-N 121.197 -0.94 . . . . 0.0 109.139 179.874 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . -62.16 -42.87 99.73 Favored Glycine 0 N--CA 1.489 2.202 0 N-CA-C 109.341 -1.504 . . . . 0.0 109.341 179.855 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 54.9 mtpt -65.48 -36.61 84.39 Favored 'General case' 0 N--CA 1.488 1.454 0 O-C-N 121.312 -1.111 . . . . 0.0 109.577 179.421 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 57.5 tp -60.89 -40.41 92.94 Favored 'General case' 0 N--CA 1.489 1.485 0 O-C-N 121.497 -0.752 . . . . 0.0 109.593 -179.109 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 49' ' ' ALA . . . . . . . . . . . . . . . -56.11 -42.41 76.8 Favored 'General case' 0 C--N 1.302 -1.491 0 O-C-N 121.178 -0.951 . . . . 0.0 109.433 -179.352 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 97.3 mt-10 -66.48 -39.13 88.59 Favored 'General case' 0 C--N 1.302 -1.488 0 O-C-N 121.467 -0.771 . . . . 0.0 109.512 179.834 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 51' ' ' TYR . . . . . 0.506 ' CE2' ' CG2' ' A' ' 95' ' ' THR . 4.3 m-85 -62.2 -40.77 97.19 Favored 'General case' 0 N--CA 1.491 1.598 0 O-C-N 121.519 -0.738 . . . . 0.0 109.638 -179.527 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 52' ' ' ILE . . . . . . . . . . . . . 96.8 mt -63.27 -42.61 97.04 Favored 'Isoleucine or valine' 0 C--N 1.298 -1.641 0 O-C-N 121.364 -0.835 . . . . 0.0 109.402 -179.671 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 66.6 m -57.82 -49.99 74.77 Favored 'General case' 0 N--CA 1.491 1.586 0 O-C-N 121.18 -0.95 . . . . 0.0 110.642 -179.022 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 54' ' ' LEU . . . . . 0.424 ' N ' ' CD2' ' A' ' 54' ' ' LEU . 4.2 mm? -66.05 -41.16 91.2 Favored 'General case' 0 N--CA 1.493 1.683 0 O-C-N 121.05 -1.031 . . . . 0.0 109.495 179.732 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -64.25 -39.14 93.34 Favored 'General case' 0 C--N 1.301 -1.516 0 O-C-N 121.46 -0.775 . . . . 0.0 109.476 -179.512 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 56' ' ' LYS . . . . . . . . . . . . . 88.8 tttt -64.05 -43.98 93.87 Favored 'General case' 0 C--N 1.304 -1.4 0 O-C-N 121.418 -0.801 . . . . 0.0 110.076 -179.478 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 15.5 mm100 -66.54 -41.64 88.41 Favored 'General case' 0 N--CA 1.489 1.497 0 O-C-N 121.236 -0.915 . . . . 0.0 109.635 -179.624 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 58' ' ' VAL . . . . . 0.469 ' CG1' ' OE1' ' A' ' 87' ' ' GLU . 74.7 t -64.92 -45.3 95.21 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.507 0 O-C-N 121.424 -0.797 . . . . 0.0 110.626 -179.27 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 59' ' ' TYR . . . . . . . . . . . . . 83.5 t80 -127.86 129.93 47.74 Favored 'General case' 0 N--CA 1.499 2.0 0 O-C-N 121.499 -0.751 . . . . 0.0 110.111 -178.898 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 60' ' ' ALA . . . . . 0.441 ' O ' ' CG ' ' A' ' 61' ' ' ASN . . . -68.51 154.99 40.81 Favored 'General case' 0 N--CA 1.489 1.478 0 O-C-N 121.59 -0.693 . . . . 0.0 110.234 -179.787 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 61' ' ' ASN . . . . . 0.441 ' CG ' ' O ' ' A' ' 60' ' ' ALA . 12.9 p30 45.4 58.31 4.27 Favored 'General case' 0 N--CA 1.493 1.724 0 CA-C-O 121.749 0.785 . . . . 0.0 109.347 -179.744 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 62' ' ' VAL . . . . . . . . . . . . . 14.7 p -74.09 136.5 25.15 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.458 0 CA-C-O 121.48 0.657 . . . . 0.0 110.211 -179.508 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 96.9 mt-10 -124.44 140.05 53.31 Favored 'General case' 0 N--CA 1.492 1.661 0 N-CA-C 109.248 -0.649 . . . . 0.0 109.248 179.826 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 64' ' ' TYR . . . . . . . . . . . . . 50.7 p90 -149.93 161.79 41.62 Favored 'General case' 0 C--N 1.303 -1.444 0 O-C-N 121.447 -0.783 . . . . 0.0 109.132 -179.854 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 49.4 tp10 -142.57 147.03 35.22 Favored 'General case' 0 N--CA 1.491 1.599 0 N-CA-C 108.66 -0.867 . . . . 0.0 108.66 179.694 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 66' ' ' VAL . . . . . . . . . . . . . 75.5 t -117.45 128.39 74.72 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.699 0 O-C-N 121.763 -0.586 . . . . 0.0 109.563 -179.85 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -81.84 168.29 25.14 Favored Pre-proline 0 N--CA 1.489 1.487 0 O-C-N 121.533 -0.729 . . . . 0.0 109.158 -179.878 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 68' ' ' PRO . . . . . . . . . . . . . 51.1 Cg_exo -53.36 131.7 44.7 Favored 'Trans proline' 0 N--CA 1.497 1.717 0 C-N-CA 122.198 1.932 . . . . 0.0 112.537 179.588 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 69' ' ' VAL . . . . . . . . . . . . . 54.4 t -133.75 136.68 53.8 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.872 0 O-C-N 121.613 -0.679 . . . . 0.0 109.632 179.58 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -67.83 150.64 48.34 Favored 'General case' 0 N--CA 1.49 1.534 0 O-C-N 121.54 -0.725 . . . . 0.0 110.489 -179.694 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 96.8 m-20 -63.08 -37.16 86.1 Favored 'General case' 0 N--CA 1.492 1.669 0 O-C-N 121.426 -0.796 . . . . 0.0 109.979 179.904 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 72' ' ' ASN . . . . . . . . . . . . . 20.2 t-20 -86.64 9.33 18.97 Favored 'General case' 0 N--CA 1.493 1.677 0 O-C-N 121.296 -0.877 . . . . 0.0 108.891 -179.916 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -63.24 142.92 58.2 Favored 'General case' 0 N--CA 1.489 1.505 0 O-C-N 121.412 -0.805 . . . . 0.0 110.157 -179.465 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 74' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -105.84 5.54 30.83 Favored 'General case' 0 N--CA 1.493 1.686 0 N-CA-C 108.405 -0.961 . . . . 0.0 108.405 179.245 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 96.8 mt-10 -141.96 160.49 40.1 Favored 'General case' 0 N--CA 1.496 1.835 0 O-C-N 121.402 -0.811 . . . . 0.0 109.141 179.372 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 6.6 tp -129.1 134.09 47.93 Favored 'General case' 0 N--CA 1.496 1.868 0 O-C-N 121.669 -0.645 . . . . 0.0 109.349 179.912 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 77' ' ' HIS . . . . . . . . . . . . . 77.7 m80 -104.94 124.07 48.85 Favored 'General case' 0 N--CA 1.494 1.726 0 CA-C-O 121.425 0.631 . . . . 0.0 109.587 179.688 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -150.66 162.17 41.2 Favored 'General case' 0 N--CA 1.488 1.469 0 O-C-N 121.492 -0.755 . . . . 0.0 109.019 -179.995 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 84.4 mtt85 -128.89 149.54 50.73 Favored 'General case' 0 N--CA 1.493 1.711 0 N-CA-C 109.114 -0.698 . . . . 0.0 109.114 179.872 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 80' ' ' PHE . . . . . . . . . . . . . 34.4 m-85 -128.14 152.1 48.43 Favored 'General case' 0 N--CA 1.494 1.734 0 O-C-N 121.665 -0.647 . . . . 0.0 109.452 -179.821 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 65.7 tttm -107.81 140.21 41.24 Favored 'General case' 0 N--CA 1.492 1.653 0 CA-C-O 121.324 0.583 . . . . 0.0 109.924 -179.373 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 82' ' ' PHE . . . . . . . . . . . . . 82.7 m-85 -141.67 -164.6 1.81 Allowed 'General case' 0 N--CA 1.492 1.67 0 O-C-N 121.52 -0.738 . . . . 0.0 109.404 179.896 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 83.0 tt0 -100.46 -50.56 3.87 Favored 'General case' 0 N--CA 1.492 1.632 0 O-C-N 121.607 -0.683 . . . . 0.0 109.285 179.806 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 84' ' ' VAL . . . . . . . . . . . . . 2.5 m -134.72 164.88 32.82 Favored 'Isoleucine or valine' 0 N--CA 1.499 2.001 0 O-C-N 121.451 -0.781 . . . . 0.0 110.311 -179.534 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 38.1 t -61.87 -19.05 62.21 Favored 'General case' 0 N--CA 1.489 1.523 0 O-C-N 121.755 -0.591 . . . . 0.0 109.61 -179.908 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 86' ' ' ALA . . . . . . . . . . . . . . . -61.45 -37.21 82.73 Favored 'General case' 0 N--CA 1.489 1.487 0 O-C-N 121.241 -0.912 . . . . 0.0 109.618 -179.899 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 87' ' ' GLU . . . . . 0.469 ' OE1' ' CG1' ' A' ' 58' ' ' VAL . 79.6 mm-40 -66.61 -34.99 79.11 Favored 'General case' 0 N--CA 1.49 1.556 0 O-C-N 121.315 -0.865 . . . . 0.0 109.386 -179.916 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 88' ' ' LYS . . . . . . . . . . . . . 88.7 tttt -62.85 -46.48 87.71 Favored 'General case' 0 N--CA 1.49 1.552 0 O-C-N 121.328 -0.858 . . . . 0.0 109.628 -179.791 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 87.1 mt -63.26 -44.38 95.3 Favored 'General case' 0 N--CA 1.488 1.468 0 O-C-N 121.346 -0.846 . . . . 0.0 109.409 -179.669 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 90' ' ' ILE . . . . . . . . . . . . . 97.0 mt -66.55 -45.15 89.47 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.461 0 O-C-N 121.34 -0.85 . . . . 0.0 109.791 -179.954 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 91' ' ' PHE . . . . . . . . . . . . . 86.2 t80 -64.4 -43.41 94.53 Favored 'General case' 0 N--CA 1.489 1.484 0 O-C-N 121.477 -0.764 . . . . 0.0 109.78 -179.919 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 92' ' ' GLU . . . . . . . . . . . . . 47.6 tp10 -59.21 -39.24 82.04 Favored 'General case' 0 N--CA 1.488 1.46 0 O-C-N 121.409 -0.807 . . . . 0.0 108.887 -179.36 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 93' ' ' LEU . . . . . . . . . . . . . 5.5 tt -62.96 -43.56 98.47 Favored 'General case' 0 C--N 1.301 -1.529 0 O-C-N 121.434 -0.792 . . . . 0.0 109.633 179.928 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 94' ' ' LYS . . . . . . . . . . . . . 99.2 mttt -64.68 -40.83 96.07 Favored 'General case' 0 N--CA 1.489 1.482 0 O-C-N 121.529 -0.732 . . . . 0.0 109.428 -179.795 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 95' ' ' THR . . . . . 0.506 ' CG2' ' CE2' ' A' ' 51' ' ' TYR . 21.1 p -64.84 -42.97 94.49 Favored 'General case' 0 N--CA 1.49 1.534 0 O-C-N 121.317 -0.864 . . . . 0.0 109.304 -179.914 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 96' ' ' ARG . . . . . . . . . . . . . 89.4 mtm180 -63.81 -38.69 92.03 Favored 'General case' 0 N--CA 1.488 1.441 0 O-C-N 121.467 -0.771 . . . . 0.0 109.136 179.483 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 97' ' ' ALA . . . . . . . . . . . . . . . -65.97 -44.72 84.13 Favored 'General case' 0 N--CA 1.488 1.473 0 O-C-N 121.369 -0.832 . . . . 0.0 109.686 -179.931 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 98' ' ' LEU . . . . . . . . . . . . . 83.5 mt -64.78 -43.31 93.65 Favored 'General case' 0 N--CA 1.49 1.556 0 O-C-N 121.245 -0.91 . . . . 0.0 109.41 -179.985 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 99' ' ' ALA . . . . . . . . . . . . . . . -70.95 -51.75 23.97 Favored 'General case' 0 C--N 1.302 -1.482 0 O-C-N 121.411 -0.805 . . . . 0.0 109.975 -179.623 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 100' ' ' ARG . . . . . . . . . . . . . 46.1 mmm-85 -68.03 -39.25 83.14 Favored 'General case' 0 C--N 1.302 -1.476 0 O-C-N 121.44 -0.787 . . . . 0.0 109.535 -179.33 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 101' ' ' LEU . . . . . . . . . . . . . 12.6 tp 41.67 58.58 2.72 Favored 'General case' 0 N--CA 1.491 1.612 0 O-C-N 121.653 -0.655 . . . . 0.0 109.921 -179.71 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 102' ' ' GLU . . . . . . . . . . . . . 80.6 mm-40 -105.95 87.23 2.53 Favored 'General case' 0 N--CA 1.498 1.93 0 O-C-N 121.497 -0.752 . . . . 0.0 109.345 179.989 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 103' ' ' HIS . . . . . 0.675 ' HD1' ' HD1' ' A' ' 104' ' ' HIS . 11.7 t-160 -86.03 -107.54 0.05 Allowed 'General case' 0 N--CA 1.49 1.571 0 O-C-N 121.501 -0.749 . . . . 0.0 109.412 179.926 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 104' ' ' HIS . . . . . 0.675 ' HD1' ' HD1' ' A' ' 103' ' ' HIS . 51.2 p-80 -86.58 12.78 9.72 Favored 'General case' 0 N--CA 1.487 1.379 0 N-CA-C 108.717 -0.845 . . . . 0.0 108.717 179.641 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 105' ' ' HIS . . . . . 0.514 ' HD1' ' H ' ' A' ' 103' ' ' HIS . 79.3 m80 -59.09 -41.22 87.54 Favored 'General case' 0 C--N 1.305 -1.361 0 N-CA-C 108.588 -0.893 . . . . 0.0 108.588 179.577 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 106' ' ' HIS . . . . . . . . . . . . . 51.9 t-80 43.4 43.2 4.22 Favored 'General case' 0 N--CA 1.491 1.621 0 CA-C-O 121.524 0.678 . . . . 0.0 109.466 -179.786 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 107' ' ' HIS . . . . . . . . . . . . . 84.0 t60 -141.81 137.31 31.41 Favored 'General case' 0 N--CA 1.491 1.622 0 O-C-N 121.415 -0.803 . . . . 0.0 109.38 -179.929 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 108' ' ' HIS . . . . . 0.439 ' O ' ' CG ' ' A' ' 108' ' ' HIS . 86.0 t60 . . . . . 0 N--CA 1.488 1.468 0 CA-C-O 117.882 -1.056 . . . . 0.0 110.159 -179.647 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 1' ' ' MET . . . . . 0.6 ' SD ' ' N ' ' A' ' 1' ' ' MET . 0.0 OUTLIER . . . . . 0 N--CA 1.49 1.572 0 N-CA-C 108.713 -0.847 . . . . 0.0 108.713 . . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 22.0 m -149.76 150.67 32.39 Favored 'General case' 0 N--CA 1.489 1.502 0 O-C-N 121.284 -0.885 . . . . 0.0 109.51 179.715 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 3' ' ' ASN . . . . . . . . . . . . . 57.4 t-20 -89.08 108.57 19.67 Favored 'General case' 0 N--CA 1.49 1.555 0 O-C-N 121.406 -0.809 . . . . 0.0 109.603 -179.716 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 5.3 tp-100 -158.24 -38.26 0.07 Allowed 'General case' 0 N--CA 1.49 1.533 0 N-CA-C 108.654 -0.869 . . . . 0.0 108.654 179.677 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 4.0 p -93.63 -6.06 47.31 Favored 'General case' 0 N--CA 1.493 1.681 0 N-CA-C 108.854 -0.795 . . . . 0.0 108.854 179.866 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 90.5 m -65.12 -37.7 88.31 Favored 'General case' 0 N--CA 1.488 1.453 0 O-C-N 121.502 -0.749 . . . . 0.0 109.032 179.634 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 7' ' ' VAL . . . . . . . . . . . . . 33.8 m -76.09 138.97 19.7 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.569 0 O-C-N 121.569 -0.707 . . . . 0.0 110.262 -179.268 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 17.6 pt-20 -60.99 142.19 56.75 Favored 'General case' 0 N--CA 1.491 1.595 0 CA-C-O 121.66 0.743 . . . . 0.0 110.716 -179.337 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 9' ' ' ASN . . . . . 0.539 ' CG ' ' H ' ' A' ' 10' ' ' GLU . 11.9 p-10 -85.51 -101.25 0.06 Allowed 'General case' 0 N--CA 1.49 1.557 0 O-C-N 121.596 -0.69 . . . . 0.0 110.321 -179.873 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 10' ' ' GLU . . . . . 0.539 ' H ' ' CG ' ' A' ' 9' ' ' ASN . 79.7 mm-40 -62.98 148.39 47.77 Favored 'General case' 0 N--CA 1.489 1.476 0 O-C-N 121.426 -0.796 . . . . 0.0 110.688 -178.719 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 64.1 t -94.77 128.1 46.24 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.553 0 O-C-N 121.615 -0.678 . . . . 0.0 109.353 -179.845 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 25.0 p -166.81 145.55 5.29 Favored 'General case' 0 N--CA 1.488 1.457 0 O-C-N 121.418 -0.801 . . . . 0.0 109.291 179.553 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 13' ' ' GLU . . . . . 0.555 ' OE1' ' N ' ' A' ' 13' ' ' GLU . 56.7 mp0 -92.27 122.54 34.84 Favored 'General case' 0 N--CA 1.49 1.573 0 O-C-N 121.37 -0.831 . . . . 0.0 109.846 -179.369 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -68.26 141.55 55.86 Favored 'General case' 0 N--CA 1.489 1.504 0 O-C-N 121.58 -0.7 . . . . 0.0 110.266 -179.583 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 71.6 m -146.95 -62.1 0.29 Allowed 'General case' 0 N--CA 1.491 1.587 0 O-C-N 121.562 -0.712 . . . . 0.0 109.178 179.715 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . -70.44 142.48 35.57 Favored Glycine 0 N--CA 1.491 2.307 0 N-CA-C 110.893 -0.883 . . . . 0.0 110.893 -179.192 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 1.6 p -67.54 -35.52 79.22 Favored 'General case' 0 N--CA 1.491 1.581 0 O-C-N 121.545 -0.974 . . . . 0.0 109.333 179.388 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -60.86 142.41 56.24 Favored 'General case' 0 N--CA 1.489 1.488 0 O-C-N 121.406 -0.809 . . . . 0.0 110.481 -178.876 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -84.1 2.63 87.45 Favored Glycine 0 N--CA 1.49 2.235 0 N-CA-C 109.232 -1.547 . . . . 0.0 109.232 179.759 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 79.0 mm-40 -56.36 132.78 51.98 Favored 'General case' 0 N--CA 1.49 1.558 0 O-C-N 121.349 -1.089 . . . . 0.0 109.953 -179.291 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 21' ' ' ILE . . . . . . . . . . . . . 91.0 mt -104.96 129.09 58.15 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.632 0 O-C-N 121.697 -0.627 . . . . 0.0 109.833 -179.896 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . -178.33 168.77 40.15 Favored Glycine 0 N--CA 1.485 1.916 0 N-CA-C 109.645 -1.382 . . . . 0.0 109.645 179.834 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 23' ' ' PHE . . . . . 0.423 ' CD1' ' O ' ' A' ' 23' ' ' PHE . 52.5 p90 -113.05 133.71 54.86 Favored 'General case' 0 N--CA 1.492 1.656 0 O-C-N 121.74 -0.859 . . . . 0.0 109.219 179.828 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 24' ' ' ILE . . . . . 0.431 ' O ' ' O ' ' A' ' 25' ' ' ILE . 19.4 tt -130.32 -36.53 0.62 Allowed 'Isoleucine or valine' 0 N--CA 1.494 1.768 0 N-CA-C 108.761 -0.829 . . . . 0.0 108.761 179.715 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 25' ' ' ILE . . . . . 0.431 ' O ' ' O ' ' A' ' 24' ' ' ILE . 94.1 mt 56.38 158.13 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.492 1.652 0 CA-C-O 121.503 0.668 . . . . 0.0 110.359 179.861 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 85.1 mtp180 -88.99 136.87 32.78 Favored 'General case' 0 N--CA 1.492 1.649 0 O-C-N 121.404 -0.81 . . . . 0.0 110.011 -179.178 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 96.4 mt-10 -80.59 144.67 32.22 Favored 'General case' 0 N--CA 1.49 1.554 0 O-C-N 121.542 -0.724 . . . . 0.0 110.741 -179.386 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . 173.03 -177.05 45.69 Favored Glycine 0 N--CA 1.486 2.032 0 N-CA-C 109.586 -1.405 . . . . 0.0 109.586 179.39 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 98.1 m-20 -72.02 -8.79 56.56 Favored 'General case' 0 C--N 1.304 -1.391 0 O-C-N 121.53 -0.982 . . . . 0.0 108.959 179.598 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 31.6 p30 -85.98 1.09 51.49 Favored 'General case' 0 N--CA 1.49 1.537 0 N-CA-C 108.774 -0.824 . . . . 0.0 108.774 179.789 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 53.5 t -126.02 133.7 68.31 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.864 0 N-CA-C 109.27 -0.641 . . . . 0.0 109.27 179.802 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -138.33 151.19 47.32 Favored 'General case' 0 N--CA 1.492 1.665 0 O-C-N 121.469 -0.769 . . . . 0.0 109.573 179.897 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 15.4 pt-20 -94.21 145.91 24.38 Favored 'General case' 0 N--CA 1.492 1.671 0 O-C-N 121.528 -0.733 . . . . 0.0 109.961 -179.552 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 34' ' ' VAL . . . . . . . . . . . . . 92.7 t -119.36 127.57 75.85 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.789 0 N-CA-C 108.64 -0.874 . . . . 0.0 108.64 179.893 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 26.1 t -117.36 128.0 54.61 Favored 'General case' 0 N--CA 1.494 1.736 0 N-CA-C 109.103 -0.703 . . . . 0.0 109.103 -179.829 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 55.1 tp -124.98 142.66 51.34 Favored 'General case' 0 N--CA 1.497 1.922 0 CA-C-O 121.381 0.61 . . . . 0.0 109.614 -179.996 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 37' ' ' PHE . . . . . . . . . . . . . 92.8 m-85 -104.69 147.01 28.14 Favored 'General case' 0 N--CA 1.493 1.723 0 O-C-N 121.685 -0.634 . . . . 0.0 109.818 179.992 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . -172.9 179.31 44.43 Favored Glycine 0 N--CA 1.488 2.128 0 N-CA-C 109.759 -1.336 . . . . 0.0 109.759 179.748 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 19.0 t -78.52 -99.27 0.02 OUTLIER 'General case' 0 N--CA 1.49 1.562 0 O-C-N 121.476 -1.014 . . . . 0.0 110.05 -179.809 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 40' ' ' ASP . . . . . . . . . . . . . 55.7 p-10 -85.59 175.44 8.78 Favored 'General case' 0 N--CA 1.49 1.573 0 O-C-N 121.424 -0.798 . . . . 0.0 110.453 -179.114 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 88.8 tttt -63.32 -41.96 98.95 Favored 'General case' 0 N--CA 1.491 1.581 0 O-C-N 121.528 -0.733 . . . . 0.0 109.196 179.905 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -53.5 -43.13 68.0 Favored 'General case' 0 N--CA 1.49 1.543 0 O-C-N 121.602 -0.686 . . . . 0.0 109.542 -179.65 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 43' ' ' HIS . . . . . . . . . . . . . 28.8 t-80 -63.21 -44.0 96.57 Favored 'General case' 0 N--CA 1.489 1.509 0 O-C-N 121.468 -0.77 . . . . 0.0 109.306 -179.851 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 84.5 mt -63.6 -39.87 95.48 Favored 'General case' 0 N--CA 1.491 1.575 0 O-C-N 121.52 -0.737 . . . . 0.0 109.306 179.982 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 97.1 mt-10 -59.65 -37.87 79.9 Favored 'General case' 0 N--CA 1.488 1.45 0 O-C-N 121.346 -0.846 . . . . 0.0 109.689 -179.782 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . -64.22 -52.01 47.82 Favored Glycine 0 N--CA 1.492 2.41 0 N-CA-C 109.588 -1.405 . . . . 0.0 109.588 -179.445 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 97.3 mttt -67.04 -32.61 73.92 Favored 'General case' 0 N--CA 1.49 1.54 0 O-C-N 121.395 -1.062 . . . . 0.0 109.376 179.299 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 52.6 tp -58.07 -40.74 81.8 Favored 'General case' 0 C--N 1.301 -1.53 0 O-C-N 121.569 -0.707 . . . . 0.0 109.286 -179.341 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 49' ' ' ALA . . . . . . . . . . . . . . . -59.74 -39.43 84.71 Favored 'General case' 0 N--CA 1.488 1.468 0 O-C-N 121.395 -0.816 . . . . 0.0 109.442 -179.597 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 97.8 mt-10 -70.17 -39.21 75.41 Favored 'General case' 0 N--CA 1.49 1.565 0 O-C-N 121.452 -0.78 . . . . 0.0 109.616 179.797 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 4.4 m-85 -61.71 -48.61 79.99 Favored 'General case' 0 N--CA 1.492 1.627 0 O-C-N 121.361 -0.837 . . . . 0.0 109.547 -179.514 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 52' ' ' ILE . . . . . . . . . . . . . 95.4 mt -65.61 -44.45 93.71 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.444 0 O-C-N 121.346 -0.846 . . . . 0.0 109.359 -179.664 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 66.2 m -63.03 -42.07 99.69 Favored 'General case' 0 N--CA 1.488 1.465 0 O-C-N 121.557 -0.715 . . . . 0.0 109.637 -179.705 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 54' ' ' LEU . . . . . . . . . . . . . 56.0 tp -63.59 -42.25 98.28 Favored 'General case' 0 N--CA 1.489 1.48 0 O-C-N 121.497 -0.752 . . . . 0.0 109.329 -179.705 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -62.48 -41.4 98.76 Favored 'General case' 0 N--CA 1.489 1.505 0 O-C-N 121.523 -0.736 . . . . 0.0 109.477 -179.04 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 56' ' ' LYS . . . . . 0.479 ' O ' ' N ' ' A' ' 60' ' ' ALA . 97.8 mttt -64.93 -42.5 94.61 Favored 'General case' 0 C--N 1.302 -1.48 0 O-C-N 121.496 -0.752 . . . . 0.0 110.084 -179.797 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 58.4 tt0 -64.65 -42.03 95.71 Favored 'General case' 0 N--CA 1.49 1.534 0 O-C-N 121.118 -0.989 . . . . 0.0 109.314 -179.597 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 58' ' ' VAL . . . . . . . . . . . . . 71.6 t -68.46 -45.71 81.62 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.517 0 O-C-N 121.443 -0.785 . . . . 0.0 110.124 -179.834 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 59' ' ' TYR . . . . . 0.506 ' O ' ' CB ' ' A' ' 60' ' ' ALA . 53.8 t80 -110.39 -57.18 2.25 Favored 'General case' 0 N--CA 1.496 1.866 0 O-C-N 121.56 -0.713 . . . . 0.0 109.913 -178.818 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 60' ' ' ALA . . . . . 0.506 ' CB ' ' O ' ' A' ' 59' ' ' TYR . . . 82.98 145.22 0.07 Allowed 'General case' 0 N--CA 1.499 2.013 0 CA-C-O 121.27 0.557 . . . . 0.0 109.707 -179.757 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 61' ' ' ASN . . . . . . . . . . . . . 5.4 m120 59.49 33.46 22.22 Favored 'General case' 0 N--CA 1.491 1.61 0 N-CA-C 108.534 -0.913 . . . . 0.0 108.534 -179.253 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 62' ' ' VAL . . . . . . . . . . . . . 9.9 p -90.97 152.82 3.29 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.655 0 O-C-N 121.577 -0.702 . . . . 0.0 110.343 -179.524 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 96.9 mt-10 -113.43 132.5 55.61 Favored 'General case' 0 N--CA 1.494 1.727 0 N-CA-C 108.892 -0.781 . . . . 0.0 108.892 179.556 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 64' ' ' TYR . . . . . . . . . . . . . 52.4 p90 -142.83 162.22 36.04 Favored 'General case' 0 N--CA 1.489 1.516 0 O-C-N 121.432 -0.792 . . . . 0.0 109.428 -179.58 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 79.6 mm-40 -138.53 157.72 45.63 Favored 'General case' 0 N--CA 1.49 1.526 0 O-C-N 121.53 -0.731 . . . . 0.0 109.041 -179.946 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 66' ' ' VAL . . . . . . . . . . . . . 3.3 p -125.5 132.47 70.92 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.696 0 CA-C-O 121.648 0.737 . . . . 0.0 109.478 -179.6 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -86.27 170.5 12.48 Favored Pre-proline 0 N--CA 1.489 1.501 0 O-C-N 121.527 -0.733 . . . . 0.0 109.381 -179.719 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 68' ' ' PRO . . . . . . . . . . . . . 37.1 Cg_exo -54.73 132.38 51.35 Favored 'Trans proline' 0 N--CA 1.494 1.534 0 C-N-CA 122.171 1.914 . . . . 0.0 112.209 179.776 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 69' ' ' VAL . . . . . . . . . . . . . 55.0 t -130.51 133.29 63.89 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.792 0 CA-C-O 121.479 0.657 . . . . 0.0 109.599 179.664 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -74.07 156.0 37.9 Favored 'General case' 0 N--CA 1.487 1.425 0 CA-C-O 121.635 0.731 . . . . 0.0 110.529 -179.711 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 92.2 m-20 -62.47 -39.78 94.53 Favored 'General case' 0 N--CA 1.492 1.628 0 O-C-N 121.545 -0.722 . . . . 0.0 109.92 -179.94 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 72' ' ' ASN . . . . . . . . . . . . . 90.9 m-20 -95.38 16.14 17.62 Favored 'General case' 0 N--CA 1.495 1.79 0 O-C-N 121.345 -0.847 . . . . 0.0 109.404 -179.396 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -59.06 143.47 48.4 Favored 'General case' 0 N--CA 1.491 1.624 0 O-C-N 121.364 -0.835 . . . . 0.0 110.311 -179.321 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 74' ' ' THR . . . . . . . . . . . . . 61.2 p -105.44 -1.0 25.5 Favored 'General case' 0 N--CA 1.494 1.735 0 N-CA-C 108.876 -0.787 . . . . 0.0 108.876 179.708 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 95.9 mt-10 -138.99 158.34 44.38 Favored 'General case' 0 N--CA 1.493 1.703 0 O-C-N 121.475 -0.766 . . . . 0.0 109.596 -179.734 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 6.2 tp -124.78 133.49 53.12 Favored 'General case' 0 N--CA 1.492 1.632 0 O-C-N 121.641 -0.662 . . . . 0.0 109.419 -179.912 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 77' ' ' HIS . . . . . . . . . . . . . 80.8 m80 -112.13 121.12 44.07 Favored 'General case' 0 N--CA 1.491 1.623 0 N-CA-C 109.085 -0.709 . . . . 0.0 109.085 179.556 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -147.1 160.69 42.11 Favored 'General case' 0 N--CA 1.489 1.522 0 O-C-N 121.239 -0.913 . . . . 0.0 109.12 -179.977 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 95.6 mtt180 -126.63 141.97 51.69 Favored 'General case' 0 N--CA 1.494 1.767 0 CA-C-O 121.593 0.711 . . . . 0.0 109.966 -179.715 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 80' ' ' PHE . . . . . . . . . . . . . 42.9 m-85 -128.66 148.53 50.82 Favored 'General case' 0 N--CA 1.493 1.676 0 N-CA-C 109.041 -0.725 . . . . 0.0 109.041 179.819 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 88.3 tttt -104.54 117.07 33.25 Favored 'General case' 0 N--CA 1.492 1.66 0 O-C-N 121.591 -0.693 . . . . 0.0 109.443 -179.757 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 82' ' ' PHE . . . . . . . . . . . . . 65.0 m-85 -112.68 141.78 46.06 Favored 'General case' 0 N--CA 1.494 1.748 0 CA-C-O 121.55 0.691 . . . . 0.0 109.854 -179.889 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 1.4 tm-20 -66.42 -34.19 77.39 Favored 'General case' 0 N--CA 1.488 1.444 0 N-CA-C 109.042 -0.725 . . . . 0.0 109.042 179.484 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 84' ' ' VAL . . . . . . . . . . . . . 31.5 m -135.07 161.3 40.21 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.734 0 CA-C-O 121.607 0.717 . . . . 0.0 109.724 -179.784 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 25.0 m -75.67 -20.55 58.35 Favored 'General case' 0 N--CA 1.491 1.576 0 O-C-N 121.586 -0.696 . . . . 0.0 109.61 -179.903 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 86' ' ' ALA . . . . . . . . . . . . . . . -62.09 -39.38 92.25 Favored 'General case' 0 N--CA 1.494 1.726 0 O-C-N 121.333 -0.854 . . . . 0.0 109.633 -179.468 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 72.8 mm-40 -67.96 -32.28 72.6 Favored 'General case' 0 C--N 1.299 -1.594 0 O-C-N 121.604 -0.685 . . . . 0.0 109.163 -179.814 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 88' ' ' LYS . . . . . . . . . . . . . 4.6 tmtt? -64.36 -49.83 70.09 Favored 'General case' 0 N--CA 1.49 1.539 0 O-C-N 121.288 -0.882 . . . . 0.0 109.069 -179.712 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 17.9 mt -63.64 -44.84 92.68 Favored 'General case' 0 N--CA 1.489 1.519 0 O-C-N 121.276 -0.89 . . . . 0.0 109.662 -179.68 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 90' ' ' ILE . . . . . 0.422 HD13 HG23 ' A' ' 90' ' ' ILE . 97.3 mt -66.41 -43.89 90.93 Favored 'Isoleucine or valine' 0 C--N 1.301 -1.521 0 O-C-N 121.579 -0.701 . . . . 0.0 109.425 -179.745 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 91' ' ' PHE . . . . . . . . . . . . . 81.9 t80 -61.55 -44.93 96.14 Favored 'General case' 0 N--CA 1.49 1.572 0 O-C-N 121.574 -0.704 . . . . 0.0 109.441 -179.588 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 92' ' ' GLU . . . . . . . . . . . . . 80.5 tt0 -62.13 -46.1 90.5 Favored 'General case' 0 N--CA 1.49 1.573 0 O-C-N 121.524 -0.735 . . . . 0.0 109.583 -179.627 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 93' ' ' LEU . . . . . . . . . . . . . 85.3 mt -63.67 -43.44 96.7 Favored 'General case' 0 N--CA 1.491 1.613 0 O-C-N 121.341 -0.849 . . . . 0.0 109.831 -179.537 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 94' ' ' LYS . . . . . . . . . . . . . 55.7 mtpt -65.05 -40.96 95.49 Favored 'General case' 0 C--N 1.302 -1.457 0 O-C-N 121.328 -0.857 . . . . 0.0 109.691 179.863 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 20.6 p -65.27 -35.79 82.1 Favored 'General case' 0 N--CA 1.488 1.471 0 O-C-N 121.385 -0.822 . . . . 0.0 109.493 -179.743 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 96' ' ' ARG . . . . . . . . . . . . . 24.4 mmt180 -63.46 -42.37 98.61 Favored 'General case' 0 C--N 1.3 -1.562 0 O-C-N 121.436 -0.79 . . . . 0.0 109.4 179.638 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 97' ' ' ALA . . . . . . . . . . . . . . . -67.42 -38.46 84.61 Favored 'General case' 0 C--N 1.3 -1.568 0 O-C-N 121.472 -0.767 . . . . 0.0 108.942 179.539 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 98' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -63.4 -45.84 89.16 Favored 'General case' 0 C--N 1.304 -1.396 0 CA-C-O 121.805 0.812 . . . . 0.0 109.067 -179.446 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 99' ' ' ALA . . . . . . . . . . . . . . . -67.27 -37.21 83.1 Favored 'General case' 0 C--N 1.304 -1.409 0 O-C-N 121.497 -0.752 . . . . 0.0 109.644 -179.747 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 100' ' ' ARG . . . . . . . . . . . . . 83.9 mtp180 -80.82 -5.84 57.78 Favored 'General case' 0 N--CA 1.489 1.509 0 O-C-N 121.476 -0.765 . . . . 0.0 109.276 -179.639 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 101' ' ' LEU . . . . . . . . . . . . . 83.9 mt 44.43 75.92 0.09 Allowed 'General case' 0 N--CA 1.493 1.716 0 CA-C-O 121.939 0.876 . . . . 0.0 109.681 -179.659 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 102' ' ' GLU . . . . . . . . . . . . . 80.4 mm-40 -63.14 146.69 52.77 Favored 'General case' 0 N--CA 1.486 1.367 0 CA-C-O 121.575 0.703 . . . . 0.0 110.07 -179.626 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 103' ' ' HIS . . . . . . . . . . . . . 98.6 m-70 -90.56 101.99 14.73 Favored 'General case' 0 N--CA 1.488 1.471 0 O-C-N 121.571 -0.705 . . . . 0.0 109.405 -179.794 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 104' ' ' HIS . . . . . . . . . . . . . 53.9 p-80 -98.78 -12.16 21.15 Favored 'General case' 0 N--CA 1.495 1.806 0 CA-C-O 121.573 0.701 . . . . 0.0 109.118 -179.894 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 105' ' ' HIS . . . . . . . . . . . . . 99.6 m-70 50.52 -178.94 0.02 OUTLIER 'General case' 0 N--CA 1.492 1.661 0 CA-C-O 121.938 0.875 . . . . 0.0 111.416 179.419 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 106' ' ' HIS . . . . . . . . . . . . . 55.3 t-80 46.56 89.89 0.02 OUTLIER 'General case' 0 N--CA 1.488 1.434 0 CA-C-O 121.209 0.528 . . . . 0.0 109.82 -179.834 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 107' ' ' HIS . . . . . . . . . . . . . 63.8 t-80 -120.08 125.04 47.29 Favored 'General case' 0 N--CA 1.496 1.832 0 CA-C-O 121.641 0.734 . . . . 0.0 109.859 179.932 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 108' ' ' HIS . . . . . 0.496 ' O ' ' CG ' ' A' ' 108' ' ' HIS . 86.4 t60 . . . . . 0 N--CA 1.49 1.541 0 CA-C-O 117.984 -1.008 . . . . 0.0 110.065 179.661 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 1' ' ' MET . . . . . 0.416 ' H3 ' ' H ' ' A' ' 2' ' ' SER . 87.2 mmm . . . . . 0 N--CA 1.488 1.466 0 N-CA-C 108.927 -0.768 . . . . 0.0 108.927 . . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 2' ' ' SER . . . . . 0.416 ' H ' ' H3 ' ' A' ' 1' ' ' MET . 66.6 m -135.0 144.69 47.51 Favored 'General case' 0 N--CA 1.494 1.771 0 O-C-N 121.424 -0.797 . . . . 0.0 109.634 179.847 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 3' ' ' ASN . . . . . 0.545 ' OD1' ' N ' ' A' ' 4' ' ' GLN . 38.4 p-10 -66.92 -40.36 87.63 Favored 'General case' 0 N--CA 1.49 1.572 0 O-C-N 121.533 -0.729 . . . . 0.0 110.195 -179.832 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 4' ' ' GLN . . . . . 0.545 ' N ' ' OD1' ' A' ' 3' ' ' ASN . 6.0 tt0 -107.61 151.77 25.18 Favored 'General case' 0 N--CA 1.495 1.782 0 O-C-N 121.495 -0.753 . . . . 0.0 109.992 -179.339 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 5' ' ' THR . . . . . 0.52 ' O ' ' N ' ' A' ' 7' ' ' VAL . 73.0 p -99.75 3.03 44.71 Favored 'General case' 0 N--CA 1.494 1.729 0 N-CA-C 109.124 -0.695 . . . . 0.0 109.124 179.784 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 6' ' ' CYS . . . . . 0.447 ' O ' ' SG ' ' A' ' 6' ' ' CYS . 26.6 p -58.87 80.81 0.01 OUTLIER 'General case' 0 N--CA 1.49 1.551 0 O-C-N 121.326 -0.858 . . . . 0.0 109.816 -179.636 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 7' ' ' VAL . . . . . 0.52 ' N ' ' O ' ' A' ' 5' ' ' THR . 7.1 p -95.8 -14.54 7.87 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.703 0 O-C-N 121.414 -0.804 . . . . 0.0 108.842 179.473 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 8' ' ' GLU . . . . . 0.452 ' CG ' ' H ' ' A' ' 9' ' ' ASN . 23.0 tp10 39.0 -131.64 0.2 Allowed 'General case' 0 N--CA 1.497 1.909 0 CA-C-O 121.684 0.754 . . . . 0.0 110.906 179.642 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 9' ' ' ASN . . . . . 0.452 ' H ' ' CG ' ' A' ' 8' ' ' GLU . 19.4 t-20 -89.77 108.34 19.64 Favored 'General case' 0 N--CA 1.486 1.356 0 O-C-N 121.343 -0.848 . . . . 0.0 109.718 -178.956 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 80.1 tt0 -162.88 121.8 2.14 Favored 'General case' 0 N--CA 1.488 1.451 0 O-C-N 121.328 -0.857 . . . . 0.0 109.17 179.788 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 33.7 m -85.5 129.18 38.35 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.687 0 O-C-N 121.487 -0.758 . . . . 0.0 109.597 -179.357 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 5.1 m -89.3 131.22 35.5 Favored 'General case' 0 N--CA 1.489 1.491 0 O-C-N 121.383 -0.823 . . . . 0.0 109.907 -179.2 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 48.1 tp10 -159.51 108.63 1.84 Allowed 'General case' 0 C--N 1.305 -1.351 0 O-C-N 121.325 -0.859 . . . . 0.0 108.939 179.044 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 14' ' ' ALA . . . . . 0.556 ' O ' ' N ' ' A' ' 16' ' ' GLY . . . -178.38 0.03 0.01 OUTLIER 'General case' 0 C--N 1.302 -1.465 0 N-CA-C 108.054 -1.091 . . . . 0.0 108.054 179.765 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 67.4 m 51.05 -84.69 0.01 OUTLIER 'General case' 0 N--CA 1.495 1.807 0 CA-C-O 121.416 0.627 . . . . 0.0 110.096 179.847 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 16' ' ' GLY . . . . . 0.556 ' N ' ' O ' ' A' ' 14' ' ' ALA . . . -159.84 -146.79 4.69 Favored Glycine 0 N--CA 1.485 1.951 0 N-CA-C 109.826 -1.309 . . . . 0.0 109.826 -179.483 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 13.8 p -76.6 146.78 38.04 Favored 'General case' 0 N--CA 1.49 1.556 0 O-C-N 121.472 -1.017 . . . . 0.0 110.532 -179.332 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -63.38 144.64 56.79 Favored 'General case' 0 N--CA 1.49 1.57 0 CA-C-O 121.67 0.748 . . . . 0.0 110.565 -179.275 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -154.33 -131.43 1.52 Allowed Glycine 0 N--CA 1.492 2.403 0 N-CA-C 109.689 -1.364 . . . . 0.0 109.689 -179.863 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 17.4 pt-20 -82.44 -5.26 58.57 Favored 'General case' 0 N--CA 1.491 1.583 0 O-C-N 121.546 -0.973 . . . . 0.0 109.586 -179.878 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 21' ' ' ILE . . . . . . . . . . . . . 35.2 mm -66.32 -42.82 91.38 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.568 0 O-C-N 121.232 -0.917 . . . . 0.0 109.463 179.859 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . -149.1 -151.94 5.6 Favored Glycine 0 N--CA 1.493 2.488 0 C-N-CA 119.847 -1.168 . . . . 0.0 110.346 -179.24 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 23' ' ' PHE . . . . . . . . . . . . . 92.2 m-85 -77.35 140.36 39.95 Favored 'General case' 0 N--CA 1.49 1.554 0 O-C-N 121.294 -1.121 . . . . 0.0 110.332 -179.309 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 40.8 pt -87.58 -14.88 9.75 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.61 0 O-C-N 121.529 -0.732 . . . . 0.0 109.64 179.766 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 25' ' ' ILE . . . . . . . . . . . . . 96.6 mt -77.84 -69.97 0.38 Allowed 'Isoleucine or valine' 0 N--CA 1.487 1.41 0 O-C-N 121.276 -0.89 . . . . 0.0 110.232 -179.086 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 72.4 ttt180 43.7 78.83 0.05 OUTLIER 'General case' 0 N--CA 1.498 1.953 0 CA-C-O 121.938 0.875 . . . . 0.0 110.042 -179.374 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 76.6 tt0 53.91 61.01 3.27 Favored 'General case' 0 N--CA 1.49 1.569 0 CA-C-O 121.693 0.759 . . . . 0.0 109.325 179.877 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . -95.18 110.65 4.06 Favored Glycine 0 N--CA 1.494 2.523 0 N-CA-C 109.682 -1.367 . . . . 0.0 109.682 179.941 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 29' ' ' ASP . . . . . 0.435 ' O ' ' O ' ' A' ' 30' ' ' ASP . 44.7 t0 40.29 71.55 0.18 Allowed 'General case' 0 N--CA 1.496 1.835 0 O-C-N 121.741 -0.858 . . . . 0.0 110.685 179.873 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 30' ' ' ASP . . . . . 0.435 ' O ' ' O ' ' A' ' 29' ' ' ASP . 26.2 t0 55.8 117.87 0.01 OUTLIER 'General case' 0 N--CA 1.495 1.792 0 CA-C-O 121.713 0.768 . . . . 0.0 110.716 179.503 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 20.4 t -125.69 160.98 31.42 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.768 0 O-C-N 121.601 -0.687 . . . . 0.0 109.728 -179.97 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 32' ' ' ALA . . . . . 0.606 ' CB ' ' HZ3' ' A' ' 88' ' ' LYS . . . -128.64 148.61 50.82 Favored 'General case' 0 N--CA 1.495 1.822 0 O-C-N 121.567 -0.708 . . . . 0.0 110.088 -179.555 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 81.1 tt0 -104.24 135.57 45.47 Favored 'General case' 0 N--CA 1.491 1.589 0 O-C-N 121.62 -0.675 . . . . 0.0 109.404 -179.894 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 34' ' ' VAL . . . . . . . . . . . . . 56.0 t -124.98 130.7 73.18 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.816 0 O-C-N 121.617 -0.677 . . . . 0.0 109.188 179.765 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 72.4 m -133.28 121.7 22.81 Favored 'General case' 0 N--CA 1.491 1.588 0 N-CA-C 109.006 -0.739 . . . . 0.0 109.006 179.527 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 50.3 tp -122.03 137.65 54.73 Favored 'General case' 0 N--CA 1.496 1.833 0 CA-C-O 121.416 0.627 . . . . 0.0 109.36 -179.986 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 37' ' ' PHE . . . . . . . . . . . . . 97.0 m-85 -102.92 148.02 26.19 Favored 'General case' 0 N--CA 1.492 1.65 0 O-C-N 121.51 -0.744 . . . . 0.0 109.443 -179.863 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . -170.05 -172.14 36.25 Favored Glycine 0 N--CA 1.49 2.251 0 N-CA-C 109.923 -1.271 . . . . 0.0 109.923 -179.78 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 39' ' ' SER . . . . . 0.486 ' OG ' ' N ' ' A' ' 40' ' ' ASP . 91.9 p -106.55 -82.71 0.54 Allowed 'General case' 0 N--CA 1.497 1.885 0 O-C-N 121.331 -1.1 . . . . 0.0 109.942 -179.774 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 40' ' ' ASP . . . . . 0.486 ' N ' ' OG ' ' A' ' 39' ' ' SER . 30.6 t70 -83.9 161.18 20.93 Favored 'General case' 0 N--CA 1.492 1.639 0 O-C-N 121.248 -0.907 . . . . 0.0 110.773 -179.018 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 65.7 tttm -64.72 -37.05 86.27 Favored 'General case' 0 N--CA 1.492 1.63 0 O-C-N 121.512 -0.742 . . . . 0.0 109.969 179.59 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -56.36 -40.52 74.65 Favored 'General case' 0 N--CA 1.492 1.646 0 O-C-N 121.284 -0.885 . . . . 0.0 110.016 -179.202 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 43' ' ' HIS . . . . . . . . . . . . . 68.2 m80 -66.63 -41.36 88.42 Favored 'General case' 0 N--CA 1.49 1.56 0 O-C-N 121.208 -0.932 . . . . 0.0 109.686 -179.921 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 89.0 mt -63.95 -41.56 97.56 Favored 'General case' 0 N--CA 1.494 1.774 0 O-C-N 121.308 -0.87 . . . . 0.0 109.556 179.944 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 80.6 mm-40 -61.47 -42.06 98.2 Favored 'General case' 0 C--N 1.302 -1.492 0 O-C-N 121.347 -0.845 . . . . 0.0 109.432 -179.696 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . -63.05 -50.76 60.68 Favored Glycine 0 N--CA 1.492 2.414 0 N-CA-C 109.691 -1.363 . . . . 0.0 109.691 -179.655 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 64.7 mttp -65.64 -35.98 82.36 Favored 'General case' 0 N--CA 1.492 1.665 0 O-C-N 121.348 -1.09 . . . . 0.0 109.415 179.545 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 53.8 tp -59.6 -38.68 81.88 Favored 'General case' 0 N--CA 1.493 1.714 0 O-C-N 121.538 -0.726 . . . . 0.0 109.498 -179.259 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 49' ' ' ALA . . . . . . . . . . . . . . . -53.15 -32.59 48.44 Favored 'General case' 0 N--CA 1.49 1.556 0 O-C-N 121.177 -0.952 . . . . 0.0 109.789 -179.434 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 73.6 mm-40 -65.31 -40.11 93.33 Favored 'General case' 0 N--CA 1.492 1.645 0 O-C-N 121.203 -0.936 . . . . 0.0 109.423 -179.882 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 51' ' ' TYR . . . . . 0.494 ' CE2' ' CG2' ' A' ' 95' ' ' THR . 31.6 m-85 -62.92 -41.68 99.54 Favored 'General case' 0 N--CA 1.49 1.573 0 O-C-N 121.326 -0.859 . . . . 0.0 109.931 -179.758 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 52' ' ' ILE . . . . . . . . . . . . . 34.6 mm -63.98 -44.95 98.01 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.641 0 O-C-N 121.14 -0.975 . . . . 0.0 109.482 -179.35 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 53' ' ' SER . . . . . 0.49 ' HG ' ' N ' ' A' ' 54' ' ' LEU . 76.1 p -65.81 -44.61 85.11 Favored 'General case' 0 N--CA 1.491 1.611 0 O-C-N 121.166 -0.959 . . . . 0.0 110.153 -179.706 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 54' ' ' LEU . . . . . 0.49 ' N ' ' HG ' ' A' ' 53' ' ' SER . 85.2 mt -65.43 -42.23 92.68 Favored 'General case' 0 N--CA 1.493 1.703 0 O-C-N 121.24 -0.913 . . . . 0.0 109.943 -179.636 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -61.16 -49.76 75.92 Favored 'General case' 0 N--CA 1.492 1.648 0 O-C-N 121.408 -0.808 . . . . 0.0 110.702 -178.893 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 56' ' ' LYS . . . . . . . . . . . . . 98.5 mttt -65.11 -43.87 90.58 Favored 'General case' 0 N--CA 1.492 1.627 0 O-C-N 121.188 -0.945 . . . . 0.0 110.056 -179.361 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 59.2 tt0 -65.94 -47.21 75.43 Favored 'General case' 0 N--CA 1.491 1.597 0 O-C-N 121.334 -0.854 . . . . 0.0 109.328 -179.9 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 58' ' ' VAL . . . . . . . . . . . . . 54.6 t -64.97 -45.42 94.73 Favored 'Isoleucine or valine' 0 C--N 1.302 -1.492 0 O-C-N 121.45 -0.781 . . . . 0.0 109.94 -179.926 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 59' ' ' TYR . . . . . . . . . . . . . 54.9 t80 -131.91 124.04 28.66 Favored 'General case' 0 N--CA 1.498 1.964 0 O-C-N 121.365 -0.834 . . . . 0.0 110.042 -179.204 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 60' ' ' ALA . . . . . 0.42 ' O ' ' OD1' ' A' ' 61' ' ' ASN . . . -66.43 148.38 51.96 Favored 'General case' 0 N--CA 1.491 1.59 0 O-C-N 121.688 -0.633 . . . . 0.0 110.902 -179.601 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 61' ' ' ASN . . . . . 0.42 ' OD1' ' O ' ' A' ' 60' ' ' ALA . 7.6 p-10 44.61 52.65 7.59 Favored 'General case' 0 N--CA 1.496 1.829 0 CA-C-O 121.717 0.77 . . . . 0.0 109.425 179.722 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 62' ' ' VAL . . . . . . . . . . . . . 15.0 p -79.09 140.22 17.18 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.499 0 O-C-N 121.635 -0.666 . . . . 0.0 109.911 -179.776 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 96.7 mt-10 -110.1 132.47 54.13 Favored 'General case' 0 N--CA 1.494 1.756 0 CA-C-O 121.58 0.705 . . . . 0.0 109.563 -179.57 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 64' ' ' TYR . . . . . . . . . . . . . 53.0 p90 -147.99 164.53 33.49 Favored 'General case' 0 N--CA 1.489 1.476 0 O-C-N 121.378 -0.826 . . . . 0.0 109.52 -179.847 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 95.7 mt-10 -139.31 151.95 46.83 Favored 'General case' 0 N--CA 1.492 1.626 0 O-C-N 121.451 -0.781 . . . . 0.0 109.273 179.893 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 66' ' ' VAL . . . . . . . . . . . . . 3.1 p -123.91 130.55 73.84 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.768 0 CA-C-O 121.537 0.684 . . . . 0.0 109.657 -179.493 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -76.7 172.35 9.87 Favored Pre-proline 0 C--N 1.303 -1.448 0 O-C-N 121.683 -0.636 . . . . 0.0 109.68 -179.85 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 68' ' ' PRO . . . . . . . . . . . . . 52.5 Cg_exo -54.8 139.07 77.85 Favored 'Trans proline' 0 N--CA 1.498 1.781 0 C-N-CA 122.57 2.18 . . . . 0.0 112.427 179.934 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 69' ' ' VAL . . . . . . . . . . . . . 60.1 t -128.96 132.32 67.46 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.924 0 O-C-N 121.593 -0.692 . . . . 0.0 109.572 179.702 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -87.02 163.49 17.02 Favored 'General case' 0 N--CA 1.489 1.503 0 O-C-N 121.413 -0.804 . . . . 0.0 109.881 -179.968 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 75.4 m-20 -63.25 -40.86 98.6 Favored 'General case' 0 N--CA 1.491 1.59 0 O-C-N 121.385 -0.822 . . . . 0.0 109.543 -179.917 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 72' ' ' ASN . . . . . . . . . . . . . 98.8 m-20 -99.31 19.35 15.62 Favored 'General case' 0 N--CA 1.493 1.71 0 O-C-N 121.423 -0.798 . . . . 0.0 109.372 -179.289 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -54.18 139.35 35.89 Favored 'General case' 0 N--CA 1.491 1.614 0 O-C-N 121.252 -0.905 . . . . 0.0 110.05 -179.279 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 74' ' ' THR . . . . . . . . . . . . . 81.6 p -107.78 -0.98 21.33 Favored 'General case' 0 N--CA 1.494 1.735 0 N-CA-C 108.879 -0.786 . . . . 0.0 108.879 179.6 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 17.3 pt-20 -141.99 160.04 41.02 Favored 'General case' 0 N--CA 1.495 1.813 0 O-C-N 121.208 -0.933 . . . . 0.0 109.34 179.327 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 6.6 tp -130.02 130.43 44.96 Favored 'General case' 0 N--CA 1.492 1.657 0 N-CA-C 109.054 -0.721 . . . . 0.0 109.054 179.617 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 77' ' ' HIS . . . . . . . . . . . . . 59.0 t-80 -114.53 113.71 24.79 Favored 'General case' 0 N--CA 1.493 1.676 0 N-CA-C 109.043 -0.725 . . . . 0.0 109.043 179.912 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -135.95 159.37 41.88 Favored 'General case' 0 N--CA 1.493 1.698 0 O-C-N 121.427 -0.796 . . . . 0.0 109.328 -179.778 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 15.9 tpp180 -127.86 141.2 51.62 Favored 'General case' 0 N--CA 1.492 1.641 0 N-CA-C 109.243 -0.651 . . . . 0.0 109.243 -179.764 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 80' ' ' PHE . . . . . . . . . . . . . 52.8 m-85 -126.08 146.62 49.85 Favored 'General case' 0 N--CA 1.494 1.728 0 CA-C-O 121.448 0.642 . . . . 0.0 109.414 -179.883 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 3.3 ttmp? -109.35 127.58 54.44 Favored 'General case' 0 N--CA 1.49 1.53 0 O-C-N 121.753 -0.592 . . . . 0.0 109.551 -179.772 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 82' ' ' PHE . . . . . . . . . . . . . 70.5 m-85 -125.02 147.03 49.15 Favored 'General case' 0 N--CA 1.491 1.616 0 CA-C-O 121.531 0.681 . . . . 0.0 109.607 -179.75 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 83.9 tt0 -67.45 -37.14 82.51 Favored 'General case' 0 C--N 1.302 -1.498 0 O-C-N 121.525 -0.734 . . . . 0.0 109.738 -179.909 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 84' ' ' VAL . . . . . . . . . . . . . 30.1 m -137.02 162.5 34.12 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.876 0 O-C-N 121.258 -0.901 . . . . 0.0 110.467 -179.306 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 74.9 p -69.97 -16.05 63.13 Favored 'General case' 0 N--CA 1.49 1.555 0 O-C-N 121.783 -0.573 . . . . 0.0 110.036 179.747 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 86' ' ' ALA . . . . . . . . . . . . . . . -62.78 -40.85 98.57 Favored 'General case' 0 N--CA 1.495 1.825 0 O-C-N 121.108 -0.995 . . . . 0.0 109.735 -179.623 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 87' ' ' GLU . . . . . 0.53 ' N ' ' OE1' ' A' ' 87' ' ' GLU . 4.9 mp0 -70.2 -30.48 67.6 Favored 'General case' 0 N--CA 1.491 1.624 0 O-C-N 121.411 -0.806 . . . . 0.0 108.848 179.883 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 88' ' ' LYS . . . . . 0.606 ' HZ3' ' CB ' ' A' ' 32' ' ' ALA . 64.6 tttp -62.62 -47.49 83.53 Favored 'General case' 0 C--N 1.3 -1.567 0 O-C-N 121.221 -0.924 . . . . 0.0 109.314 -179.956 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 48.3 tp -64.71 -47.45 78.25 Favored 'General case' 0 N--CA 1.49 1.55 0 O-C-N 121.312 -0.867 . . . . 0.0 109.857 -179.38 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 90' ' ' ILE . . . . . . . . . . . . . 97.0 mt -66.58 -45.07 89.54 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.734 0 O-C-N 121.236 -0.915 . . . . 0.0 109.674 -179.533 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 91' ' ' PHE . . . . . . . . . . . . . 91.2 t80 -64.45 -45.35 87.83 Favored 'General case' 0 N--CA 1.491 1.588 0 O-C-N 121.581 -0.7 . . . . 0.0 110.021 -179.587 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 92' ' ' GLU . . . . . . . . . . . . . 47.1 tp10 -66.25 -37.37 85.34 Favored 'General case' 0 N--CA 1.49 1.544 0 O-C-N 121.334 -0.854 . . . . 0.0 109.63 -179.225 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 93' ' ' LEU . . . . . . . . . . . . . 6.2 tt -62.73 -44.26 96.66 Favored 'General case' 0 C--N 1.3 -1.561 0 O-C-N 121.219 -0.925 . . . . 0.0 109.819 -179.582 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 94' ' ' LYS . . . . . . . . . . . . . 68.0 mttm -65.29 -42.88 92.67 Favored 'General case' 0 N--CA 1.491 1.588 0 O-C-N 121.334 -0.853 . . . . 0.0 110.238 -179.633 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 95' ' ' THR . . . . . 0.494 ' CG2' ' CE2' ' A' ' 51' ' ' TYR . 19.7 p -65.2 -44.23 89.03 Favored 'General case' 0 N--CA 1.492 1.657 0 O-C-N 121.39 -0.819 . . . . 0.0 110.367 -179.048 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 96' ' ' ARG . . . . . 0.434 HH21 ' NH1' ' A' ' 100' ' ' ARG . 83.3 mtp180 -64.4 -39.53 94.03 Favored 'General case' 0 N--CA 1.491 1.597 0 O-C-N 121.176 -0.953 . . . . 0.0 109.659 -179.796 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 97' ' ' ALA . . . . . . . . . . . . . . . -61.65 -49.23 77.36 Favored 'General case' 0 N--CA 1.49 1.545 0 O-C-N 121.291 -0.88 . . . . 0.0 109.911 -179.687 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 98' ' ' LEU . . . . . . . . . . . . . 93.8 mt -65.48 -42.82 91.78 Favored 'General case' 0 N--CA 1.493 1.684 0 O-C-N 121.324 -0.86 . . . . 0.0 109.623 -179.831 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 99' ' ' ALA . . . . . . . . . . . . . . . -66.55 -37.53 85.17 Favored 'General case' 0 N--CA 1.491 1.576 0 O-C-N 121.416 -0.802 . . . . 0.0 109.673 -179.697 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 100' ' ' ARG . . . . . 0.434 ' NH1' HH21 ' A' ' 96' ' ' ARG . 96.6 mtt180 -90.96 1.89 56.68 Favored 'General case' 0 N--CA 1.492 1.63 0 N-CA-C 108.691 -0.855 . . . . 0.0 108.691 -179.769 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 101' ' ' LEU . . . . . . . . . . . . . 85.4 mt 58.29 179.98 0.07 Allowed 'General case' 0 N--CA 1.497 1.921 0 CA-C-O 121.733 0.777 . . . . 0.0 111.022 179.431 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 102' ' ' GLU . . . . . . . . . . . . . 12.7 pt-20 -172.21 134.84 0.73 Allowed 'General case' 0 N--CA 1.488 1.462 0 O-C-N 121.533 -0.729 . . . . 0.0 109.613 -179.908 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 103' ' ' HIS . . . . . . . . . . . . . 80.5 t60 -69.05 130.16 41.97 Favored 'General case' 0 N--CA 1.489 1.514 0 O-C-N 121.536 -0.728 . . . . 0.0 110.298 -179.051 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 104' ' ' HIS . . . . . . . . . . . . . 81.8 t60 -148.86 138.54 21.95 Favored 'General case' 0 N--CA 1.49 1.572 0 O-C-N 121.214 -0.929 . . . . 0.0 109.606 179.681 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 105' ' ' HIS . . . . . . . . . . . . . 80.5 m80 -87.47 120.09 28.42 Favored 'General case' 0 N--CA 1.489 1.48 0 O-C-N 121.395 -0.816 . . . . 0.0 109.786 -179.783 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 106' ' ' HIS . . . . . . . . . . . . . 85.1 t60 -66.16 -40.63 90.68 Favored 'General case' 0 N--CA 1.488 1.439 0 O-C-N 121.462 -0.774 . . . . 0.0 109.39 179.751 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 107' ' ' HIS . . . . . . . . . . . . . 81.9 t60 45.1 87.48 0.02 OUTLIER 'General case' 0 N--CA 1.492 1.631 0 CA-C-O 121.727 0.775 . . . . 0.0 109.883 -179.625 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 108' ' ' HIS . . . . . . . . . . . . . 58.9 t-80 . . . . . 0 N--CA 1.489 1.51 0 CA-C-O 117.998 -1.001 . . . . 0.0 109.959 -179.96 . . . . . . . . 0 0 . 1 . 019 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 85.0 mmm . . . . . 0 N--CA 1.489 1.476 0 N-CA-C 109.143 -0.688 . . . . 0.0 109.143 . . . . . . . . . 0 0 . 1 . 019 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 19.5 m -71.09 146.15 49.42 Favored 'General case' 0 N--CA 1.492 1.633 0 O-C-N 121.443 -0.786 . . . . 0.0 110.142 -179.804 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 3' ' ' ASN . . . . . . . . . . . . . 25.2 t-20 -92.29 107.08 18.95 Favored 'General case' 0 N--CA 1.492 1.625 0 O-C-N 121.422 -0.799 . . . . 0.0 109.831 -179.745 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 99.6 mm-40 -84.86 -81.26 0.19 Allowed 'General case' 0 N--CA 1.49 1.571 0 O-C-N 121.525 -0.735 . . . . 0.0 109.777 179.946 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 68.9 p -82.64 163.22 21.55 Favored 'General case' 0 N--CA 1.494 1.745 0 O-C-N 121.409 -0.807 . . . . 0.0 110.606 -179.102 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 8.1 t -83.52 114.96 21.86 Favored 'General case' 0 N--CA 1.49 1.535 0 CA-C-O 121.808 0.813 . . . . 0.0 109.844 -179.763 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 7' ' ' VAL . . . . . . . . . . . . . 70.9 t -66.73 -43.25 90.14 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.675 0 O-C-N 121.56 -0.712 . . . . 0.0 109.583 179.701 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 96.3 mt-10 -65.91 142.22 57.97 Favored 'General case' 0 N--CA 1.493 1.678 0 O-C-N 121.218 -0.926 . . . . 0.0 110.547 -179.032 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 52.1 p-10 -87.55 -3.35 58.99 Favored 'General case' 0 N--CA 1.49 1.568 0 O-C-N 121.421 -0.8 . . . . 0.0 109.271 179.863 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 52.8 tp10 -87.22 119.01 27.01 Favored 'General case' 0 N--CA 1.49 1.571 0 O-C-N 121.244 -0.91 . . . . 0.0 109.593 -179.821 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 9.0 p -153.3 -21.57 0.06 OUTLIER 'Isoleucine or valine' 0 N--CA 1.49 1.555 0 N-CA-C 108.694 -0.854 . . . . 0.0 108.694 179.728 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 35.1 m -89.98 107.73 19.29 Favored 'General case' 0 N--CA 1.494 1.761 0 O-C-N 121.38 -0.825 . . . . 0.0 109.777 -179.68 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 43.7 tt0 -174.07 -42.22 0.01 OUTLIER 'General case' 0 N--CA 1.49 1.571 0 N-CA-C 108.594 -0.891 . . . . 0.0 108.594 179.98 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 14' ' ' ALA . . . . . 0.555 ' O ' ' N ' ' A' ' 16' ' ' GLY . . . -176.7 147.48 0.63 Allowed 'General case' 0 N--CA 1.493 1.696 0 O-C-N 121.185 -0.947 . . . . 0.0 110.012 179.723 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 63.2 m 44.61 -88.1 0.01 OUTLIER 'General case' 0 N--CA 1.496 1.831 0 CA-C-O 121.426 0.631 . . . . 0.0 110.054 -179.715 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 16' ' ' GLY . . . . . 0.555 ' N ' ' O ' ' A' ' 14' ' ' ALA . . . 81.17 16.31 74.72 Favored Glycine 0 N--CA 1.492 2.402 0 N-CA-C 109.833 -1.307 . . . . 0.0 109.833 -179.917 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 1.2 p -65.42 -35.57 81.33 Favored 'General case' 0 N--CA 1.493 1.706 0 O-C-N 121.218 -1.166 . . . . 0.0 109.473 179.828 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . 52.03 16.92 0.59 Allowed 'General case' 0 N--CA 1.493 1.72 0 O-C-N 121.349 -0.844 . . . . 0.0 109.729 -179.588 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -177.1 139.53 4.44 Favored Glycine 0 N--CA 1.492 2.401 0 C-N-CA 119.937 -1.125 . . . . 0.0 110.393 179.608 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 79.6 tt0 58.32 101.5 0.02 OUTLIER 'General case' 0 N--CA 1.499 1.983 0 O-C-N 121.666 -0.902 . . . . 0.0 110.505 179.654 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 21' ' ' ILE . . . . . . . . . . . . . 9.3 tp -89.28 130.99 37.71 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.501 0 O-C-N 121.243 -0.91 . . . . 0.0 110.412 -179.648 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 176.86 -172.76 45.72 Favored Glycine 0 N--CA 1.489 2.209 0 N-CA-C 109.962 -1.255 . . . . 0.0 109.962 179.467 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 23' ' ' PHE . . . . . . . . . . . . . 65.2 m-85 -110.54 132.19 54.4 Favored 'General case' 0 N--CA 1.498 1.957 0 O-C-N 121.508 -0.995 . . . . 0.0 109.469 -179.978 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 35.3 mm -66.23 -43.29 91.88 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.628 0 O-C-N 121.525 -0.734 . . . . 0.0 109.758 -179.751 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 25' ' ' ILE . . . . . . . . . . . . . 90.0 mt -92.87 -91.85 0.08 OUTLIER 'Isoleucine or valine' 0 N--CA 1.497 1.916 0 O-C-N 120.894 -1.129 . . . . 0.0 110.277 -179.507 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 79.0 ttt-85 46.27 81.22 0.04 OUTLIER 'General case' 0 N--CA 1.49 1.554 0 CA-C-O 121.8 0.81 . . . . 0.0 109.774 -179.118 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 79.4 mm-40 -139.73 -164.35 1.67 Allowed 'General case' 0 N--CA 1.493 1.715 0 O-C-N 121.489 -0.757 . . . . 0.0 109.574 179.92 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . -154.56 -39.72 0.02 OUTLIER Glycine 0 N--CA 1.49 2.28 0 N-CA-C 109.133 -1.587 . . . . 0.0 109.133 -179.663 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 59.0 t0 -63.71 -50.76 67.91 Favored 'General case' 0 N--CA 1.496 1.874 0 O-C-N 121.349 -1.089 . . . . 0.0 110.233 -179.936 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 88.4 m-20 -98.8 1.12 45.61 Favored 'General case' 0 N--CA 1.497 1.9 0 O-C-N 121.016 -1.053 . . . . 0.0 109.03 179.725 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 52.0 t -124.61 134.77 65.9 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.934 0 O-C-N 121.482 -0.761 . . . . 0.0 109.324 -179.946 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -110.14 154.93 22.62 Favored 'General case' 0 N--CA 1.495 1.805 0 CA-C-O 121.695 0.76 . . . . 0.0 109.515 -179.946 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 95.8 mt-10 -87.68 126.48 34.99 Favored 'General case' 0 N--CA 1.489 1.518 0 CA-C-O 121.585 0.707 . . . . 0.0 109.653 -179.621 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 34' ' ' VAL . . . . . . . . . . . . . 53.7 t -124.99 134.99 65.52 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.712 0 CA-C-O 121.748 0.785 . . . . 0.0 109.198 -179.626 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 6.0 p -134.81 140.49 45.91 Favored 'General case' 0 N--CA 1.491 1.58 0 N-CA-C 108.89 -0.781 . . . . 0.0 108.89 179.878 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 36' ' ' LEU . . . . . 0.416 ' CD2' ' CZ ' ' A' ' 51' ' ' TYR . 0.2 OUTLIER -121.0 124.04 43.89 Favored 'General case' 0 N--CA 1.494 1.761 0 CA-C-O 121.709 0.766 . . . . 0.0 109.131 -179.662 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 37' ' ' PHE . . . . . . . . . . . . . 92.5 m-85 -99.79 146.02 27.05 Favored 'General case' 0 N--CA 1.492 1.656 0 O-C-N 121.506 -0.746 . . . . 0.0 109.777 179.872 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . -178.84 -169.31 39.3 Favored Glycine 0 N--CA 1.489 2.171 0 N-CA-C 109.837 -1.305 . . . . 0.0 109.837 -179.975 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 39' ' ' SER . . . . . 0.494 ' OG ' ' N ' ' A' ' 40' ' ' ASP . 3.0 t -82.23 -99.37 0.04 OUTLIER 'General case' 0 N--CA 1.491 1.606 0 O-C-N 121.634 -0.921 . . . . 0.0 109.91 -179.939 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 40' ' ' ASP . . . . . 0.494 ' N ' ' OG ' ' A' ' 39' ' ' SER . 97.4 m-20 -83.6 178.03 8.15 Favored 'General case' 0 N--CA 1.495 1.811 0 O-C-N 121.165 -0.959 . . . . 0.0 110.696 -179.464 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 87.9 tttt -63.62 -33.14 74.95 Favored 'General case' 0 N--CA 1.493 1.676 0 CA-C-O 121.404 0.621 . . . . 0.0 110.092 -179.795 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -60.53 -38.59 84.94 Favored 'General case' 0 N--CA 1.492 1.663 0 O-C-N 121.161 -0.962 . . . . 0.0 109.725 -179.533 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 43' ' ' HIS . . . . . . . . . . . . . 83.6 m-70 -68.43 -37.38 80.23 Favored 'General case' 0 N--CA 1.492 1.671 0 O-C-N 121.313 -0.867 . . . . 0.0 109.931 179.868 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 97.0 mt -63.61 -42.23 98.23 Favored 'General case' 0 N--CA 1.493 1.724 0 O-C-N 121.514 -0.741 . . . . 0.0 110.27 -178.953 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 98.0 mt-10 -69.69 -38.53 77.03 Favored 'General case' 0 C--N 1.299 -1.607 0 O-C-N 121.205 -0.934 . . . . 0.0 109.637 -179.852 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 46' ' ' GLY . . . . . 0.441 ' O ' ' OE1' ' A' ' 50' ' ' GLU . . . -62.78 -40.85 99.73 Favored Glycine 0 N--CA 1.493 2.435 0 N-CA-C 110.178 -1.169 . . . . 0.0 110.178 -179.644 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 56.7 mtpt -81.29 -21.75 39.1 Favored 'General case' 0 N--CA 1.489 1.485 0 O-C-N 121.365 -1.08 . . . . 0.0 109.316 179.905 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 57.6 tp -65.89 -38.15 88.0 Favored 'General case' 0 N--CA 1.492 1.668 0 O-C-N 121.542 -0.724 . . . . 0.0 109.787 179.838 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 49' ' ' ALA . . . . . . . . . . . . . . . -56.96 -34.74 68.35 Favored 'General case' 0 N--CA 1.493 1.725 0 O-C-N 121.359 -0.838 . . . . 0.0 109.861 -179.179 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 50' ' ' GLU . . . . . 0.564 ' N ' ' OE1' ' A' ' 50' ' ' GLU . 51.8 mp0 -67.28 -40.78 86.19 Favored 'General case' 0 C--N 1.299 -1.609 0 O-C-N 121.348 -0.845 . . . . 0.0 109.549 -179.909 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 51' ' ' TYR . . . . . 0.416 ' CZ ' ' CD2' ' A' ' 36' ' ' LEU . 3.9 m-85 -60.24 -42.83 96.12 Favored 'General case' 0 N--CA 1.492 1.665 0 O-C-N 121.407 -0.808 . . . . 0.0 109.821 -179.642 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 52' ' ' ILE . . . . . . . . . . . . . 95.7 mt -64.13 -42.67 96.3 Favored 'Isoleucine or valine' 0 C--N 1.298 -1.653 0 O-C-N 121.361 -0.837 . . . . 0.0 109.613 -179.676 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 48.4 m -52.92 -51.74 60.23 Favored 'General case' 0 N--CA 1.493 1.695 0 O-C-N 121.364 -0.835 . . . . 0.0 110.012 -178.951 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 54' ' ' LEU . . . . . 0.46 ' N ' ' CD2' ' A' ' 54' ' ' LEU . 4.2 mm? -65.31 -40.74 94.14 Favored 'General case' 0 N--CA 1.493 1.713 0 O-C-N 121.255 -0.903 . . . . 0.0 110.076 179.807 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -64.73 -38.37 90.77 Favored 'General case' 0 C--N 1.3 -1.563 0 O-C-N 121.373 -0.83 . . . . 0.0 110.08 -179.336 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 56' ' ' LYS . . . . . . . . . . . . . 45.4 tttp -63.77 -42.74 97.72 Favored 'General case' 0 N--CA 1.489 1.521 0 O-C-N 121.283 -0.886 . . . . 0.0 109.68 -179.683 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 77.0 mt-30 -65.75 -43.71 88.13 Favored 'General case' 0 N--CA 1.494 1.745 0 O-C-N 121.37 -0.831 . . . . 0.0 109.687 -179.765 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 58' ' ' VAL . . . . . . . . . . . . . 79.7 t -65.33 -44.74 94.7 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.675 0 O-C-N 121.383 -0.823 . . . . 0.0 109.518 -179.948 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 59' ' ' TYR . . . . . 0.425 ' O ' ' O ' ' A' ' 60' ' ' ALA . 62.6 t80 -126.66 133.14 51.04 Favored 'General case' 0 N--CA 1.497 1.902 0 CA-C-O 121.866 0.841 . . . . 0.0 109.406 -179.793 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 60' ' ' ALA . . . . . 0.425 ' O ' ' O ' ' A' ' 59' ' ' TYR . . . -44.43 -100.01 0.0 OUTLIER 'General case' 0 N--CA 1.493 1.679 0 CA-C-O 121.645 0.736 . . . . 0.0 111.129 -179.229 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 61' ' ' ASN . . . . . . . . . . . . . 10.4 m120 -87.11 90.29 8.3 Favored 'General case' 0 N--CA 1.491 1.59 0 O-C-N 121.334 -0.854 . . . . 0.0 109.351 -179.051 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 62' ' ' VAL . . . . . . . . . . . . . 11.0 p -80.15 136.68 22.93 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.552 0 O-C-N 121.571 -0.706 . . . . 0.0 109.768 -179.978 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 84.8 tt0 -113.64 138.39 50.26 Favored 'General case' 0 N--CA 1.495 1.784 0 CA-C-O 121.623 0.725 . . . . 0.0 109.178 -179.854 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 64' ' ' TYR . . . . . . . . . . . . . 50.7 p90 -148.36 162.64 39.14 Favored 'General case' 0 N--CA 1.491 1.614 0 O-C-N 121.413 -0.804 . . . . 0.0 109.962 -179.499 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 49.3 tp10 -139.69 145.73 38.75 Favored 'General case' 0 N--CA 1.493 1.686 0 N-CA-C 108.789 -0.819 . . . . 0.0 108.789 179.623 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 66' ' ' VAL . . . . . . . . . . . . . 27.2 m -115.52 128.03 72.88 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.764 0 CA-C-O 121.768 0.795 . . . . 0.0 110.018 -179.26 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -80.15 171.82 11.41 Favored Pre-proline 0 N--CA 1.488 1.446 0 N-CA-C 109.569 -0.53 . . . . 0.0 109.569 -179.85 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 68' ' ' PRO . . . . . . . . . . . . . 51.0 Cg_exo -51.68 129.5 30.11 Favored 'Trans proline' 0 N--CA 1.494 1.54 0 C-N-CA 122.428 2.085 . . . . 0.0 112.309 179.624 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 69' ' ' VAL . . . . . . . . . . . . . 51.0 t -131.51 134.1 61.05 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.794 0 CA-C-O 121.803 0.811 . . . . 0.0 109.899 179.911 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -73.01 153.07 41.05 Favored 'General case' 0 N--CA 1.49 1.541 0 CA-C-O 121.735 0.779 . . . . 0.0 110.335 -179.992 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 64.6 t0 -63.6 -36.1 82.7 Favored 'General case' 0 N--CA 1.49 1.563 0 CA-C-O 121.591 0.71 . . . . 0.0 109.322 179.308 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 72' ' ' ASN . . . . . . . . . . . . . 56.5 p30 -95.43 19.1 11.39 Favored 'General case' 0 N--CA 1.493 1.709 0 O-C-N 121.266 -0.897 . . . . 0.0 108.722 179.849 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -64.26 143.86 57.57 Favored 'General case' 0 N--CA 1.49 1.538 0 O-C-N 121.435 -0.791 . . . . 0.0 110.358 -179.715 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 74' ' ' THR . . . . . . . . . . . . . 6.3 p -106.18 -0.62 24.45 Favored 'General case' 0 N--CA 1.492 1.673 0 N-CA-C 108.589 -0.893 . . . . 0.0 108.589 179.268 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 80.9 tt0 -141.74 154.42 45.26 Favored 'General case' 0 N--CA 1.494 1.746 0 O-C-N 121.222 -0.924 . . . . 0.0 109.379 179.884 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 6.7 tp -117.03 131.89 56.83 Favored 'General case' 0 N--CA 1.493 1.699 0 O-C-N 121.569 -0.707 . . . . 0.0 109.512 -179.814 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 77' ' ' HIS . . . . . . . . . . . . . 7.4 t-160 -105.66 108.33 19.79 Favored 'General case' 0 N--CA 1.493 1.703 0 N-CA-C 109.062 -0.718 . . . . 0.0 109.062 179.846 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -147.01 159.35 43.68 Favored 'General case' 0 N--CA 1.492 1.653 0 O-C-N 121.353 -0.842 . . . . 0.0 109.596 -179.413 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 89.7 mtm-85 -131.8 148.95 52.59 Favored 'General case' 0 N--CA 1.496 1.846 0 O-C-N 121.639 -0.663 . . . . 0.0 109.356 -179.917 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 80' ' ' PHE . . . . . . . . . . . . . 28.3 m-85 -121.61 147.43 45.86 Favored 'General case' 0 N--CA 1.5 2.049 0 CA-C-O 121.669 0.747 . . . . 0.0 109.599 -179.802 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 64.2 tttp -109.26 114.02 27.35 Favored 'General case' 0 N--CA 1.491 1.618 0 CA-C-O 121.732 0.777 . . . . 0.0 109.37 179.903 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 82' ' ' PHE . . . . . . . . . . . . . 82.7 m-85 -100.98 -109.25 0.22 Allowed 'General case' 0 N--CA 1.494 1.725 0 CA-C-O 121.635 0.731 . . . . 0.0 109.561 -179.973 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 47.3 tp10 -168.78 -37.96 0.02 OUTLIER 'General case' 0 N--CA 1.489 1.493 0 N-CA-C 108.539 -0.912 . . . . 0.0 108.539 179.926 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 84' ' ' VAL . . . . . . . . . . . . . 27.3 m -133.77 161.94 40.24 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.909 0 O-C-N 121.471 -0.768 . . . . 0.0 109.63 -179.998 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 15.5 m -72.9 -19.63 61.24 Favored 'General case' 0 N--CA 1.491 1.597 0 O-C-N 121.464 -0.773 . . . . 0.0 109.274 179.825 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 86' ' ' ALA . . . . . . . . . . . . . . . -63.43 -39.52 94.7 Favored 'General case' 0 N--CA 1.492 1.634 0 O-C-N 121.215 -0.928 . . . . 0.0 109.714 -179.98 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 97.0 mt-10 -71.01 -32.26 69.01 Favored 'General case' 0 N--CA 1.493 1.691 0 O-C-N 121.334 -0.854 . . . . 0.0 109.37 179.731 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 88' ' ' LYS . . . . . . . . . . . . . 14.4 tmtt? -62.18 -48.01 81.97 Favored 'General case' 0 C--N 1.302 -1.49 0 O-C-N 121.33 -0.856 . . . . 0.0 110.013 -179.803 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 94.0 mt -64.97 -42.94 94.12 Favored 'General case' 0 N--CA 1.492 1.659 0 O-C-N 121.338 -0.851 . . . . 0.0 109.372 -179.68 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 90' ' ' ILE . . . . . 0.418 HD11 HG23 ' A' ' 90' ' ' ILE . 95.1 mt -65.36 -45.45 93.19 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.645 0 CA-C-O 121.737 0.779 . . . . 0.0 109.512 -179.91 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 91' ' ' PHE . . . . . . . . . . . . . 80.9 t80 -66.0 -44.07 85.9 Favored 'General case' 0 N--CA 1.49 1.568 0 CA-C-O 121.724 0.773 . . . . 0.0 109.845 -179.909 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 92' ' ' GLU . . . . . . . . . . . . . 48.4 tp10 -59.97 -38.7 83.28 Favored 'General case' 0 N--CA 1.491 1.61 0 O-C-N 121.445 -0.785 . . . . 0.0 109.469 -179.163 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 93' ' ' LEU . . . . . . . . . . . . . 5.5 tt -63.53 -44.35 94.48 Favored 'General case' 0 C--N 1.297 -1.679 0 O-C-N 121.38 -0.825 . . . . 0.0 109.865 179.974 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 94' ' ' LYS . . . . . . . . . . . . . 62.5 mttp -65.7 -41.64 92.13 Favored 'General case' 0 N--CA 1.492 1.674 0 O-C-N 121.433 -0.792 . . . . 0.0 109.77 -179.878 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 23.4 p -66.59 -38.6 87.38 Favored 'General case' 0 N--CA 1.493 1.688 0 O-C-N 121.315 -0.866 . . . . 0.0 109.653 -179.782 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 96' ' ' ARG . . . . . . . . . . . . . 25.1 mmt180 -65.14 -40.97 95.13 Favored 'General case' 0 N--CA 1.492 1.663 0 O-C-N 121.227 -0.921 . . . . 0.0 109.935 179.739 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 97' ' ' ALA . . . . . 0.496 ' O ' ' N ' ' A' ' 101' ' ' LEU . . . -63.39 -48.56 77.38 Favored 'General case' 0 C--N 1.3 -1.578 0 O-C-N 121.323 -0.861 . . . . 0.0 109.839 -179.688 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 98' ' ' LEU . . . . . . . . . . . . . 95.6 mt -64.89 -42.68 94.59 Favored 'General case' 0 N--CA 1.493 1.682 0 O-C-N 121.496 -0.752 . . . . 0.0 109.796 -179.845 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 99' ' ' ALA . . . . . . . . . . . . . . . -67.57 -40.04 84.88 Favored 'General case' 0 N--CA 1.492 1.654 0 O-C-N 121.313 -0.867 . . . . 0.0 109.859 -179.873 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 100' ' ' ARG . . . . . . . . . . . . . 85.9 mmt-85 -90.67 -6.46 54.49 Favored 'General case' 0 N--CA 1.495 1.786 0 CA-C-O 121.889 0.852 . . . . 0.0 109.067 -179.539 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 101' ' ' LEU . . . . . 0.496 ' N ' ' O ' ' A' ' 97' ' ' ALA . 5.9 tp 59.34 153.69 0.02 OUTLIER 'General case' 0 C--N 1.296 -1.726 0 CA-C-O 121.794 0.807 . . . . 0.0 110.604 179.507 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 102' ' ' GLU . . . . . 0.441 ' O ' ' O ' ' A' ' 101' ' ' LEU . 79.8 mm-40 -43.23 167.99 0.0 OUTLIER 'General case' 0 N--CA 1.49 1.54 0 CA-C-O 121.728 0.775 . . . . 0.0 110.357 179.979 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 103' ' ' HIS . . . . . . . . . . . . . 21.2 m170 58.77 13.37 2.66 Favored 'General case' 0 N--CA 1.491 1.594 0 N-CA-C 108.889 -0.782 . . . . 0.0 108.889 -179.491 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 104' ' ' HIS . . . . . . . . . . . . . 92.8 m-70 44.79 55.15 6.19 Favored 'General case' 0 N--CA 1.493 1.72 0 O-C-N 121.413 -0.804 . . . . 0.0 109.918 179.887 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 105' ' ' HIS . . . . . . . . . . . . . 86.3 t60 42.21 89.68 0.01 OUTLIER 'General case' 0 N--CA 1.494 1.77 0 CA-C-O 121.644 0.735 . . . . 0.0 110.035 179.732 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 106' ' ' HIS . . . . . . . . . . . . . 56.8 p-80 -69.04 139.12 54.89 Favored 'General case' 0 N--CA 1.489 1.488 0 CA-C-O 121.789 0.804 . . . . 0.0 110.301 -179.431 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 107' ' ' HIS . . . . . . . . . . . . . 80.3 m80 -77.32 140.72 40.06 Favored 'General case' 0 N--CA 1.489 1.48 0 CA-C-O 121.686 0.755 . . . . 0.0 110.228 -179.392 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 108' ' ' HIS . . . . . . . . . . . . . 86.4 t60 . . . . . 0 N--CA 1.492 1.639 0 CA-C-O 117.91 -1.043 . . . . 0.0 110.45 -179.645 . . . . . . . . 0 0 . 1 . 020 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 78.1 mtm . . . . . 0 N--CA 1.489 1.504 0 CA-C-O 121.588 0.708 . . . . 0.0 109.738 . . . . . . . . . 0 0 . 1 . 020 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 4.6 t 57.03 57.43 4.61 Favored 'General case' 0 N--CA 1.492 1.665 0 CA-C-O 121.869 0.842 . . . . 0.0 109.402 179.99 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 3' ' ' ASN . . . . . . . . . . . . . 92.5 m-20 -85.61 107.44 17.52 Favored 'General case' 0 N--CA 1.494 1.751 0 O-C-N 121.39 -0.819 . . . . 0.0 109.629 179.998 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 99.4 mm-40 -84.04 -122.47 0.03 OUTLIER 'General case' 0 N--CA 1.491 1.622 0 O-C-N 121.387 -0.821 . . . . 0.0 110.083 -179.683 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 5' ' ' THR . . . . . 0.404 ' O ' ' O ' ' A' ' 6' ' ' CYS . 80.3 m -97.77 -17.15 19.54 Favored 'General case' 0 N--CA 1.494 1.734 0 O-C-N 121.351 -0.843 . . . . 0.0 109.488 -179.765 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 6' ' ' CYS . . . . . 0.404 ' O ' ' O ' ' A' ' 5' ' ' THR . 5.1 m 60.86 121.51 0.01 OUTLIER 'General case' 0 N--CA 1.494 1.755 0 O-C-N 121.377 -0.827 . . . . 0.0 110.141 179.953 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 7' ' ' VAL . . . . . . . . . . . . . 2.1 p -100.19 131.08 48.37 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.832 0 CA-C-O 121.86 0.838 . . . . 0.0 109.977 -179.359 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 8' ' ' GLU . . . . . 0.505 ' O ' ' ND2' ' A' ' 9' ' ' ASN . 15.7 pt-20 -70.2 145.76 51.21 Favored 'General case' 0 N--CA 1.492 1.63 0 CA-C-O 121.734 0.778 . . . . 0.0 110.715 -179.413 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 9' ' ' ASN . . . . . 0.505 ' ND2' ' O ' ' A' ' 8' ' ' GLU . 0.8 OUTLIER 43.65 34.89 0.9 Allowed 'General case' 0 N--CA 1.492 1.648 0 CA-C-O 122.01 0.91 . . . . 0.0 109.049 -179.859 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 97.2 mt-10 43.14 -166.54 0.01 OUTLIER 'General case' 0 N--CA 1.489 1.504 0 CA-C-O 121.717 0.77 . . . . 0.0 110.438 -179.97 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 46.2 t -77.58 -1.87 4.21 Favored 'Isoleucine or valine' 0 C--N 1.299 -1.595 0 O-C-N 121.38 -0.825 . . . . 0.0 109.009 -179.854 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 42.2 t 46.17 40.61 7.59 Favored 'General case' 0 N--CA 1.493 1.725 0 CA-C-O 121.848 0.832 . . . . 0.0 109.498 179.93 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 13' ' ' GLU . . . . . 0.424 ' CD ' ' N ' ' A' ' 14' ' ' ALA . 12.8 tm-20 -64.08 139.77 58.8 Favored 'General case' 0 N--CA 1.489 1.495 0 O-C-N 121.436 -0.79 . . . . 0.0 110.012 -179.905 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 14' ' ' ALA . . . . . 0.424 ' N ' ' CD ' ' A' ' 13' ' ' GLU . . . -159.83 2.21 0.08 Allowed 'General case' 0 C--N 1.3 -1.573 0 N-CA-C 108.645 -0.872 . . . . 0.0 108.645 179.763 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 97.1 m -66.79 -39.1 87.67 Favored 'General case' 0 N--CA 1.496 1.831 0 O-C-N 121.281 -0.887 . . . . 0.0 109.468 179.876 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . -71.31 141.42 32.46 Favored Glycine 0 N--CA 1.493 2.467 0 N-CA-C 110.399 -1.08 . . . . 0.0 110.399 -179.337 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 76.2 m -129.21 153.77 47.43 Favored 'General case' 0 N--CA 1.496 1.87 0 O-C-N 121.454 -1.027 . . . . 0.0 110.257 -179.921 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . 59.6 146.99 0.01 OUTLIER 'General case' 0 N--CA 1.493 1.678 0 CA-C-O 121.646 0.736 . . . . 0.0 110.652 179.589 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 169.86 -161.63 34.93 Favored Glycine 0 N--CA 1.489 2.202 0 C-N-CA 119.947 -1.121 . . . . 0.0 110.556 -179.967 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 20' ' ' GLU . . . . . 0.517 ' OE1' ' N ' ' A' ' 22' ' ' GLY . 2.6 pp20? -52.47 145.18 11.92 Favored 'General case' 0 N--CA 1.493 1.717 0 O-C-N 121.698 -0.884 . . . . 0.0 110.935 -179.092 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 21' ' ' ILE . . . . . 0.425 HD13 HG22 ' A' ' 21' ' ' ILE . 90.7 mt -65.11 -42.94 95.67 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.56 0 CA-C-O 121.683 0.754 . . . . 0.0 109.194 179.635 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 22' ' ' GLY . . . . . 0.517 ' N ' ' OE1' ' A' ' 20' ' ' GLU . . . 83.57 -150.99 27.48 Favored Glycine 0 N--CA 1.486 2.005 0 N-CA-C 110.545 -1.022 . . . . 0.0 110.545 179.512 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 23' ' ' PHE . . . . . . . . . . . . . 93.0 m-85 -72.63 151.5 42.27 Favored 'General case' 0 C--N 1.299 -1.624 0 O-C-N 121.697 -0.884 . . . . 0.0 110.093 -179.282 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 24' ' ' ILE . . . . . 0.401 HD12 HG22 ' A' ' 24' ' ' ILE . 97.1 mt -63.48 -42.63 96.91 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.55 0 CA-C-O 121.682 0.753 . . . . 0.0 109.672 179.819 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 25' ' ' ILE . . . . . . . . . . . . . 65.2 mt -63.43 -42.26 95.63 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.651 0 O-C-N 121.293 -0.88 . . . . 0.0 109.556 -179.487 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 26' ' ' ARG . . . . . 0.411 ' O ' ' O ' ' A' ' 27' ' ' GLU . 33.1 ttm180 61.48 59.41 1.88 Allowed 'General case' 0 C--N 1.304 -1.388 0 CA-C-O 121.813 0.816 . . . . 0.0 109.585 -179.909 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 27' ' ' GLU . . . . . 0.411 ' O ' ' O ' ' A' ' 26' ' ' ARG . 82.9 tt0 39.98 93.48 0.01 OUTLIER 'General case' 0 N--CA 1.495 1.798 0 CA-C-O 121.771 0.796 . . . . 0.0 110.374 179.711 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 28' ' ' GLY . . . . . 0.521 ' O ' ' N ' ' A' ' 30' ' ' ASP . . . -84.91 49.2 4.2 Favored Glycine 0 N--CA 1.492 2.38 0 N-CA-C 109.712 -1.355 . . . . 0.0 109.712 -179.818 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 4.0 p-10 41.85 21.91 0.01 OUTLIER 'General case' 0 N--CA 1.497 1.924 0 O-C-N 121.722 -0.869 . . . . 0.0 110.0 179.804 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 30' ' ' ASP . . . . . 0.521 ' N ' ' O ' ' A' ' 28' ' ' GLY . 51.1 p30 -159.83 43.83 0.22 Allowed 'General case' 0 C--N 1.301 -1.501 0 O-C-N 121.336 -0.853 . . . . 0.0 109.18 179.692 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 52.6 t -122.7 135.83 61.48 Favored 'Isoleucine or valine' 0 N--CA 1.502 2.142 0 O-C-N 121.403 -0.811 . . . . 0.0 109.775 -179.609 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 32' ' ' ALA . . . . . 0.579 ' CB ' ' HZ3' ' A' ' 88' ' ' LYS . . . -113.83 151.73 31.67 Favored 'General case' 0 N--CA 1.496 1.856 0 CA-C-O 121.42 0.629 . . . . 0.0 109.601 -179.967 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 40.3 tt0 -109.04 145.62 35.29 Favored 'General case' 0 N--CA 1.496 1.867 0 CA-C-O 121.499 0.666 . . . . 0.0 110.266 -179.312 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 34' ' ' VAL . . . . . . . . . . . . . 55.5 t -124.46 131.95 72.03 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.887 0 CA-C-O 121.487 0.661 . . . . 0.0 109.435 179.96 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 56.8 m -108.33 121.83 45.72 Favored 'General case' 0 N--CA 1.496 1.836 0 N-CA-C 109.264 -0.643 . . . . 0.0 109.264 179.542 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 49.5 tp -121.98 135.77 54.88 Favored 'General case' 0 N--CA 1.495 1.793 0 CA-C-O 121.595 0.712 . . . . 0.0 109.656 179.856 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 37' ' ' PHE . . . . . . . . . . . . . 86.1 t80 -113.17 138.12 50.43 Favored 'General case' 0 N--CA 1.494 1.73 0 CA-C-O 121.578 0.704 . . . . 0.0 109.69 -179.851 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . -169.11 -170.51 33.79 Favored Glycine 0 N--CA 1.489 2.189 0 N-CA-C 110.15 -1.18 . . . . 0.0 110.15 -179.849 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 32.8 p -82.36 -108.9 0.03 OUTLIER 'General case' 0 N--CA 1.491 1.585 0 O-C-N 121.677 -0.896 . . . . 0.0 110.104 -179.69 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 40' ' ' ASP . . . . . . . . . . . . . 99.4 m-20 -81.05 175.13 10.94 Favored 'General case' 0 N--CA 1.493 1.72 0 O-C-N 121.192 -0.943 . . . . 0.0 110.698 -179.352 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 88.6 tttt -62.71 -41.98 99.42 Favored 'General case' 0 N--CA 1.491 1.624 0 CA-C-O 121.527 0.679 . . . . 0.0 109.966 -179.892 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -54.01 -46.29 71.73 Favored 'General case' 0 N--CA 1.492 1.662 0 O-C-N 121.394 -0.816 . . . . 0.0 109.796 -179.451 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 43' ' ' HIS . . . . . 0.627 ' CE1' ' HZ3' ' A' ' 47' ' ' LYS . 82.9 t60 -66.67 -42.65 86.24 Favored 'General case' 0 N--CA 1.493 1.682 0 O-C-N 121.283 -0.885 . . . . 0.0 109.72 179.829 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 37.0 mt -63.29 -41.26 98.97 Favored 'General case' 0 N--CA 1.496 1.851 0 O-C-N 121.333 -0.855 . . . . 0.0 109.877 -179.94 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 66.0 mm-40 -62.46 -38.23 88.97 Favored 'General case' 0 N--CA 1.49 1.565 0 O-C-N 121.439 -0.788 . . . . 0.0 109.623 -179.775 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . -59.3 -53.91 42.27 Favored Glycine 0 N--CA 1.494 2.504 0 N-CA-C 109.519 -1.432 . . . . 0.0 109.519 -179.884 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 47' ' ' LYS . . . . . 0.627 ' HZ3' ' CE1' ' A' ' 43' ' ' HIS . 47.6 mttp -66.47 -37.63 85.54 Favored 'General case' 0 N--CA 1.493 1.683 0 O-C-N 121.456 -1.026 . . . . 0.0 109.605 179.02 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 49.0 tp -51.84 -34.07 38.85 Favored 'General case' 0 N--CA 1.494 1.746 0 CA-C-O 121.657 0.742 . . . . 0.0 109.681 -179.373 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 49' ' ' ALA . . . . . . . . . . . . . . . -56.37 -34.46 66.67 Favored 'General case' 0 N--CA 1.491 1.612 0 O-C-N 121.354 -0.841 . . . . 0.0 109.635 -179.698 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 80.5 mm-40 -66.46 -43.16 86.26 Favored 'General case' 0 N--CA 1.495 1.79 0 O-C-N 121.259 -0.9 . . . . 0.0 109.974 -179.923 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 64.0 m-85 -64.1 -44.53 92.02 Favored 'General case' 0 N--CA 1.495 1.816 0 O-C-N 121.325 -0.859 . . . . 0.0 109.872 -179.727 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 52' ' ' ILE . . . . . 0.403 HD13 HG23 ' A' ' 52' ' ' ILE . 96.4 mt -65.18 -43.75 95.45 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.732 0 O-C-N 121.287 -0.883 . . . . 0.0 109.677 -179.987 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 60.9 m -61.86 -41.14 97.48 Favored 'General case' 0 N--CA 1.493 1.697 0 O-C-N 121.293 -0.879 . . . . 0.0 109.729 -179.844 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 54' ' ' LEU . . . . . . . . . . . . . 46.6 tp -63.79 -40.98 97.97 Favored 'General case' 0 N--CA 1.491 1.605 0 O-C-N 121.248 -0.907 . . . . 0.0 109.643 -179.988 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -60.12 -40.65 90.46 Favored 'General case' 0 N--CA 1.491 1.604 0 O-C-N 121.378 -0.826 . . . . 0.0 109.392 -179.355 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 56' ' ' LYS . . . . . . . . . . . . . 98.4 mttt -65.19 -41.52 94.48 Favored 'General case' 0 N--CA 1.491 1.582 0 O-C-N 121.456 -0.777 . . . . 0.0 109.551 179.587 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 67.5 tp60 -65.21 -46.33 81.12 Favored 'General case' 0 N--CA 1.493 1.709 0 O-C-N 121.32 -0.862 . . . . 0.0 109.919 -179.399 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 58' ' ' VAL . . . . . . . . . . . . . 88.0 t -65.23 -43.87 95.25 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.572 0 O-C-N 121.199 -0.938 . . . . 0.0 109.118 -179.979 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 59' ' ' TYR . . . . . . . . . . . . . 45.1 t80 -138.54 117.99 12.9 Favored 'General case' 0 N--CA 1.496 1.865 0 O-C-N 121.433 -0.792 . . . . 0.0 109.545 -179.806 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -69.39 149.11 48.73 Favored 'General case' 0 N--CA 1.492 1.64 0 CA-C-O 121.714 0.768 . . . . 0.0 110.625 -179.615 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 61' ' ' ASN . . . . . . . . . . . . . 8.8 t-20 60.09 39.35 19.76 Favored 'General case' 0 N--CA 1.491 1.613 0 CA-C-O 121.779 0.8 . . . . 0.0 109.472 179.806 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 62' ' ' VAL . . . . . . . . . . . . . 14.1 p -76.67 139.15 19.3 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.762 0 O-C-N 121.438 -0.789 . . . . 0.0 110.523 -179.967 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 96.0 mt-10 -106.05 136.09 46.34 Favored 'General case' 0 N--CA 1.497 1.891 0 CA-C-O 121.756 0.789 . . . . 0.0 109.594 179.944 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 64' ' ' TYR . . . . . . . . . . . . . 50.4 p90 -151.03 162.98 39.82 Favored 'General case' 0 N--CA 1.49 1.54 0 O-C-N 121.458 -0.776 . . . . 0.0 109.681 -179.478 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 79.8 mm-40 -139.5 152.45 46.97 Favored 'General case' 0 N--CA 1.495 1.78 0 O-C-N 121.408 -0.808 . . . . 0.0 109.643 179.853 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 66' ' ' VAL . . . . . . . . . . . . . 53.8 t -113.44 129.87 68.45 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.75 0 CA-C-O 121.718 0.771 . . . . 0.0 109.218 -179.679 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -77.06 168.88 24.37 Favored Pre-proline 0 C--N 1.302 -1.486 0 O-C-N 121.727 -0.608 . . . . 0.0 109.766 -179.55 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 68' ' ' PRO . . . . . . . . . . . . . 27.8 Cg_exo -59.04 143.25 99.88 Favored 'Trans proline' 0 N--CA 1.493 1.483 0 C-N-CA 122.371 2.047 . . . . 0.0 112.354 179.557 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 69' ' ' VAL . . . . . 0.541 ' C ' ' H ' ' A' ' 71' ' ' ASP . 47.2 t -120.99 132.58 70.12 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.74 0 CA-C-O 121.676 0.751 . . . . 0.0 109.589 -179.856 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 70' ' ' ALA . . . . . 0.62 ' O ' ' N ' ' A' ' 72' ' ' ASN . . . -74.42 30.49 0.08 Allowed 'General case' 0 N--CA 1.491 1.602 0 O-C-N 121.576 -0.703 . . . . 0.0 109.453 179.861 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 71' ' ' ASP . . . . . 0.541 ' H ' ' C ' ' A' ' 69' ' ' VAL . 25.0 t0 55.6 -71.74 0.01 OUTLIER 'General case' 0 N--CA 1.493 1.7 0 CA-C-O 121.625 0.726 . . . . 0.0 110.728 179.658 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 72' ' ' ASN . . . . . 0.62 ' N ' ' O ' ' A' ' 70' ' ' ALA . 64.3 t30 -75.51 -2.15 27.58 Favored 'General case' 0 C--N 1.299 -1.628 0 O-C-N 121.299 -0.876 . . . . 0.0 109.429 -179.723 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -43.95 146.84 0.55 Allowed 'General case' 0 N--CA 1.496 1.843 0 O-C-N 121.306 -0.871 . . . . 0.0 110.125 179.974 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 74' ' ' THR . . . . . . . . . . . . . 5.0 p -96.74 0.15 49.09 Favored 'General case' 0 N--CA 1.492 1.658 0 O-C-N 121.385 -0.822 . . . . 0.0 108.965 -179.922 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 21.6 pt-20 -144.78 156.63 44.15 Favored 'General case' 0 N--CA 1.495 1.782 0 O-C-N 121.133 -0.979 . . . . 0.0 109.862 179.855 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 6.8 tt -126.4 133.26 51.33 Favored 'General case' 0 N--CA 1.492 1.644 0 CA-C-O 121.62 0.724 . . . . 0.0 109.267 -180.0 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 77' ' ' HIS . . . . . . . . . . . . . 73.8 m80 -105.76 129.37 53.97 Favored 'General case' 0 N--CA 1.495 1.819 0 O-C-N 121.626 -0.671 . . . . 0.0 109.639 -179.664 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -140.75 155.87 46.32 Favored 'General case' 0 N--CA 1.494 1.775 0 O-C-N 121.359 -0.838 . . . . 0.0 109.787 -179.774 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 95.7 mtt180 -128.04 147.16 50.51 Favored 'General case' 0 N--CA 1.497 1.876 0 CA-C-O 121.402 0.62 . . . . 0.0 109.83 -179.716 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 80' ' ' PHE . . . . . . . . . . . . . 83.8 m-85 -127.96 148.04 50.5 Favored 'General case' 0 N--CA 1.496 1.871 0 CA-C-O 121.451 0.643 . . . . 0.0 109.568 -179.851 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 81' ' ' LYS . . . . . 0.49 ' HZ1' ' CG ' ' A' ' 30' ' ' ASP . 63.4 tttp -111.37 127.35 55.63 Favored 'General case' 0 N--CA 1.494 1.739 0 N-CA-C 109.207 -0.664 . . . . 0.0 109.207 179.94 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 82' ' ' PHE . . . . . . . . . . . . . 78.0 m-85 -122.54 145.04 48.69 Favored 'General case' 0 N--CA 1.494 1.746 0 CA-C-O 121.875 0.845 . . . . 0.0 109.649 -179.782 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 32.4 mm-40 -69.46 -32.76 71.89 Favored 'General case' 0 C--N 1.299 -1.608 0 O-C-N 121.751 -0.593 . . . . 0.0 109.638 -179.815 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 84' ' ' VAL . . . . . . . . . . . . . 3.2 m -130.61 157.28 42.98 Favored 'Isoleucine or valine' 0 N--CA 1.499 1.999 0 CA-C-O 121.915 0.864 . . . . 0.0 110.397 -179.427 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 85' ' ' SER . . . . . 0.497 ' O ' ' N ' ' A' ' 88' ' ' LYS . 38.9 t -67.63 -40.2 84.65 Favored 'General case' 0 N--CA 1.492 1.626 0 CA-C-O 121.535 0.683 . . . . 0.0 110.213 179.645 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 86' ' ' ALA . . . . . 0.423 ' C ' ' O ' ' A' ' 85' ' ' SER . . . -40.85 -44.24 2.22 Favored 'General case' 0 N--CA 1.496 1.845 0 O-C-N 121.397 -0.815 . . . . 0.0 110.356 -179.042 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 98.2 mt-10 -66.03 -30.14 70.63 Favored 'General case' 0 C--N 1.299 -1.62 0 O-C-N 121.279 -0.888 . . . . 0.0 110.08 179.895 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 88' ' ' LYS . . . . . 0.579 ' HZ3' ' CB ' ' A' ' 32' ' ' ALA . 65.0 tttp -63.38 -46.8 84.8 Favored 'General case' 0 N--CA 1.494 1.727 0 O-C-N 121.068 -1.02 . . . . 0.0 110.062 -179.904 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 89' ' ' LEU . . . . . 0.505 ' CD2' ' N ' ' A' ' 89' ' ' LEU . 3.6 mm? -63.37 -47.58 81.49 Favored 'General case' 0 N--CA 1.493 1.723 0 O-C-N 121.23 -0.919 . . . . 0.0 110.128 -179.2 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 90' ' ' ILE . . . . . 0.487 ' CD1' ' N ' ' A' ' 90' ' ' ILE . 1.3 mp -69.19 -43.69 81.3 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.636 0 O-C-N 121.271 -0.893 . . . . 0.0 109.521 179.634 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 91' ' ' PHE . . . . . . . . . . . . . 62.2 t80 -60.37 -46.41 90.04 Favored 'General case' 0 C--N 1.298 -1.651 0 O-C-N 121.456 -0.778 . . . . 0.0 109.869 -179.116 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 92' ' ' GLU . . . . . 0.495 ' OE2' ' NZ ' ' A' ' 88' ' ' LYS . 97.1 mt-10 -67.74 -37.95 82.85 Favored 'General case' 0 N--CA 1.49 1.561 0 O-C-N 121.395 -0.816 . . . . 0.0 109.998 179.903 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 93' ' ' LEU . . . . . . . . . . . . . 6.4 tt -64.05 -46.82 82.71 Favored 'General case' 0 N--CA 1.49 1.575 0 O-C-N 121.129 -0.982 . . . . 0.0 110.156 -179.708 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 94' ' ' LYS . . . . . . . . . . . . . 96.1 mttt -66.91 -45.45 77.89 Favored 'General case' 0 N--CA 1.495 1.794 0 O-C-N 121.383 -0.823 . . . . 0.0 110.2 179.996 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 21.5 p -67.44 -41.47 84.71 Favored 'General case' 0 N--CA 1.492 1.665 0 O-C-N 121.23 -0.919 . . . . 0.0 109.61 -179.698 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 96' ' ' ARG . . . . . 0.435 ' CG ' ' O ' ' A' ' 92' ' ' GLU . 8.0 mmp_? -64.38 -43.81 93.3 Favored 'General case' 0 N--CA 1.49 1.565 0 O-C-N 121.221 -0.924 . . . . 0.0 109.698 179.825 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 97' ' ' ALA . . . . . . . . . . . . . . . -69.49 -40.15 77.22 Favored 'General case' 0 C--N 1.3 -1.55 0 CA-C-O 121.771 0.796 . . . . 0.0 109.204 179.767 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 98' ' ' LEU . . . . . . . . . . . . . 7.0 tt -64.72 -42.22 95.41 Favored 'General case' 0 C--N 1.302 -1.485 0 O-C-N 121.329 -0.857 . . . . 0.0 109.147 179.597 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 99' ' ' ALA . . . . . . . . . . . . . . . -64.15 -37.28 86.87 Favored 'General case' 0 N--CA 1.491 1.583 0 CA-C-O 121.723 0.773 . . . . 0.0 109.092 179.814 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 100' ' ' ARG . . . . . 0.417 ' O ' ' O ' ' A' ' 101' ' ' LEU . 89.3 mtm180 -80.99 -15.4 56.31 Favored 'General case' 0 N--CA 1.493 1.701 0 O-C-N 121.353 -0.842 . . . . 0.0 109.292 179.757 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 101' ' ' LEU . . . . . 0.437 ' O ' ' O ' ' A' ' 102' ' ' GLU . 83.0 mt 53.72 168.33 0.02 OUTLIER 'General case' 0 N--CA 1.495 1.779 0 CA-C-O 121.858 0.837 . . . . 0.0 110.738 179.735 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 102' ' ' GLU . . . . . 0.437 ' O ' ' O ' ' A' ' 101' ' ' LEU . 83.0 tt0 41.52 95.14 0.01 OUTLIER 'General case' 0 N--CA 1.491 1.591 0 CA-C-O 121.582 0.706 . . . . 0.0 110.186 -179.689 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 103' ' ' HIS . . . . . 0.457 ' ND1' ' O ' ' A' ' 103' ' ' HIS . 57.1 t-80 -137.39 27.57 2.82 Favored 'General case' 0 N--CA 1.493 1.68 0 N-CA-C 108.787 -0.82 . . . . 0.0 108.787 179.622 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 104' ' ' HIS . . . . . 0.541 ' HD1' ' N ' ' A' ' 105' ' ' HIS . 0.0 OUTLIER -135.72 2.46 2.91 Favored 'General case' 0 N--CA 1.497 1.897 0 N-CA-C 108.692 -0.855 . . . . 0.0 108.692 179.658 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 105' ' ' HIS . . . . . 0.541 ' N ' ' HD1' ' A' ' 104' ' ' HIS . 76.6 t60 -66.08 -41.71 90.36 Favored 'General case' 0 N--CA 1.494 1.743 0 O-C-N 121.406 -0.809 . . . . 0.0 109.141 179.331 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 106' ' ' HIS . . . . . . . . . . . . . 38.0 p-80 -150.82 143.1 24.21 Favored 'General case' 0 N--CA 1.493 1.69 0 O-C-N 121.211 -0.93 . . . . 0.0 109.962 -179.988 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 107' ' ' HIS . . . . . 0.445 ' O ' ' OXT' ' A' ' 108' ' ' HIS . 86.0 t60 -87.82 -57.08 3.07 Favored 'General case' 0 N--CA 1.492 1.661 0 O-C-N 121.537 -0.727 . . . . 0.0 109.131 179.69 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 108' ' ' HIS . . . . . 0.445 ' OXT' ' O ' ' A' ' 107' ' ' HIS . 36.9 m-70 . . . . . 0 N--CA 1.5 2.068 0 CA-C-O 117.922 -1.037 . . . . 0.0 110.815 179.577 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 83.3 m-20 . . . . . 0 N--CA 1.494 1.76 0 N-CA-C 109.005 -0.739 . . . . 0.0 109.005 . . . . . . . . . 0 0 . 1 . 001 nuclear build core ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 51.3 t -124.8 136.1 61.83 Favored 'Isoleucine or valine' 0 N--CA 1.499 2.016 0 CA-C-O 121.728 0.775 . . . . 0.0 109.712 179.886 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -123.9 148.1 47.12 Favored 'General case' 0 N--CA 1.496 1.861 0 CA-C-O 121.86 0.838 . . . . 0.0 109.913 -179.961 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 96.7 mt-10 -104.42 142.01 35.33 Favored 'General case' 0 N--CA 1.496 1.85 0 CA-C-O 121.737 0.78 . . . . 0.0 109.984 -179.702 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 34' ' ' VAL . . . . . . . . . . . . . 55.5 t -125.89 132.84 70.24 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.769 0 CA-C-O 121.638 0.732 . . . . 0.0 109.331 -179.967 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 45.5 t -126.24 110.73 13.76 Favored 'General case' 0 N--CA 1.494 1.761 0 CA-C-O 121.678 0.752 . . . . 0.0 109.61 179.778 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 36' ' ' LEU . . . . . 0.544 HD13 ' OH ' ' A' ' 51' ' ' TYR . 51.4 tp -121.98 146.64 46.96 Favored 'General case' 0 N--CA 1.497 1.886 0 CA-C-O 121.818 0.818 . . . . 0.0 109.512 179.827 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 37' ' ' PHE . . . . . . . . . . . . . 41.7 p90 -141.87 155.77 45.53 Favored 'General case' 0 N--CA 1.492 1.648 0 CA-C-O 121.781 0.801 . . . . 0.0 110.293 -179.714 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . -166.66 -155.41 8.94 Favored Glycine 0 N--CA 1.491 2.312 0 N-CA-C 110.482 -1.047 . . . . 0.0 110.482 -179.579 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 39' ' ' SER . . . . . 0.491 ' OG ' ' CG ' ' A' ' 43' ' ' HIS . 74.3 p -63.24 -41.88 99.13 Favored 'General case' 0 N--CA 1.496 1.862 0 O-C-N 122.027 -0.69 . . . . 0.0 110.129 -179.103 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 40' ' ' ASP . . . . . . . . . . . . . 53.3 p-10 -171.62 -168.18 0.58 Allowed 'General case' 0 N--CA 1.491 1.586 0 CA-C-O 121.788 0.804 . . . . 0.0 110.01 179.769 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 28.3 tptp -62.43 -45.55 92.59 Favored 'General case' 0 C--N 1.303 -1.452 0 O-C-N 121.727 -0.608 . . . . 0.0 110.09 -179.265 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -50.41 -51.57 45.23 Favored 'General case' 0 N--CA 1.494 1.773 0 O-C-N 121.68 -0.637 . . . . 0.0 110.533 -178.358 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 43' ' ' HIS . . . . . 0.491 ' CG ' ' OG ' ' A' ' 39' ' ' SER . 32.0 m80 -67.01 -37.35 84.01 Favored 'General case' 0 N--CA 1.495 1.782 0 O-C-N 121.441 -0.787 . . . . 0.0 110.115 -179.242 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 18.0 mt -63.58 -40.3 96.6 Favored 'General case' 0 N--CA 1.493 1.702 0 O-C-N 121.358 -0.839 . . . . 0.0 109.427 -179.467 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 96.0 mt-10 -61.56 -42.21 98.5 Favored 'General case' 0 N--CA 1.489 1.511 0 N-CA-C 109.036 -0.727 . . . . 0.0 109.036 -179.857 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . -64.55 -48.08 77.04 Favored Glycine 0 N--CA 1.494 2.542 0 N-CA-C 109.584 -1.406 . . . . 0.0 109.584 179.931 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 63.0 mttp -66.97 -33.9 76.59 Favored 'General case' 0 N--CA 1.493 1.698 0 O-C-N 121.712 -0.876 . . . . 0.0 108.995 179.641 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 58.7 tp -59.46 -40.23 86.21 Favored 'General case' 0 C--N 1.303 -1.423 0 N-CA-C 109.503 -0.555 . . . . 0.0 109.503 -178.965 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 49' ' ' ALA . . . . . . . . . . . . . . . -55.97 -39.97 72.56 Favored 'General case' 0 N--CA 1.491 1.618 0 O-C-N 121.563 -0.71 . . . . 0.0 109.23 -179.468 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 97.8 mt-10 -68.33 -39.75 81.83 Favored 'General case' 0 N--CA 1.492 1.659 0 O-C-N 121.62 -0.675 . . . . 0.0 109.419 179.791 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 51' ' ' TYR . . . . . 0.576 ' CE2' ' CG2' ' A' ' 95' ' ' THR . 4.3 m-85 -59.13 -40.69 86.24 Favored 'General case' 0 N--CA 1.494 1.763 0 O-C-N 121.536 -0.727 . . . . 0.0 109.145 -179.432 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 52' ' ' ILE . . . . . 0.565 ' CG2' ' HZ2' ' A' ' 56' ' ' LYS . 95.5 mt -63.98 -42.52 96.01 Favored 'Isoleucine or valine' 0 C--N 1.301 -1.518 0 N-CA-C 109.134 -0.691 . . . . 0.0 109.134 -179.844 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 49.4 m -53.23 -45.99 68.94 Favored 'General case' 0 N--CA 1.493 1.695 0 O-C-N 121.714 -0.616 . . . . 0.0 109.463 -179.0 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 54' ' ' LEU . . . . . 0.407 ' N ' ' CD2' ' A' ' 54' ' ' LEU . 4.0 mm? -64.73 -39.81 94.26 Favored 'General case' 0 C--N 1.3 -1.556 0 O-C-N 121.763 -0.586 . . . . 0.0 109.453 179.168 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -59.13 -49.48 77.73 Favored 'General case' 0 N--CA 1.49 1.573 0 CA-C-O 121.202 0.525 . . . . 0.0 109.769 -179.019 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 56' ' ' LYS . . . . . 0.565 ' HZ2' ' CG2' ' A' ' 52' ' ' ILE . 62.2 mttp -64.6 -39.66 94.11 Favored 'General case' 0 N--CA 1.49 1.564 0 O-C-N 121.6 -0.688 . . . . 0.0 109.359 179.715 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 51.5 tt0 -62.15 -49.19 76.85 Favored 'General case' 0 N--CA 1.489 1.494 0 O-C-N 121.73 -0.606 . . . . 0.0 109.375 -179.433 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 58' ' ' VAL . . . . . . . . . . . . . 72.8 t -66.49 -44.45 90.34 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.587 0 O-C-N 121.761 -0.587 . . . . 0.0 109.795 -179.731 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 59' ' ' TYR . . . . . . . . . . . . . 51.3 t80 -135.75 125.19 24.96 Favored 'General case' 0 N--CA 1.498 1.946 0 CA-C-O 121.918 0.866 . . . . 0.0 110.024 -179.421 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -71.45 144.77 49.61 Favored 'General case' 0 N--CA 1.492 1.629 0 CA-C-O 121.57 0.7 . . . . 0.0 110.73 -179.588 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 61' ' ' ASN . . . . . . . . . . . . . 88.7 m-20 57.29 37.44 28.18 Favored 'General case' 0 N--CA 1.493 1.702 0 CA-C-O 121.544 0.688 . . . . 0.0 109.156 179.603 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 62' ' ' VAL . . . . . . . . . . . . . 10.3 p -67.63 138.73 22.13 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.509 0 CA-C-O 121.709 0.766 . . . . 0.0 110.194 -179.643 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 97.3 mt-10 -108.91 142.74 39.09 Favored 'General case' 0 N--CA 1.495 1.813 0 CA-C-O 121.726 0.774 . . . . 0.0 109.671 -179.466 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 64' ' ' TYR . . . . . . . . . . . . . 49.9 p90 -151.22 161.91 41.86 Favored 'General case' 0 N--CA 1.492 1.639 0 CA-C-O 121.936 0.874 . . . . 0.0 110.486 -179.993 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 80.5 tt0 -144.24 145.55 32.12 Favored 'General case' 0 N--CA 1.493 1.721 0 CA-C-O 121.511 0.672 . . . . 0.0 109.426 179.959 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 66' ' ' VAL . . . . . . . . . . . . . 30.8 m -120.71 129.99 75.04 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.903 0 CA-C-O 121.999 0.904 . . . . 0.0 110.266 -179.646 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 67' ' ' ALA . . . . . 0.558 ' HB1' ' HD2' ' A' ' 68' ' ' PRO . . . -78.57 170.74 14.82 Favored Pre-proline 0 C--N 1.301 -1.501 0 CA-C-N 115.976 -0.556 . . . . 0.0 109.506 179.925 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 68' ' ' PRO . . . . . 0.558 ' HD2' ' HB1' ' A' ' 67' ' ' ALA . 46.7 Cg_exo -54.58 134.11 60.29 Favored 'Trans proline' 0 N--CA 1.496 1.621 0 C-N-CA 122.578 2.186 . . . . 0.0 113.276 179.752 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 69' ' ' VAL . . . . . . . . . . . . . 64.9 t -134.76 132.85 54.21 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.939 0 CA-C-O 121.661 0.743 . . . . 0.0 109.93 179.445 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -82.37 163.7 21.54 Favored 'General case' 0 N--CA 1.49 1.569 0 CA-C-O 121.619 0.723 . . . . 0.0 109.516 179.343 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 49.8 t0 -64.92 -40.69 95.44 Favored 'General case' 0 N--CA 1.489 1.486 0 O-C-N 121.721 -0.612 . . . . 0.0 109.645 -179.53 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 72' ' ' ASN . . . . . . . . . . . . . 95.0 m-20 -97.87 21.81 10.08 Favored 'General case' 0 N--CA 1.495 1.819 0 N-CA-C 108.97 -0.752 . . . . 0.0 108.97 -179.586 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 73' ' ' ALA . . . . . 0.462 ' C ' ' H ' ' A' ' 75' ' ' GLU . . . -62.36 -36.55 82.59 Favored 'General case' 0 N--CA 1.494 1.767 0 O-C-N 121.649 -0.657 . . . . 0.0 109.411 -179.826 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 74' ' ' THR . . . . . . . . . . . . . 2.0 m 67.78 -6.37 0.71 Allowed 'General case' 0 N--CA 1.491 1.606 0 N-CA-C 109.432 -0.581 . . . . 0.0 109.432 -179.965 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 75' ' ' GLU . . . . . 0.462 ' H ' ' C ' ' A' ' 73' ' ' ALA . 2.9 pp20? -137.85 145.98 42.88 Favored 'General case' 0 N--CA 1.495 1.82 0 CA-C-O 121.93 0.872 . . . . 0.0 110.336 -179.873 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 2.0 tp -121.06 128.92 53.08 Favored 'General case' 0 N--CA 1.49 1.56 0 CA-C-O 121.586 0.708 . . . . 0.0 109.451 -179.928 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 77' ' ' HIS . . . . . . . . . . . . . 76.3 m-70 -106.09 114.48 28.65 Favored 'General case' 0 N--CA 1.495 1.788 0 CA-C-O 121.672 0.749 . . . . 0.0 109.213 179.913 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -135.07 154.62 51.63 Favored 'General case' 0 N--CA 1.495 1.78 0 CA-C-O 121.899 0.857 . . . . 0.0 110.227 -179.675 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 94.6 mtt-85 -129.46 146.22 51.33 Favored 'General case' 0 N--CA 1.496 1.829 0 CA-C-O 121.536 0.684 . . . . 0.0 109.585 -179.956 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 80' ' ' PHE . . . . . . . . . . . . . 67.9 m-85 -126.34 144.49 50.79 Favored 'General case' 0 N--CA 1.498 1.942 0 CA-C-O 121.803 0.811 . . . . 0.0 109.965 -179.876 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 21.6 ttpp -115.17 121.46 43.06 Favored 'General case' 0 N--CA 1.494 1.746 0 CA-C-O 121.719 0.771 . . . . 0.0 109.565 -179.792 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 82' ' ' PHE . . . . . . . . . . . . . 83.5 m-85 -115.32 -129.42 0.3 Allowed 'General case' 0 N--CA 1.496 1.859 0 CA-C-O 121.532 0.682 . . . . 0.0 109.613 -179.876 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 78.8 tt0 -140.46 -33.29 0.56 Allowed 'General case' 0 N--CA 1.493 1.71 0 N-CA-C 108.841 -0.8 . . . . 0.0 108.841 -179.54 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 84' ' ' VAL . . . . . . . . . . . . . 27.5 m -135.79 159.8 39.49 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.894 0 CA-C-O 121.891 0.853 . . . . 0.0 109.852 179.953 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 38.0 m -63.37 -34.92 78.76 Favored 'General case' 0 N--CA 1.49 1.536 0 CA-C-O 121.319 0.58 . . . . 0.0 109.907 -179.567 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 86' ' ' ALA . . . . . . . . . . . . . . . -50.22 -45.94 54.28 Favored 'General case' 0 N--CA 1.491 1.577 0 O-C-N 121.526 -0.734 . . . . 0.0 109.676 -178.911 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 87' ' ' GLU . . . . . 0.56 ' N ' ' OE1' ' A' ' 87' ' ' GLU . 0.0 OUTLIER -52.12 -37.81 55.46 Favored 'General case' 0 N--CA 1.493 1.695 0 O-C-N 121.56 -0.712 . . . . 0.0 109.654 -179.103 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 88' ' ' LYS . . . . . . . . . . . . . 88.7 tttt -64.13 -46.1 85.61 Favored 'General case' 0 N--CA 1.49 1.527 0 O-C-N 121.675 -0.64 . . . . 0.0 109.526 -179.609 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 89' ' ' LEU . . . . . 0.531 HD22 ' N ' ' A' ' 89' ' ' LEU . 4.0 mm? -63.94 -45.31 89.74 Favored 'General case' 0 N--CA 1.492 1.664 0 O-C-N 121.651 -0.655 . . . . 0.0 110.427 -179.252 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 90' ' ' ILE . . . . . . . . . . . . . 37.1 mm -70.2 -45.28 76.38 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.665 0 O-C-N 121.773 -0.58 . . . . 0.0 109.684 -179.641 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 91' ' ' PHE . . . . . . . . . . . . . 83.9 t80 -64.51 -45.33 87.69 Favored 'General case' 0 N--CA 1.492 1.66 0 O-C-N 121.648 -0.658 . . . . 0.0 109.896 179.84 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 92' ' ' GLU . . . . . . . . . . . . . 46.5 tp10 -66.48 -38.0 86.33 Favored 'General case' 0 N--CA 1.491 1.595 0 O-C-N 121.726 -0.609 . . . . 0.0 109.533 -178.949 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 93' ' ' LEU . . . . . . . . . . . . . 5.5 tt -62.68 -49.17 76.17 Favored 'General case' 0 C--N 1.303 -1.44 0 O-C-N 121.572 -0.705 . . . . 0.0 109.952 -179.301 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 94' ' ' LYS . . . . . . . . . . . . . 49.6 mtmt -69.67 -40.96 76.11 Favored 'General case' 0 N--CA 1.49 1.551 0 O-C-N 121.647 -0.658 . . . . 0.0 109.746 -179.87 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 95' ' ' THR . . . . . 0.576 ' CG2' ' CE2' ' A' ' 51' ' ' TYR . 98.9 m -61.61 -46.9 87.85 Favored 'General case' 0 N--CA 1.491 1.621 0 O-C-N 121.657 -0.652 . . . . 0.0 109.594 -178.917 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 96' ' ' ARG . . . . . . . . . . . . . 78.8 mtp85 -65.8 -40.36 91.83 Favored 'General case' 0 N--CA 1.492 1.669 0 O-C-N 121.687 -0.633 . . . . 0.0 109.338 179.67 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 97' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.489 1.484 0 N-CA-C 109.023 -0.732 . . . . 0.0 109.023 -179.813 . . . . . . . . 0 0 . 1 . 002 nuclear build core ' A' A ' 30' ' ' ASP . . . . . 0.458 ' N ' ' OD1' ' A' ' 30' ' ' ASP . 29.3 p-10 . . . . . 0 N--CA 1.493 1.701 0 N-CA-C 108.945 -0.761 . . . . 0.0 108.945 . . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 31' ' ' VAL . . . . . 0.444 HG12 ' N ' ' A' ' 32' ' ' ALA . 17.2 t -117.21 161.24 16.14 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.97 0 O-C-N 121.551 -0.718 . . . . 0.0 109.658 -179.78 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 32' ' ' ALA . . . . . 0.444 ' N ' HG12 ' A' ' 31' ' ' VAL . . . -135.92 151.61 50.15 Favored 'General case' 0 N--CA 1.492 1.63 0 O-C-N 121.514 -0.741 . . . . 0.0 109.436 -179.652 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 33' ' ' GLU . . . . . 0.496 ' OE1' ' NE2' ' A' ' 77' ' ' HIS . 80.4 mm-40 -100.2 142.7 31.32 Favored 'General case' 0 N--CA 1.493 1.71 0 CA-C-O 121.877 0.846 . . . . 0.0 110.035 -179.597 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 34' ' ' VAL . . . . . . . . . . . . . 52.3 t -128.87 135.48 62.11 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.802 0 CA-C-O 121.629 0.728 . . . . 0.0 109.146 -179.915 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 79.8 p -142.4 120.87 12.43 Favored 'General case' 0 N--CA 1.492 1.638 0 O-C-N 121.258 -0.901 . . . . 0.0 109.05 179.779 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 51.0 tp -122.38 136.27 54.86 Favored 'General case' 0 N--CA 1.497 1.887 0 CA-C-O 121.449 0.642 . . . . 0.0 109.587 -179.9 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 37' ' ' PHE . . . . . . . . . . . . . 91.0 t80 -108.48 131.01 55.23 Favored 'General case' 0 N--CA 1.495 1.787 0 CA-C-O 121.61 0.719 . . . . 0.0 109.468 -179.997 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . -172.09 -159.18 17.9 Favored Glycine 0 N--CA 1.488 2.16 0 N-CA-C 109.951 -1.26 . . . . 0.0 109.951 -179.639 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 39' ' ' SER . . . . . 0.449 ' OG ' ' N ' ' A' ' 40' ' ' ASP . 39.7 t -75.78 -146.94 0.03 OUTLIER 'General case' 0 N--CA 1.494 1.771 0 O-C-N 121.645 -0.914 . . . . 0.0 111.042 -179.061 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 40' ' ' ASP . . . . . 0.449 ' N ' ' OG ' ' A' ' 39' ' ' SER . 97.9 m-20 -52.07 175.98 0.02 OUTLIER 'General case' 0 N--CA 1.493 1.706 0 CA-C-O 122.162 0.982 . . . . 0.0 111.24 -178.696 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 38.0 ttmt -62.29 -42.82 99.68 Favored 'General case' 0 N--CA 1.491 1.577 0 O-C-N 121.633 -0.667 . . . . 0.0 109.575 179.608 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -53.46 -44.7 69.13 Favored 'General case' 0 N--CA 1.492 1.63 0 O-C-N 121.337 -0.852 . . . . 0.0 109.569 -179.558 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 43' ' ' HIS . . . . . . . . . . . . . 86.6 t60 -63.17 -43.36 98.49 Favored 'General case' 0 N--CA 1.493 1.694 0 O-C-N 121.277 -0.89 . . . . 0.0 109.62 179.892 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 97.5 mt -64.43 -39.88 94.68 Favored 'General case' 0 N--CA 1.493 1.723 0 O-C-N 121.413 -0.804 . . . . 0.0 109.713 -179.871 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 96.1 mt-10 -60.73 -38.55 85.5 Favored 'General case' 0 N--CA 1.491 1.603 0 O-C-N 121.203 -0.936 . . . . 0.0 109.833 -179.719 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . -62.34 -52.06 52.03 Favored Glycine 0 N--CA 1.494 2.507 0 N-CA-C 109.698 -1.361 . . . . 0.0 109.698 179.951 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 97.3 mttt -67.59 -37.21 82.25 Favored 'General case' 0 N--CA 1.492 1.644 0 O-C-N 121.32 -1.106 . . . . 0.0 109.739 179.157 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 48' ' ' LEU . . . . . 0.5 ' O ' ' N ' ' A' ' 51' ' ' TYR . 20.7 tp -61.62 -40.13 93.74 Favored 'General case' 0 C--N 1.299 -1.595 0 O-C-N 121.532 -0.73 . . . . 0.0 109.427 -179.177 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 49' ' ' ALA . . . . . 0.426 ' C ' ' O ' ' A' ' 48' ' ' LEU . . . -40.44 -33.24 0.24 Allowed 'General case' 0 N--CA 1.497 1.91 0 CA-C-O 121.617 0.723 . . . . 0.0 109.955 -179.588 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 72.8 mm-40 -68.69 -38.53 80.38 Favored 'General case' 0 N--CA 1.491 1.608 0 O-C-N 121.32 -0.862 . . . . 0.0 109.658 179.513 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 51' ' ' TYR . . . . . 0.5 ' N ' ' O ' ' A' ' 48' ' ' LEU . 21.3 m-85 -62.04 -45.31 94.11 Favored 'General case' 0 N--CA 1.494 1.74 0 O-C-N 121.224 -0.923 . . . . 0.0 109.79 -179.761 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 52' ' ' ILE . . . . . . . . . . . . . 97.2 mt -65.24 -44.16 95.17 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.658 0 O-C-N 121.347 -0.845 . . . . 0.0 109.857 -179.658 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 68.9 m -62.52 -45.02 94.9 Favored 'General case' 0 N--CA 1.494 1.729 0 O-C-N 121.163 -0.96 . . . . 0.0 109.713 -179.642 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 54' ' ' LEU . . . . . 0.442 HD12 HG22 ' A' ' 95' ' ' THR . 88.2 mt -65.87 -39.38 90.66 Favored 'General case' 0 N--CA 1.492 1.646 0 O-C-N 121.371 -0.831 . . . . 0.0 109.784 179.883 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -61.37 -38.82 88.37 Favored 'General case' 0 N--CA 1.49 1.565 0 O-C-N 121.352 -0.842 . . . . 0.0 109.666 -179.522 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 56' ' ' LYS . . . . . . . . . . . . . 56.6 mtpt -64.43 -42.53 95.96 Favored 'General case' 0 N--CA 1.491 1.599 0 O-C-N 121.246 -0.909 . . . . 0.0 109.565 179.68 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 19.3 mm100 -68.54 -41.8 79.32 Favored 'General case' 0 N--CA 1.49 1.532 0 O-C-N 121.286 -0.884 . . . . 0.0 109.521 -179.897 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 58' ' ' VAL . . . . . . . . . . . . . 75.0 t -64.76 -45.57 94.74 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.638 0 O-C-N 121.285 -0.884 . . . . 0.0 109.755 179.809 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 59' ' ' TYR . . . . . . . . . . . . . 51.2 t80 -135.09 121.69 20.7 Favored 'General case' 0 N--CA 1.497 1.909 0 O-C-N 121.339 -0.85 . . . . 0.0 109.77 -179.588 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -68.04 144.51 55.08 Favored 'General case' 0 N--CA 1.492 1.673 0 CA-C-O 121.645 0.736 . . . . 0.0 110.764 -179.585 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 61' ' ' ASN . . . . . . . . . . . . . 55.9 t-20 57.75 41.33 25.3 Favored 'General case' 0 N--CA 1.489 1.508 0 CA-C-O 121.906 0.86 . . . . 0.0 108.98 179.659 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 62' ' ' VAL . . . . . . . . . . . . . 7.4 p -70.76 138.66 21.4 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.516 0 CA-C-O 121.772 0.796 . . . . 0.0 110.321 -179.67 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 97.1 mt-10 -111.19 136.74 49.82 Favored 'General case' 0 N--CA 1.494 1.749 0 CA-C-O 121.611 0.719 . . . . 0.0 109.466 -179.849 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 64' ' ' TYR . . . . . . . . . . . . . 52.4 p90 -147.6 161.3 41.41 Favored 'General case' 0 N--CA 1.489 1.485 0 O-C-N 121.432 -0.792 . . . . 0.0 109.767 -179.549 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 83.1 tt0 -144.56 150.16 37.04 Favored 'General case' 0 N--CA 1.49 1.57 0 N-CA-C 108.935 -0.765 . . . . 0.0 108.935 -179.992 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 66' ' ' VAL . . . . . . . . . . . . . 57.3 t -111.48 129.67 66.4 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.89 0 CA-C-O 121.752 0.787 . . . . 0.0 109.83 -179.705 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 67' ' ' ALA . . . . . 0.514 ' HB1' ' HD2' ' A' ' 68' ' ' PRO . . . -79.45 170.54 15.59 Favored Pre-proline 0 N--CA 1.486 1.369 0 O-C-N 121.698 -0.626 . . . . 0.0 109.589 -179.487 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 68' ' ' PRO . . . . . 0.514 ' HD2' ' HB1' ' A' ' 67' ' ' ALA . 51.3 Cg_exo -54.72 119.11 5.91 Favored 'Trans proline' 0 N--CA 1.496 1.651 0 C-N-CA 122.412 2.075 . . . . 0.0 112.448 179.64 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 69' ' ' VAL . . . . . . . . . . . . . 74.7 t -131.98 133.28 61.01 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.946 0 O-C-N 121.469 -0.769 . . . . 0.0 109.653 179.634 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -78.61 158.07 28.55 Favored 'General case' 0 N--CA 1.493 1.684 0 CA-C-O 121.757 0.789 . . . . 0.0 110.253 179.869 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 56.6 m-20 -64.09 -37.04 85.99 Favored 'General case' 0 N--CA 1.493 1.684 0 O-C-N 121.58 -0.7 . . . . 0.0 109.39 -179.807 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 72' ' ' ASN . . . . . . . . . . . . . 61.7 t30 -103.91 28.9 6.26 Favored 'General case' 0 N--CA 1.495 1.79 0 O-C-N 121.333 -0.855 . . . . 0.0 108.925 -179.703 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 73' ' ' ALA . . . . . 0.5 ' O ' ' N ' ' A' ' 75' ' ' GLU . . . -72.96 -10.07 59.4 Favored 'General case' 0 N--CA 1.493 1.677 0 O-C-N 121.292 -0.88 . . . . 0.0 108.729 179.622 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 74' ' ' THR . . . . . . . . . . . . . 68.4 p 49.69 10.59 0.04 OUTLIER 'General case' 0 N--CA 1.493 1.722 0 O-C-N 121.424 -0.797 . . . . 0.0 109.489 -179.726 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 75' ' ' GLU . . . . . 0.5 ' N ' ' O ' ' A' ' 73' ' ' ALA . 80.8 tt0 -153.82 153.04 31.4 Favored 'General case' 0 C--N 1.302 -1.487 0 O-C-N 121.2 -0.937 . . . . 0.0 109.165 179.618 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 5.7 tt -132.38 134.99 45.82 Favored 'General case' 0 N--CA 1.49 1.546 0 O-C-N 121.608 -0.683 . . . . 0.0 109.324 179.971 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 77' ' ' HIS . . . . . 0.496 ' NE2' ' OE1' ' A' ' 33' ' ' GLU . 74.5 t60 -118.75 126.22 51.4 Favored 'General case' 0 N--CA 1.494 1.758 0 CA-C-O 121.74 0.781 . . . . 0.0 109.46 -179.853 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -144.13 163.87 32.32 Favored 'General case' 0 N--CA 1.492 1.661 0 O-C-N 121.389 -0.82 . . . . 0.0 109.408 -179.719 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 84.5 mtt85 -126.01 144.95 50.51 Favored 'General case' 0 N--CA 1.495 1.792 0 N-CA-C 109.226 -0.657 . . . . 0.0 109.226 -179.877 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 80' ' ' PHE . . . . . . . . . . . . . 64.9 m-85 -128.93 152.0 49.04 Favored 'General case' 0 N--CA 1.495 1.798 0 CA-C-O 121.616 0.722 . . . . 0.0 109.374 -179.717 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 65.0 tttm -106.07 137.72 43.5 Favored 'General case' 0 N--CA 1.492 1.655 0 CA-C-O 121.603 0.716 . . . . 0.0 110.007 -179.507 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 82' ' ' PHE . . . . . . . . . . . . . 80.7 m-85 -133.13 -123.46 0.18 Allowed 'General case' 0 N--CA 1.494 1.768 0 N-CA-C 109.201 -0.666 . . . . 0.0 109.201 179.846 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 49.5 tp10 -153.65 -36.89 0.1 Allowed 'General case' 0 N--CA 1.488 1.442 0 O-C-N 121.225 -0.922 . . . . 0.0 108.704 179.959 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 84' ' ' VAL . . . . . . . . . . . . . 27.8 m -135.89 162.49 36.55 Favored 'Isoleucine or valine' 0 N--CA 1.499 1.991 0 O-C-N 121.329 -0.857 . . . . 0.0 110.155 -179.745 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 77.8 p -69.66 -19.95 63.59 Favored 'General case' 0 N--CA 1.492 1.635 0 O-C-N 121.496 -0.753 . . . . 0.0 109.482 179.618 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 86' ' ' ALA . . . . . . . . . . . . . . . -62.72 -37.6 87.15 Favored 'General case' 0 N--CA 1.492 1.63 0 O-C-N 121.253 -0.905 . . . . 0.0 109.521 179.983 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 80.4 mm-40 -71.8 -27.13 62.73 Favored 'General case' 0 N--CA 1.491 1.596 0 O-C-N 121.348 -0.845 . . . . 0.0 109.109 179.572 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 88' ' ' LYS . . . . . . . . . . . . . 36.8 ttmt -63.41 -50.61 69.14 Favored 'General case' 0 N--CA 1.49 1.544 0 O-C-N 121.258 -0.901 . . . . 0.0 109.726 -179.592 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 89' ' ' LEU . . . . . 0.5 HD22 ' N ' ' A' ' 89' ' ' LEU . 4.0 mm? -65.41 -44.22 88.09 Favored 'General case' 0 N--CA 1.493 1.72 0 O-C-N 121.349 -0.845 . . . . 0.0 109.893 -179.72 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 90' ' ' ILE . . . . . 0.4 ' O ' ' CB ' ' A' ' 94' ' ' LYS . 96.0 mt -66.63 -43.62 90.3 Favored 'Isoleucine or valine' 0 C--N 1.299 -1.616 0 O-C-N 121.296 -0.877 . . . . 0.0 109.625 -179.94 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 91' ' ' PHE . . . . . 0.582 ' O ' HG23 ' A' ' 95' ' ' THR . 82.5 t80 -61.67 -46.74 88.45 Favored 'General case' 0 N--CA 1.49 1.57 0 O-C-N 121.257 -0.902 . . . . 0.0 109.9 -179.619 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 92' ' ' GLU . . . . . . . . . . . . . 8.8 tm-20 -68.19 -51.77 41.87 Favored 'General case' 0 N--CA 1.491 1.611 0 O-C-N 121.345 -0.847 . . . . 0.0 109.996 -179.463 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 93' ' ' LEU . . . . . 0.631 ' O ' HD23 ' A' ' 93' ' ' LEU . 3.1 tt -63.64 -46.67 84.6 Favored 'General case' 0 C--N 1.3 -1.586 0 O-C-N 121.173 -0.954 . . . . 0.0 109.659 -179.101 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 94' ' ' LYS . . . . . 0.4 ' CB ' ' O ' ' A' ' 90' ' ' ILE . 55.1 tttp -63.32 -47.27 82.92 Favored 'General case' 0 N--CA 1.491 1.61 0 O-C-N 121.205 -0.935 . . . . 0.0 110.09 -179.072 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 95' ' ' THR . . . . . 0.582 HG23 ' O ' ' A' ' 91' ' ' PHE . 60.0 p -67.68 -42.09 82.65 Favored 'General case' 0 C--N 1.299 -1.595 0 O-C-N 121.258 -0.901 . . . . 0.0 109.465 -179.854 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 96' ' ' ARG . . . . . . . . . . . . . 12.1 tpt180 -65.47 -41.54 93.23 Favored 'General case' 0 C--N 1.3 -1.553 0 O-C-N 121.313 -0.867 . . . . 0.0 109.322 -179.853 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 97' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.489 1.517 0 O-C-N 121.366 -0.834 . . . . 0.0 109.245 -179.762 . . . . . . . . 0 0 . 1 . 003 nuclear build core ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 96.3 m-20 . . . . . 0 N--CA 1.493 1.702 0 CA-C-O 121.205 0.526 . . . . 0.0 109.688 . . . . . . . . . 0 0 . 1 . 003 nuclear build core ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 49.9 t -120.24 135.63 59.88 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.773 0 N-CA-C 109.112 -0.699 . . . . 0.0 109.112 -179.829 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -118.48 147.91 43.13 Favored 'General case' 0 N--CA 1.492 1.63 0 N-CA-C 109.267 -0.642 . . . . 0.0 109.267 -179.79 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 97.3 mt-10 -105.49 133.92 49.46 Favored 'General case' 0 N--CA 1.492 1.67 0 O-C-N 121.593 -0.692 . . . . 0.0 109.519 -179.74 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 34' ' ' VAL . . . . . . . . . . . . . 48.6 t -123.06 133.44 69.06 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.734 0 N-CA-C 108.771 -0.826 . . . . 0.0 108.771 179.929 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 77.9 p -128.52 122.96 32.33 Favored 'General case' 0 N--CA 1.491 1.588 0 N-CA-C 108.719 -0.845 . . . . 0.0 108.719 -179.944 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 44.9 tp -117.81 132.58 56.43 Favored 'General case' 0 N--CA 1.496 1.858 0 N-CA-C 108.905 -0.776 . . . . 0.0 108.905 179.808 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 37' ' ' PHE . . . . . . . . . . . . . 91.2 t80 -112.98 132.33 55.4 Favored 'General case' 0 N--CA 1.493 1.688 0 O-C-N 121.676 -0.64 . . . . 0.0 109.287 -179.638 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 38' ' ' GLY . . . . . 0.405 ' N ' HD21 ' A' ' 44' ' ' LEU . . . -168.45 -162.79 21.24 Favored Glycine 0 N--CA 1.487 2.074 0 C-N-CA 119.693 -1.241 . . . . 0.0 110.164 -179.667 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 39' ' ' SER . . . . . 0.515 ' OG ' ' N ' ' A' ' 40' ' ' ASP . 30.0 t -62.65 -128.33 0.0 OUTLIER 'General case' 0 N--CA 1.49 1.55 0 O-C-N 121.667 -0.902 . . . . 0.0 110.766 -179.264 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 40' ' ' ASP . . . . . 0.515 ' N ' ' OG ' ' A' ' 39' ' ' SER . 98.5 m-20 -73.52 175.77 6.74 Favored 'General case' 0 N--CA 1.488 1.467 0 O-C-N 121.398 -0.814 . . . . 0.0 110.134 -179.197 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 88.5 tttt -63.18 -39.97 96.19 Favored 'General case' 0 C--N 1.305 -1.361 0 N-CA-C 109.05 -0.722 . . . . 0.0 109.05 179.512 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -54.81 -46.02 74.47 Favored 'General case' 0 N--CA 1.488 1.468 0 O-C-N 121.352 -0.843 . . . . 0.0 109.416 -179.944 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 43' ' ' HIS . . . . . . . . . . . . . 15.3 t-80 -61.24 -41.56 97.09 Favored 'General case' 0 C--N 1.303 -1.426 0 O-C-N 121.29 -0.881 . . . . 0.0 109.263 179.653 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 44' ' ' LEU . . . . . 0.405 HD21 ' N ' ' A' ' 38' ' ' GLY . 96.5 mt -64.41 -39.59 94.13 Favored 'General case' 0 N--CA 1.49 1.526 0 O-C-N 121.459 -0.776 . . . . 0.0 109.656 -179.929 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 97.2 mt-10 -59.39 -41.15 88.71 Favored 'General case' 0 N--CA 1.488 1.462 0 O-C-N 121.178 -0.951 . . . . 0.0 109.847 -179.69 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . -62.81 -46.72 93.04 Favored Glycine 0 N--CA 1.49 2.285 0 N-CA-C 109.162 -1.575 . . . . 0.0 109.162 179.75 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 25.6 mtpp -67.29 -33.12 74.63 Favored 'General case' 0 N--CA 1.488 1.46 0 O-C-N 121.505 -0.997 . . . . 0.0 109.356 179.224 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 44.0 tp -57.55 -38.33 74.57 Favored 'General case' 0 N--CA 1.488 1.467 0 O-C-N 121.518 -0.739 . . . . 0.0 109.399 -179.056 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 49' ' ' ALA . . . . . . . . . . . . . . . -52.15 -40.48 61.47 Favored 'General case' 0 C--N 1.302 -1.46 0 O-C-N 121.26 -0.9 . . . . 0.0 109.998 -179.682 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 75.9 mt-10 -68.01 -40.96 82.88 Favored 'General case' 0 N--CA 1.491 1.586 0 O-C-N 121.138 -0.977 . . . . 0.0 109.629 179.955 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 8.1 m-85 -61.98 -44.9 95.78 Favored 'General case' 0 N--CA 1.49 1.525 0 O-C-N 121.441 -0.787 . . . . 0.0 109.232 179.934 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 52' ' ' ILE . . . . . . . . . . . . . 96.0 mt -63.97 -43.19 97.6 Favored 'Isoleucine or valine' 0 C--N 1.303 -1.422 0 O-C-N 121.513 -0.742 . . . . 0.0 109.771 -179.816 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 79.9 p -59.49 -39.89 85.24 Favored 'General case' 0 N--CA 1.49 1.562 0 O-C-N 121.147 -0.971 . . . . 0.0 110.028 -179.193 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 54' ' ' LEU . . . . . . . . . . . . . 95.0 mt -63.26 -41.84 99.09 Favored 'General case' 0 N--CA 1.489 1.478 0 O-C-N 121.154 -0.967 . . . . 0.0 109.122 179.8 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 55' ' ' ALA . . . . . 0.417 ' HB2' ' CE1' ' A' ' 91' ' ' PHE . . . -64.11 -41.5 97.23 Favored 'General case' 0 N--CA 1.488 1.437 0 O-C-N 121.42 -0.8 . . . . 0.0 109.502 179.911 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 56' ' ' LYS . . . . . . . . . . . . . 56.5 mtpt -65.37 -43.7 89.95 Favored 'General case' 0 N--CA 1.489 1.514 0 O-C-N 121.377 -0.827 . . . . 0.0 109.461 179.728 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 60.7 tt0 -67.34 -43.76 80.73 Favored 'General case' 0 N--CA 1.488 1.456 0 O-C-N 121.408 -0.807 . . . . 0.0 109.377 -179.762 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 58' ' ' VAL . . . . . 0.475 ' CG1' ' OE1' ' A' ' 87' ' ' GLU . 53.6 t -64.63 -45.61 94.88 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.405 0 O-C-N 121.461 -0.774 . . . . 0.0 109.523 179.999 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 59' ' ' TYR . . . . . . . . . . . . . 56.6 t80 -131.98 123.27 27.01 Favored 'General case' 0 N--CA 1.497 1.902 0 O-C-N 121.479 -0.763 . . . . 0.0 109.619 -179.536 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -70.51 144.44 51.36 Favored 'General case' 0 N--CA 1.491 1.612 0 O-C-N 121.544 -0.722 . . . . 0.0 110.898 -179.436 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 61' ' ' ASN . . . . . . . . . . . . . 11.2 t-20 57.94 40.96 25.21 Favored 'General case' 0 N--CA 1.491 1.591 0 O-C-N 121.525 -0.734 . . . . 0.0 109.115 179.594 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 62' ' ' VAL . . . . . . . . . . . . . 11.5 p -75.98 132.32 33.32 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.501 0 O-C-N 121.595 -0.691 . . . . 0.0 110.046 -179.718 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 97.4 mt-10 -90.91 150.74 21.39 Favored 'General case' 0 N--CA 1.492 1.652 0 O-C-N 121.437 -0.789 . . . . 0.0 109.638 -179.89 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 64' ' ' TYR . . . . . 0.45 ' C ' ' OE1' ' A' ' 65' ' ' GLU . 53.9 p90 -156.4 164.07 38.72 Favored 'General case' 0 N--CA 1.49 1.544 0 O-C-N 121.175 -0.953 . . . . 0.0 110.207 -179.729 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 65' ' ' GLU . . . . . 0.602 ' CD ' ' N ' ' A' ' 65' ' ' GLU . 1.8 pm0 -152.61 156.64 39.67 Favored 'General case' 0 N--CA 1.49 1.529 0 N-CA-C 108.634 -0.876 . . . . 0.0 108.634 -179.465 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 66' ' ' VAL . . . . . . . . . . . . . 2.6 p -123.19 129.57 74.85 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.86 0 CA-C-O 121.533 0.683 . . . . 0.0 109.465 -179.82 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 67' ' ' ALA . . . . . 0.467 ' HB1' ' HD2' ' A' ' 68' ' ' PRO . . . -75.96 160.68 77.99 Favored Pre-proline 0 N--CA 1.488 1.469 0 O-C-N 121.607 -0.683 . . . . 0.0 109.333 -179.78 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 68' ' ' PRO . . . . . 0.467 ' HD2' ' HB1' ' A' ' 67' ' ' ALA . 21.4 Cg_endo -59.76 111.83 1.08 Allowed 'Trans proline' 0 N--CA 1.495 1.61 0 C-N-CA 122.831 2.354 . . . . 0.0 111.738 179.905 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 69' ' ' VAL . . . . . . . . . . . . . 56.0 t -124.66 134.61 66.35 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.917 0 N-CA-C 109.136 -0.69 . . . . 0.0 109.136 179.987 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -67.02 149.83 50.08 Favored 'General case' 0 C--N 1.304 -1.41 0 O-C-N 121.527 -0.733 . . . . 0.0 110.27 -179.625 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 71' ' ' ASP . . . . . 0.547 ' OD1' ' N ' ' A' ' 72' ' ' ASN . 48.2 p-10 -64.75 -29.51 70.49 Favored 'General case' 0 N--CA 1.488 1.456 0 O-C-N 121.565 -0.709 . . . . 0.0 109.566 179.797 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 72' ' ' ASN . . . . . 0.547 ' N ' ' OD1' ' A' ' 71' ' ' ASP . 89.2 m-20 -90.27 8.28 34.04 Favored 'General case' 0 N--CA 1.49 1.548 0 O-C-N 121.299 -0.876 . . . . 0.0 108.959 -179.942 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -68.76 148.75 49.88 Favored 'General case' 0 N--CA 1.49 1.564 0 O-C-N 121.506 -0.746 . . . . 0.0 110.464 -179.613 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 74' ' ' THR . . . . . . . . . . . . . 12.7 p -100.27 3.71 43.68 Favored 'General case' 0 N--CA 1.494 1.764 0 O-C-N 121.451 -0.78 . . . . 0.0 109.471 179.821 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 22.2 pt-20 -142.28 160.96 39.22 Favored 'General case' 0 N--CA 1.495 1.819 0 O-C-N 121.137 -0.977 . . . . 0.0 109.55 179.796 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 9.9 tp -127.55 135.03 49.76 Favored 'General case' 0 N--CA 1.493 1.717 0 O-C-N 121.636 -0.665 . . . . 0.0 109.285 -179.88 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 77' ' ' HIS . . . . . . . . . . . . . 75.1 m80 -108.4 128.63 54.94 Favored 'General case' 0 N--CA 1.494 1.768 0 N-CA-C 109.16 -0.681 . . . . 0.0 109.16 179.699 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -151.79 154.57 36.49 Favored 'General case' 0 N--CA 1.489 1.506 0 O-C-N 121.258 -0.901 . . . . 0.0 109.369 179.992 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 79' ' ' ARG . . . . . 0.455 ' O ' ' OE2' ' A' ' 65' ' ' GLU . 84.5 mtt85 -128.74 150.43 50.28 Favored 'General case' 0 N--CA 1.493 1.724 0 N-CA-C 109.311 -0.626 . . . . 0.0 109.311 -179.834 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 80' ' ' PHE . . . . . . . . . . . . . 83.1 m-85 -130.58 147.75 52.3 Favored 'General case' 0 N--CA 1.494 1.774 0 O-C-N 121.609 -0.682 . . . . 0.0 109.22 -179.742 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 49.5 mttm -113.67 139.05 49.38 Favored 'General case' 0 N--CA 1.495 1.819 0 N-CA-C 109.173 -0.676 . . . . 0.0 109.173 179.833 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 82' ' ' PHE . . . . . . . . . . . . . 79.2 m-85 -133.19 158.8 41.95 Favored 'General case' 0 N--CA 1.495 1.786 0 CA-C-O 121.496 0.665 . . . . 0.0 109.872 -179.582 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 81.7 tt0 -65.52 -37.66 87.42 Favored 'General case' 0 C--N 1.303 -1.423 0 O-C-N 121.543 -0.723 . . . . 0.0 109.559 179.953 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 84' ' ' VAL . . . . . . . . . . . . . 35.7 m -136.08 159.56 38.89 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.961 0 O-C-N 121.378 -0.826 . . . . 0.0 110.282 -179.549 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 85' ' ' SER . . . . . 0.509 ' O ' ' N ' ' A' ' 88' ' ' LYS . 38.6 t -64.77 -38.95 92.71 Favored 'General case' 0 N--CA 1.49 1.556 0 O-C-N 121.791 -0.568 . . . . 0.0 110.191 -179.946 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 86' ' ' ALA . . . . . . . . . . . . . . . -40.8 -39.46 1.12 Allowed 'General case' 0 N--CA 1.494 1.767 0 O-C-N 121.607 -0.683 . . . . 0.0 110.24 -179.353 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 87' ' ' GLU . . . . . 0.475 ' OE1' ' CG1' ' A' ' 58' ' ' VAL . 79.5 mm-40 -66.02 -34.03 77.16 Favored 'General case' 0 N--CA 1.488 1.432 0 O-C-N 121.508 -0.745 . . . . 0.0 109.477 179.751 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 88' ' ' LYS . . . . . 0.509 ' N ' ' O ' ' A' ' 85' ' ' SER . 88.5 tttt -62.15 -44.9 95.61 Favored 'General case' 0 N--CA 1.489 1.509 0 O-C-N 121.297 -0.877 . . . . 0.0 109.936 -179.988 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 50.7 tp -62.56 -50.35 71.68 Favored 'General case' 0 N--CA 1.489 1.483 0 O-C-N 121.271 -0.893 . . . . 0.0 110.234 -178.905 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 90' ' ' ILE . . . . . 0.543 ' N ' HD12 ' A' ' 90' ' ' ILE . 1.4 mp -69.27 -45.42 79.27 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.567 0 O-C-N 121.302 -0.874 . . . . 0.0 109.853 -179.684 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 91' ' ' PHE . . . . . 0.417 ' CE1' ' HB2' ' A' ' 55' ' ' ALA . 69.7 t80 -62.59 -44.66 95.76 Favored 'General case' 0 N--CA 1.489 1.51 0 O-C-N 121.388 -0.82 . . . . 0.0 110.168 -179.551 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 92' ' ' GLU . . . . . 0.515 ' OE2' ' NH2' ' A' ' 96' ' ' ARG . 83.0 tt0 -62.36 -38.74 90.71 Favored 'General case' 0 C--N 1.305 -1.369 0 O-C-N 121.358 -0.839 . . . . 0.0 109.95 -179.36 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 93' ' ' LEU . . . . . . . . . . . . . 39.3 mt -63.2 -44.4 95.43 Favored 'General case' 0 N--CA 1.49 1.55 0 O-C-N 121.209 -0.932 . . . . 0.0 109.97 -179.574 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 94' ' ' LYS . . . . . . . . . . . . . 60.9 mttp -66.32 -44.15 84.19 Favored 'General case' 0 N--CA 1.488 1.467 0 O-C-N 121.183 -0.948 . . . . 0.0 110.128 -179.993 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 34.3 p -68.31 -35.82 78.39 Favored 'General case' 0 N--CA 1.487 1.423 0 O-C-N 121.338 -0.851 . . . . 0.0 109.714 -179.654 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 96' ' ' ARG . . . . . 0.515 ' NH2' ' OE2' ' A' ' 92' ' ' GLU . 19.3 tpp180 -68.08 -39.53 82.91 Favored 'General case' 0 N--CA 1.488 1.467 0 O-C-N 121.197 -0.94 . . . . 0.0 108.773 179.608 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 97' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.486 1.372 0 O-C-N 121.337 -0.852 . . . . 0.0 109.097 179.935 . . . . . . . . 0 0 . 1 . 004 nuclear build core ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 99.6 m-20 . . . . . 0 N--CA 1.49 1.543 0 CA-C-O 121.363 0.602 . . . . 0.0 109.44 . . . . . . . . . 0 0 . 1 . 004 nuclear build core ' A' A ' 31' ' ' VAL . . . . . 0.443 HG22 ' N ' ' A' ' 32' ' ' ALA . 9.2 p -86.16 161.34 2.98 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.635 0 O-C-N 121.34 -0.85 . . . . 0.0 109.608 -179.67 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 32' ' ' ALA . . . . . 0.443 ' N ' HG22 ' A' ' 31' ' ' VAL . . . -143.61 139.42 29.63 Favored 'General case' 0 N--CA 1.493 1.721 0 O-C-N 121.294 -0.879 . . . . 0.0 109.016 179.835 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 83.7 tt0 -101.38 142.75 32.33 Favored 'General case' 0 N--CA 1.494 1.755 0 O-C-N 121.403 -0.81 . . . . 0.0 109.132 179.989 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 34' ' ' VAL . . . . . . . . . . . . . 52.4 t -122.54 131.56 72.97 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.905 0 N-CA-C 108.905 -0.776 . . . . 0.0 108.905 179.812 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 35.3 m -111.17 123.41 50.15 Favored 'General case' 0 N--CA 1.494 1.735 0 N-CA-C 108.658 -0.867 . . . . 0.0 108.658 179.904 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 26.3 mt -119.23 149.41 41.81 Favored 'General case' 0 N--CA 1.497 1.887 0 O-C-N 121.501 -0.75 . . . . 0.0 109.649 -179.436 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 37' ' ' PHE . . . . . . . . . . . . . 97.0 m-85 -128.74 147.36 50.76 Favored 'General case' 0 N--CA 1.493 1.717 0 N-CA-C 109.083 -0.71 . . . . 0.0 109.083 -179.405 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . -177.79 -177.65 46.75 Favored Glycine 0 N--CA 1.487 2.091 0 N-CA-C 109.474 -1.45 . . . . 0.0 109.474 -179.865 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 8.7 p -87.48 -81.64 0.23 Allowed 'General case' 0 N--CA 1.489 1.498 0 O-C-N 121.387 -1.066 . . . . 0.0 109.824 -179.911 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 40' ' ' ASP . . . . . . . . . . . . . 52.4 p30 -87.78 168.51 12.89 Favored 'General case' 0 N--CA 1.493 1.724 0 O-C-N 121.464 -0.772 . . . . 0.0 110.399 -179.445 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 88.6 tttt -65.93 -36.63 83.9 Favored 'General case' 0 N--CA 1.49 1.555 0 O-C-N 121.674 -0.641 . . . . 0.0 110.188 179.883 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -57.64 -41.62 81.76 Favored 'General case' 0 N--CA 1.492 1.629 0 O-C-N 121.272 -0.893 . . . . 0.0 110.155 -179.106 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 43' ' ' HIS . . . . . . . . . . . . . 80.0 t60 -63.39 -42.13 98.79 Favored 'General case' 0 N--CA 1.489 1.516 0 O-C-N 121.169 -0.957 . . . . 0.0 109.42 -179.788 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 95.3 mt -63.47 -40.54 97.39 Favored 'General case' 0 N--CA 1.489 1.514 0 O-C-N 121.399 -0.813 . . . . 0.0 109.827 -179.671 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 74.5 mt-10 -62.75 -39.68 94.9 Favored 'General case' 0 N--CA 1.488 1.437 0 O-C-N 121.239 -0.913 . . . . 0.0 109.759 -179.639 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . -65.01 -45.17 93.1 Favored Glycine 0 N--CA 1.49 2.287 0 N-CA-C 109.671 -1.372 . . . . 0.0 109.671 -179.844 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 16.9 tptm -64.95 -36.03 83.07 Favored 'General case' 0 N--CA 1.489 1.509 0 O-C-N 121.27 -1.135 . . . . 0.0 109.236 179.882 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 60.8 tp -61.73 -39.5 91.74 Favored 'General case' 0 N--CA 1.488 1.451 0 O-C-N 121.339 -0.851 . . . . 0.0 109.345 -179.707 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 49' ' ' ALA . . . . . . . . . . . . . . . -54.03 -34.01 58.81 Favored 'General case' 0 N--CA 1.488 1.468 0 O-C-N 121.336 -0.852 . . . . 0.0 109.823 -179.627 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 79.3 mm-40 -65.31 -41.04 94.46 Favored 'General case' 0 N--CA 1.491 1.599 0 O-C-N 121.226 -0.921 . . . . 0.0 109.713 -179.981 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 10.8 m-85 -60.78 -39.67 89.72 Favored 'General case' 0 N--CA 1.491 1.581 0 O-C-N 121.487 -0.758 . . . . 0.0 109.552 -179.631 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 52' ' ' ILE . . . . . 0.522 HD12 ' CE1' ' A' ' 64' ' ' TYR . 34.1 mm -63.59 -43.51 98.25 Favored 'Isoleucine or valine' 0 C--N 1.301 -1.536 0 O-C-N 121.39 -0.819 . . . . 0.0 109.491 -179.484 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 53' ' ' SER . . . . . 0.481 ' O ' ' NE2' ' A' ' 57' ' ' GLN . 71.1 m -60.32 -51.7 68.4 Favored 'General case' 0 N--CA 1.492 1.674 0 O-C-N 121.081 -1.012 . . . . 0.0 110.136 -179.488 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 54' ' ' LEU . . . . . 0.444 ' N ' HD12 ' A' ' 54' ' ' LEU . 10.4 mp -65.07 -41.68 94.86 Favored 'General case' 0 N--CA 1.491 1.587 0 O-C-N 121.166 -0.958 . . . . 0.0 109.418 179.785 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -64.67 -39.38 93.57 Favored 'General case' 0 N--CA 1.488 1.428 0 O-C-N 121.282 -0.886 . . . . 0.0 109.731 -179.692 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 56' ' ' LYS . . . . . . . . . . . . . 50.9 tttp -64.08 -45.17 89.91 Favored 'General case' 0 C--N 1.305 -1.36 0 O-C-N 121.237 -0.915 . . . . 0.0 109.393 -179.94 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 57' ' ' GLN . . . . . 0.534 ' OE1' ' N ' ' A' ' 57' ' ' GLN . 0.8 OUTLIER -65.73 -43.78 87.99 Favored 'General case' 0 N--CA 1.488 1.439 0 O-C-N 121.418 -0.801 . . . . 0.0 109.508 -179.853 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 58' ' ' VAL . . . . . . . . . . . . . 56.0 t -63.35 -45.81 97.14 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.39 0 O-C-N 121.25 -0.906 . . . . 0.0 109.453 -179.801 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 59' ' ' TYR . . . . . . . . . . . . . 71.4 t80 -137.79 119.11 14.65 Favored 'General case' 0 N--CA 1.494 1.752 0 O-C-N 121.334 -0.854 . . . . 0.0 109.578 -179.502 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -69.75 153.53 43.24 Favored 'General case' 0 N--CA 1.493 1.682 0 O-C-N 121.563 -0.71 . . . . 0.0 110.538 -179.486 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 61' ' ' ASN . . . . . . . . . . . . . 98.2 m-20 57.73 36.44 26.57 Favored 'General case' 0 N--CA 1.494 1.746 0 O-C-N 121.752 -0.592 . . . . 0.0 109.671 179.897 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 62' ' ' VAL . . . . . . . . . . . . . 12.3 p -72.65 138.45 21.44 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.583 0 O-C-N 121.436 -0.79 . . . . 0.0 109.858 179.933 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 83.1 tt0 -115.61 142.19 47.07 Favored 'General case' 0 N--CA 1.497 1.921 0 O-C-N 121.571 -0.705 . . . . 0.0 109.313 -179.878 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 64' ' ' TYR . . . . . 0.522 ' CE1' HD12 ' A' ' 52' ' ' ILE . 51.4 p90 -148.29 161.27 41.86 Favored 'General case' 0 N--CA 1.493 1.709 0 O-C-N 121.365 -0.834 . . . . 0.0 109.539 -179.866 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 51.1 tp10 -141.0 147.76 39.21 Favored 'General case' 0 N--CA 1.495 1.799 0 N-CA-C 108.687 -0.857 . . . . 0.0 108.687 179.911 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 66' ' ' VAL . . . . . . . . . . . . . 28.8 m -117.82 129.08 74.77 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.805 0 CA-C-O 121.688 0.756 . . . . 0.0 109.953 -179.472 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 67' ' ' ALA . . . . . 0.625 ' HB1' ' HD2' ' A' ' 68' ' ' PRO . . . -70.65 171.81 7.44 Favored Pre-proline 0 N--CA 1.49 1.558 0 O-C-N 121.657 -0.652 . . . . 0.0 109.61 -179.417 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 68' ' ' PRO . . . . . 0.625 ' HD2' ' HB1' ' A' ' 67' ' ' ALA . 73.2 Cg_exo -50.86 129.89 29.2 Favored 'Trans proline' 0 N--CA 1.497 1.7 0 C-N-CA 122.355 2.037 . . . . 0.0 112.399 179.891 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 69' ' ' VAL . . . . . . . . . . . . . 54.4 t -131.04 134.42 61.53 Favored 'Isoleucine or valine' 0 N--CA 1.499 2.016 0 O-C-N 121.455 -0.778 . . . . 0.0 109.247 179.814 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -83.36 159.73 21.78 Favored 'General case' 0 N--CA 1.491 1.577 0 O-C-N 121.434 -0.792 . . . . 0.0 109.897 -179.913 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 53.3 t0 -64.12 -36.08 82.85 Favored 'General case' 0 N--CA 1.491 1.604 0 O-C-N 121.5 -0.75 . . . . 0.0 109.662 179.562 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 72' ' ' ASN . . . . . . . . . . . . . 55.7 p30 -96.67 17.33 16.69 Favored 'General case' 0 N--CA 1.495 1.778 0 O-C-N 121.235 -0.916 . . . . 0.0 109.237 -179.726 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -61.88 144.23 55.23 Favored 'General case' 0 N--CA 1.492 1.64 0 O-C-N 121.414 -0.804 . . . . 0.0 110.167 -179.641 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 74' ' ' THR . . . . . . . . . . . . . 71.8 p -101.79 -3.07 28.69 Favored 'General case' 0 N--CA 1.496 1.826 0 O-C-N 121.48 -0.763 . . . . 0.0 109.467 179.703 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 17.0 pt-20 -148.62 158.69 44.31 Favored 'General case' 0 N--CA 1.494 1.744 0 O-C-N 121.145 -0.972 . . . . 0.0 109.361 179.624 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 5.7 tt -131.7 134.52 46.0 Favored 'General case' 0 N--CA 1.496 1.829 0 O-C-N 121.521 -0.737 . . . . 0.0 109.237 -179.981 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 77' ' ' HIS . . . . . . . . . . . . . 98.2 m-70 -103.28 130.59 50.58 Favored 'General case' 0 N--CA 1.494 1.738 0 N-CA-C 109.255 -0.646 . . . . 0.0 109.255 -179.642 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -142.53 155.01 44.98 Favored 'General case' 0 N--CA 1.494 1.725 0 O-C-N 121.286 -0.884 . . . . 0.0 109.517 -179.726 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 83.9 mtp180 -127.95 148.11 50.5 Favored 'General case' 0 N--CA 1.494 1.745 0 N-CA-C 108.957 -0.757 . . . . 0.0 108.957 -179.86 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 80' ' ' PHE . . . . . . . . . . . . . 62.4 m-85 -129.33 147.83 51.2 Favored 'General case' 0 N--CA 1.496 1.862 0 O-C-N 121.555 -0.716 . . . . 0.0 109.285 -179.572 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 70.9 mmtt -112.6 104.1 12.18 Favored 'General case' 0 N--CA 1.496 1.827 0 N-CA-C 108.79 -0.818 . . . . 0.0 108.79 -179.996 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 82' ' ' PHE . . . . . . . . . . . . . 68.1 m-85 -98.91 148.92 23.47 Favored 'General case' 0 N--CA 1.492 1.636 0 O-C-N 121.591 -0.693 . . . . 0.0 109.871 -179.263 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 82.9 tt0 -65.4 -36.82 85.13 Favored 'General case' 0 N--CA 1.488 1.431 0 O-C-N 121.48 -0.762 . . . . 0.0 109.904 -179.648 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 84' ' ' VAL . . . . . . . . . . . . . 27.4 m -133.49 156.86 42.13 Favored 'Isoleucine or valine' 0 N--CA 1.499 2.021 0 O-C-N 121.333 -0.854 . . . . 0.0 110.073 -179.582 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 27.1 t -70.15 -17.43 63.18 Favored 'General case' 0 N--CA 1.488 1.443 0 O-C-N 121.573 -0.704 . . . . 0.0 109.529 179.899 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 86' ' ' ALA . . . . . . . . . . . . . . . -62.43 -41.17 98.52 Favored 'General case' 0 N--CA 1.49 1.528 0 O-C-N 121.256 -0.902 . . . . 0.0 109.537 -179.722 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 98.9 mt-10 -65.59 -33.51 76.07 Favored 'General case' 0 C--N 1.302 -1.475 0 O-C-N 121.458 -0.776 . . . . 0.0 109.024 179.642 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 88' ' ' LYS . . . . . . . . . . . . . 88.2 tttt -62.98 -43.96 97.36 Favored 'General case' 0 C--N 1.303 -1.433 0 O-C-N 121.449 -0.782 . . . . 0.0 109.979 179.836 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 96.3 mt -62.42 -48.11 81.13 Favored 'General case' 0 N--CA 1.488 1.427 0 O-C-N 121.193 -0.942 . . . . 0.0 109.884 -179.04 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 90' ' ' ILE . . . . . 0.53 ' N ' HD12 ' A' ' 90' ' ' ILE . 1.4 mp -70.58 -44.44 76.8 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.599 0 O-C-N 121.3 -0.875 . . . . 0.0 109.312 179.639 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 91' ' ' PHE . . . . . 0.456 ' O ' HG23 ' A' ' 95' ' ' THR . 70.6 t80 -59.13 -44.56 92.03 Favored 'General case' 0 C--N 1.299 -1.606 0 O-C-N 121.461 -0.774 . . . . 0.0 109.883 -179.196 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 92' ' ' GLU . . . . . . . . . . . . . 42.8 tp10 -63.18 -59.09 5.22 Favored 'General case' 0 N--CA 1.49 1.527 0 O-C-N 121.26 -0.9 . . . . 0.0 110.3 -179.322 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 93' ' ' LEU . . . . . 0.445 ' N ' HD12 ' A' ' 93' ' ' LEU . 8.8 mp -63.1 -42.67 99.63 Favored 'General case' 0 N--CA 1.492 1.65 0 O-C-N 121.315 -0.866 . . . . 0.0 109.954 -179.347 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 94' ' ' LYS . . . . . . . . . . . . . 64.2 tttp -62.86 -45.29 93.27 Favored 'General case' 0 C--N 1.301 -1.505 0 O-C-N 121.298 -0.876 . . . . 0.0 109.834 -179.682 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 95' ' ' THR . . . . . 0.456 HG23 ' O ' ' A' ' 91' ' ' PHE . 22.0 p -65.97 -43.03 89.08 Favored 'General case' 0 N--CA 1.488 1.452 0 O-C-N 121.117 -0.989 . . . . 0.0 109.354 179.709 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 96' ' ' ARG . . . . . . . . . . . . . 93.0 mtt-85 -64.35 -38.51 91.29 Favored 'General case' 0 N--CA 1.487 1.381 0 O-C-N 121.278 -0.889 . . . . 0.0 109.02 179.36 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 97' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.304 -1.388 0 O-C-N 121.537 -0.727 . . . . 0.0 109.182 179.756 . . . . . . . . 0 0 . 1 . 005 nuclear build core ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 44.2 p30 . . . . . 0 N--CA 1.493 1.7 0 N-CA-C 109.007 -0.738 . . . . 0.0 109.007 . . . . . . . . . 0 0 . 1 . 005 nuclear build core ' A' A ' 31' ' ' VAL . . . . . 0.434 ' CG1' HH21 ' A' ' 79' ' ' ARG . 93.3 t -118.71 134.56 61.93 Favored 'Isoleucine or valine' 0 N--CA 1.499 2.016 0 CA-C-O 121.712 0.768 . . . . 0.0 109.452 -179.822 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -98.88 157.2 16.47 Favored 'General case' 0 N--CA 1.494 1.745 0 CA-C-O 121.787 0.803 . . . . 0.0 110.409 -179.019 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 33' ' ' GLU . . . . . 0.424 ' OE1' ' CD ' ' A' ' 79' ' ' ARG . 48.9 tp10 -108.03 126.0 52.22 Favored 'General case' 0 N--CA 1.493 1.7 0 CA-C-O 121.716 0.769 . . . . 0.0 110.13 -179.186 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 34' ' ' VAL . . . . . . . . . . . . . 54.0 t -124.24 133.62 68.85 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.875 0 CA-C-O 121.629 0.728 . . . . 0.0 109.626 179.635 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 74.0 p -137.03 126.91 25.72 Favored 'General case' 0 N--CA 1.494 1.752 0 CA-C-O 121.854 0.835 . . . . 0.0 110.042 179.276 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 40.0 tp -117.41 132.41 56.58 Favored 'General case' 0 N--CA 1.49 1.527 0 CA-C-O 121.665 0.745 . . . . 0.0 109.788 179.74 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 37' ' ' PHE . . . . . . . . . . . . . 90.7 t80 -109.04 131.1 55.4 Favored 'General case' 0 N--CA 1.493 1.707 0 CA-C-O 121.868 0.842 . . . . 0.0 109.582 179.99 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . -173.14 -164.23 28.15 Favored Glycine 0 N--CA 1.487 2.061 0 N-CA-C 109.867 -1.293 . . . . 0.0 109.867 -179.689 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 22.9 t -62.55 -147.56 0.0 OUTLIER 'General case' 0 N--CA 1.49 1.534 0 O-C-N 121.891 -0.77 . . . . 0.0 110.726 -179.237 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 40' ' ' ASP . . . . . . . . . . . . . 44.6 p-10 -55.94 174.77 0.11 Allowed 'General case' 0 N--CA 1.488 1.444 0 CA-C-O 121.771 0.795 . . . . 0.0 110.807 -178.812 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 88.7 tttt -62.53 -41.16 98.69 Favored 'General case' 0 N--CA 1.49 1.554 0 CA-C-O 121.225 0.536 . . . . 0.0 109.868 -179.075 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -53.67 -46.83 70.76 Favored 'General case' 0 N--CA 1.492 1.647 0 O-C-N 121.897 -0.502 . . . . 0.0 109.978 -178.965 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 43' ' ' HIS . . . . . . . . . . . . . 59.1 t-80 -62.96 -40.8 98.78 Favored 'General case' 0 C--N 1.302 -1.476 0 O-C-N 121.749 -0.595 . . . . 0.0 109.462 -179.619 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 95.1 mt -63.33 -39.99 96.08 Favored 'General case' 0 N--CA 1.491 1.592 0 O-C-N 121.805 -0.559 . . . . 0.0 109.546 -179.702 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 95.1 mt-10 -61.28 -41.02 96.24 Favored 'General case' 0 N--CA 1.49 1.555 0 N-CA-C 109.262 -0.644 . . . . 0.0 109.262 -179.756 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . -61.17 -42.5 99.8 Favored Glycine 0 N--CA 1.492 2.376 0 N-CA-C 109.65 -1.38 . . . . 0.0 109.65 -179.725 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 71.2 mmtt -81.53 -21.14 38.76 Favored 'General case' 0 N--CA 1.492 1.647 0 O-C-N 121.702 -0.881 . . . . 0.0 108.953 -179.801 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 44.9 tp -63.41 -40.15 96.42 Favored 'General case' 0 N--CA 1.489 1.504 0 CA-C-O 121.308 0.575 . . . . 0.0 109.48 -179.694 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 49' ' ' ALA . . . . . . . . . . . . . . . -49.89 -38.16 34.52 Favored 'General case' 0 N--CA 1.492 1.628 0 O-C-N 121.846 -0.534 . . . . 0.0 109.933 -178.635 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 50' ' ' GLU . . . . . 0.458 ' OE1' ' N ' ' A' ' 50' ' ' GLU . 56.5 mp0 -68.01 -43.14 79.5 Favored 'General case' 0 N--CA 1.491 1.581 0 O-C-N 121.635 -0.666 . . . . 0.0 109.777 -179.929 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 10.0 m-85 -63.07 -45.48 91.97 Favored 'General case' 0 N--CA 1.492 1.635 0 N-CA-C 109.58 -0.526 . . . . 0.0 109.58 -179.337 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 52' ' ' ILE . . . . . . . . . . . . . 92.0 mt -64.97 -42.75 95.57 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.531 0 N-CA-C 109.331 -0.618 . . . . 0.0 109.331 -179.746 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 49.6 m -57.43 -41.31 80.21 Favored 'General case' 0 N--CA 1.495 1.776 0 O-C-N 121.815 -0.553 . . . . 0.0 109.608 -179.151 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 54' ' ' LEU . . . . . 0.635 HD22 ' NZ ' ' A' ' 94' ' ' LYS . 82.6 mt -63.35 -40.21 96.64 Favored 'General case' 0 N--CA 1.491 1.584 0 N-CA-C 109.336 -0.616 . . . . 0.0 109.336 179.964 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 55' ' ' ALA . . . . . 0.477 ' HB2' ' CE1' ' A' ' 91' ' ' PHE . . . -59.26 -42.77 91.96 Favored 'General case' 0 N--CA 1.489 1.484 0 N-CA-C 109.194 -0.669 . . . . 0.0 109.194 -179.417 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 56' ' ' LYS . . . . . . . . . . . . . 64.1 tttp -65.46 -41.02 93.85 Favored 'General case' 0 N--CA 1.486 1.339 0 CA-C-O 121.265 0.555 . . . . 0.0 109.624 179.984 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 16.5 tt0 -64.07 -43.75 94.5 Favored 'General case' 0 N--CA 1.491 1.58 0 O-C-N 121.76 -0.587 . . . . 0.0 109.587 -179.274 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 58' ' ' VAL . . . . . . . . . . . . . 72.1 t -65.38 -44.89 94.45 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.563 0 N-CA-C 109.561 -0.533 . . . . 0.0 109.561 -179.708 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 59' ' ' TYR . . . . . 0.417 ' O ' ' O ' ' A' ' 60' ' ' ALA . 58.4 t80 -127.12 132.33 50.61 Favored 'General case' 0 N--CA 1.498 1.945 0 CA-C-O 121.812 0.815 . . . . 0.0 109.611 -179.595 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 60' ' ' ALA . . . . . 0.417 ' O ' ' O ' ' A' ' 59' ' ' TYR . . . -42.34 -97.0 0.0 OUTLIER 'General case' 0 N--CA 1.491 1.593 0 CA-C-O 121.378 0.608 . . . . 0.0 110.739 -179.281 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 61' ' ' ASN . . . . . . . . . . . . . 20.2 t-20 -85.05 92.62 8.4 Favored 'General case' 0 N--CA 1.491 1.581 0 CA-C-O 121.713 0.768 . . . . 0.0 109.856 -178.74 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 62' ' ' VAL . . . . . . . . . . . . . 10.9 p -99.45 133.71 41.27 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.717 0 CA-C-O 121.801 0.81 . . . . 0.0 110.037 179.995 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 81.0 tt0 -105.13 143.7 32.95 Favored 'General case' 0 N--CA 1.49 1.546 0 CA-C-O 121.702 0.763 . . . . 0.0 109.283 179.979 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 64' ' ' TYR . . . . . . . . . . . . . 51.0 p90 -151.96 161.15 43.1 Favored 'General case' 0 C--N 1.303 -1.443 0 CA-C-O 121.962 0.887 . . . . 0.0 110.493 -179.594 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 47.7 tp10 -147.18 146.95 30.04 Favored 'General case' 0 N--CA 1.49 1.57 0 CA-C-O 121.729 0.776 . . . . 0.0 109.32 179.83 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 66' ' ' VAL . . . . . . . . . . . . . 88.4 t -102.57 125.13 56.91 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.707 0 CA-C-O 121.866 0.841 . . . . 0.0 109.935 -179.926 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 67' ' ' ALA . . . . . 0.598 ' HB1' ' HD2' ' A' ' 68' ' ' PRO . . . -76.97 171.08 13.36 Favored Pre-proline 0 C--N 1.304 -1.41 0 CA-C-O 121.227 0.536 . . . . 0.0 109.935 -179.72 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 68' ' ' PRO . . . . . 0.598 ' HD2' ' HB1' ' A' ' 67' ' ' ALA . 51.1 Cg_exo -54.48 137.32 72.38 Favored 'Trans proline' 0 N--CA 1.496 1.62 0 C-N-CA 122.965 2.443 . . . . 0.0 113.057 -179.923 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 69' ' ' VAL . . . . . 0.453 ' C ' ' H ' ' A' ' 71' ' ' ASP . 73.2 t -128.39 131.91 68.57 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.928 0 CA-C-O 121.848 0.832 . . . . 0.0 110.087 179.963 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 70' ' ' ALA . . . . . 0.646 ' O ' ' N ' ' A' ' 72' ' ' ASN . . . -74.8 34.25 0.1 Allowed 'General case' 0 N--CA 1.491 1.6 0 CA-C-N 116.154 -0.475 . . . . 0.0 109.963 179.811 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 71' ' ' ASP . . . . . 0.453 ' H ' ' C ' ' A' ' 69' ' ' VAL . 66.4 t0 54.78 -72.52 0.01 OUTLIER 'General case' 0 N--CA 1.493 1.708 0 CA-C-O 121.448 0.642 . . . . 0.0 109.969 179.693 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 72' ' ' ASN . . . . . 0.783 ' O ' HG23 ' A' ' 74' ' ' THR . 63.8 t30 -84.67 12.54 6.99 Favored 'General case' 0 C--N 1.301 -1.533 0 N-CA-C 108.626 -0.879 . . . . 0.0 108.626 179.941 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 73' ' ' ALA . . . . . 0.512 ' HB2' ' HB3' ' A' ' 70' ' ' ALA . . . -52.16 -6.53 0.05 OUTLIER 'General case' 0 N--CA 1.497 1.902 0 N-CA-C 109.503 -0.554 . . . . 0.0 109.503 179.95 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 74' ' ' THR . . . . . 0.783 HG23 ' O ' ' A' ' 72' ' ' ASN . 70.4 p 51.03 11.59 0.1 Allowed 'General case' 0 C--N 1.304 -1.411 0 CA-C-O 121.469 0.652 . . . . 0.0 109.296 -179.771 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 75' ' ' GLU . . . . . 0.49 ' H ' ' C ' ' A' ' 73' ' ' ALA . 81.9 tt0 -149.63 151.98 34.66 Favored 'General case' 0 C--N 1.302 -1.457 0 CA-C-O 121.666 0.746 . . . . 0.0 109.446 179.582 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 7.2 tt -128.31 131.08 48.67 Favored 'General case' 0 N--CA 1.489 1.493 0 CA-C-O 121.796 0.807 . . . . 0.0 109.798 179.848 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 77' ' ' HIS . . . . . . . . . . . . . 98.3 m-70 -101.91 128.87 48.11 Favored 'General case' 0 N--CA 1.495 1.781 0 CA-C-O 121.906 0.86 . . . . 0.0 109.92 -180.0 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -136.0 152.2 50.69 Favored 'General case' 0 N--CA 1.491 1.595 0 CA-C-O 121.674 0.749 . . . . 0.0 109.88 179.991 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 79' ' ' ARG . . . . . 0.434 HH21 ' CG1' ' A' ' 31' ' ' VAL . 50.1 mmm-85 -127.7 144.53 51.07 Favored 'General case' 0 N--CA 1.494 1.74 0 CA-C-O 121.755 0.788 . . . . 0.0 109.544 -179.25 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 80' ' ' PHE . . . . . . . . . . . . . 82.1 m-85 -130.6 150.78 51.64 Favored 'General case' 0 N--CA 1.494 1.741 0 CA-C-O 121.571 0.7 . . . . 0.0 109.819 -179.385 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 63.1 tttm -114.96 127.9 55.96 Favored 'General case' 0 N--CA 1.495 1.793 0 CA-C-O 121.722 0.772 . . . . 0.0 110.041 -179.514 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 82' ' ' PHE . . . . . . . . . . . . . 81.1 m-85 -129.37 143.9 51.03 Favored 'General case' 0 N--CA 1.496 1.852 0 CA-C-O 121.732 0.777 . . . . 0.0 109.904 179.579 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 6.8 pt-20 -69.39 -34.27 74.27 Favored 'General case' 0 N--CA 1.489 1.491 0 N-CA-C 109.487 -0.56 . . . . 0.0 109.487 -179.672 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 84' ' ' VAL . . . . . . . . . . . . . 26.8 m -131.37 161.03 41.86 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.924 0 CA-C-O 121.885 0.85 . . . . 0.0 110.29 -179.629 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 33.6 m -76.54 -17.48 59.22 Favored 'General case' 0 N--CA 1.492 1.653 0 CA-C-N 116.055 -0.521 . . . . 0.0 109.91 -179.209 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 86' ' ' ALA . . . . . . . . . . . . . . . -62.71 -40.83 98.38 Favored 'General case' 0 N--CA 1.491 1.61 0 N-CA-C 109.129 -0.693 . . . . 0.0 109.129 -179.435 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 97.4 mt-10 -71.69 -32.16 67.54 Favored 'General case' 0 N--CA 1.49 1.541 0 N-CA-C 109.112 -0.699 . . . . 0.0 109.112 179.889 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 88' ' ' LYS . . . . . . . . . . . . . 88.0 tttt -62.84 -47.58 82.76 Favored 'General case' 0 N--CA 1.489 1.506 0 O-C-N 121.789 -0.569 . . . . 0.0 109.51 -179.711 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 96.9 mt -63.76 -45.54 89.33 Favored 'General case' 0 N--CA 1.491 1.587 0 O-C-N 121.745 -0.597 . . . . 0.0 110.151 -179.1 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 90' ' ' ILE . . . . . . . . . . . . . 96.9 mt -68.32 -43.96 84.07 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.636 0 CA-C-O 121.399 0.619 . . . . 0.0 109.41 -179.717 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 91' ' ' PHE . . . . . 0.477 ' CE1' ' HB2' ' A' ' 55' ' ' ALA . 40.3 t80 -61.78 -46.95 87.37 Favored 'General case' 0 N--CA 1.489 1.486 0 N-CA-C 109.28 -0.637 . . . . 0.0 109.28 -179.512 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 92' ' ' GLU . . . . . . . . . . . . . 95.4 mt-10 -67.32 -33.76 75.94 Favored 'General case' 0 N--CA 1.489 1.477 0 N-CA-C 109.142 -0.688 . . . . 0.0 109.142 179.751 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 93' ' ' LEU . . . . . . . . . . . . . 49.4 tp -63.75 -45.68 88.74 Favored 'General case' 0 N--CA 1.487 1.379 0 CA-C-O 121.373 0.606 . . . . 0.0 109.42 -179.559 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 94' ' ' LYS . . . . . 0.635 ' NZ ' HD22 ' A' ' 54' ' ' LEU . 7.9 mtpm? -66.98 -44.02 81.51 Favored 'General case' 0 N--CA 1.489 1.515 0 O-C-N 121.749 -0.595 . . . . 0.0 109.812 -179.446 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 67.0 p -67.53 -33.8 75.81 Favored 'General case' 0 N--CA 1.491 1.622 0 O-C-N 121.783 -0.573 . . . . 0.0 109.773 -179.262 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 96' ' ' ARG . . . . . . . . . . . . . 61.3 ttm-85 -62.62 -43.47 98.73 Favored 'General case' 0 N--CA 1.492 1.656 0 O-C-N 121.676 -0.64 . . . . 0.0 109.508 -179.563 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 97' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.492 1.647 0 N-CA-C 109.522 -0.547 . . . . 0.0 109.522 -179.661 . . . . . . . . 0 0 . 1 . 006 nuclear build core ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 96.0 m-20 . . . . . 0 N--CA 1.494 1.77 0 N-CA-C 109.13 -0.693 . . . . 0.0 109.13 . . . . . . . . . 0 0 . 1 . 006 nuclear build core ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 3.8 p -129.22 154.04 39.52 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.861 0 CA-C-O 121.641 0.734 . . . . 0.0 109.799 -179.69 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -122.51 142.02 51.03 Favored 'General case' 0 N--CA 1.496 1.853 0 CA-C-O 121.937 0.875 . . . . 0.0 109.819 -179.896 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 33' ' ' GLU . . . . . 0.4 ' H ' ' HG2' ' A' ' 33' ' ' GLU . 21.9 pt-20 -94.36 138.01 32.83 Favored 'General case' 0 N--CA 1.492 1.669 0 CA-C-O 121.782 0.801 . . . . 0.0 110.444 -179.154 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 34' ' ' VAL . . . . . 0.41 HG13 ' CE2' ' A' ' 51' ' ' TYR . 55.0 t -127.01 130.83 71.32 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.834 0 CA-C-O 121.844 0.83 . . . . 0.0 109.263 179.371 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 51.1 m -133.53 128.73 35.91 Favored 'General case' 0 N--CA 1.495 1.809 0 CA-C-O 121.522 0.677 . . . . 0.0 109.315 179.355 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 74.1 mt -119.43 151.37 38.64 Favored 'General case' 0 N--CA 1.499 1.996 0 CA-C-O 121.863 0.84 . . . . 0.0 110.223 -179.39 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 37' ' ' PHE . . . . . . . . . . . . . 96.1 m-85 -124.56 137.92 54.36 Favored 'General case' 0 N--CA 1.497 1.881 0 CA-C-O 121.866 0.841 . . . . 0.0 109.702 -179.669 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 38' ' ' GLY . . . . . 0.528 ' N ' HD21 ' A' ' 44' ' ' LEU . . . 177.2 179.89 47.73 Favored Glycine 0 N--CA 1.491 2.339 0 N-CA-C 110.296 -1.122 . . . . 0.0 110.296 -179.984 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 36.0 p -88.48 -76.69 0.39 Allowed 'General case' 0 N--CA 1.491 1.605 0 O-C-N 121.718 -0.871 . . . . 0.0 109.877 -179.705 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 40' ' ' ASP . . . . . . . . . . . . . 32.9 t70 -80.36 155.46 27.17 Favored 'General case' 0 N--CA 1.497 1.884 0 O-C-N 121.318 -0.864 . . . . 0.0 110.666 -179.2 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 88.8 tttt -63.37 -39.84 95.63 Favored 'General case' 0 N--CA 1.489 1.48 0 CA-C-O 121.107 0.479 . . . . 0.0 110.117 -179.645 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -54.93 -38.9 68.25 Favored 'General case' 0 N--CA 1.492 1.668 0 O-C-N 121.551 -0.718 . . . . 0.0 109.45 -178.951 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 43' ' ' HIS . . . . . 0.736 ' CE1' ' NZ ' ' A' ' 47' ' ' LYS . 28.1 t60 -67.54 -42.27 82.97 Favored 'General case' 0 N--CA 1.495 1.778 0 O-C-N 121.751 -0.593 . . . . 0.0 109.409 -179.999 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 44' ' ' LEU . . . . . 0.528 HD21 ' N ' ' A' ' 38' ' ' GLY . 96.0 mt -63.02 -40.54 98.07 Favored 'General case' 0 N--CA 1.487 1.385 0 N-CA-C 106.527 -1.657 . . . . 0.0 106.527 178.72 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 77.0 mm-40 -64.36 -32.04 73.49 Favored 'General case' 0 N--CA 1.487 1.409 0 CA-C-N 115.726 -0.67 . . . . 0.0 109.446 179.241 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . -61.33 -50.0 71.5 Favored Glycine 0 N--CA 1.495 2.589 0 N-CA-C 109.507 -1.437 . . . . 0.0 109.507 -179.756 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 47' ' ' LYS . . . . . 0.736 ' NZ ' ' CE1' ' A' ' 43' ' ' HIS . 62.2 mttp -65.99 -38.62 88.98 Favored 'General case' 0 N--CA 1.49 1.536 0 O-C-N 121.678 -0.895 . . . . 0.0 109.039 179.561 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 61.8 tp -56.07 -34.19 65.73 Favored 'General case' 0 C--N 1.302 -1.471 0 N-CA-C 109.348 -0.612 . . . . 0.0 109.348 -179.167 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 49' ' ' ALA . . . . . . . . . . . . . . . -60.05 -38.07 81.72 Favored 'General case' 0 N--CA 1.492 1.655 0 O-C-N 121.614 -0.679 . . . . 0.0 109.183 -179.601 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 97.0 mt-10 -67.8 -38.51 83.42 Favored 'General case' 0 N--CA 1.491 1.617 0 O-C-N 121.638 -0.664 . . . . 0.0 109.308 179.786 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 51' ' ' TYR . . . . . 0.41 ' CE2' HG13 ' A' ' 34' ' ' VAL . 8.3 m-85 -60.97 -45.5 94.5 Favored 'General case' 0 N--CA 1.493 1.676 0 N-CA-C 108.808 -0.812 . . . . 0.0 108.808 179.889 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 52' ' ' ILE . . . . . . . . . . . . . 92.0 mt -65.11 -44.63 95.55 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.557 0 N-CA-C 109.596 -0.52 . . . . 0.0 109.596 -179.828 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 66.9 m -62.9 -46.58 87.14 Favored 'General case' 0 N--CA 1.494 1.738 0 O-C-N 121.415 -0.803 . . . . 0.0 109.862 -179.459 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 54' ' ' LEU . . . . . . . . . . . . . 93.2 mt -65.94 -42.62 89.78 Favored 'General case' 0 N--CA 1.494 1.737 0 O-C-N 121.648 -0.657 . . . . 0.0 109.858 179.999 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -65.57 -38.82 90.64 Favored 'General case' 0 N--CA 1.491 1.589 0 O-C-N 121.81 -0.556 . . . . 0.0 110.015 -178.913 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 56' ' ' LYS . . . . . . . . . . . . . 66.1 tttm -64.82 -45.47 86.06 Favored 'General case' 0 N--CA 1.487 1.414 0 O-C-N 121.42 -0.8 . . . . 0.0 109.729 -179.426 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 98.3 mt-30 -66.38 -44.23 83.7 Favored 'General case' 0 N--CA 1.493 1.69 0 O-C-N 121.594 -0.692 . . . . 0.0 109.675 -179.606 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 58' ' ' VAL . . . . . . . . . . . . . 74.8 t -65.05 -44.65 95.79 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.536 0 N-CA-C 109.116 -0.698 . . . . 0.0 109.116 -179.637 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 59' ' ' TYR . . . . . . . . . . . . . 9.2 t80 -106.97 -143.5 0.38 Allowed 'General case' 0 N--CA 1.496 1.866 0 CA-C-O 121.498 0.666 . . . . 0.0 109.585 -179.676 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -164.79 125.01 1.96 Allowed 'General case' 0 N--CA 1.491 1.622 0 CA-C-O 121.851 0.834 . . . . 0.0 110.255 179.998 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 61' ' ' ASN . . . . . . . . . . . . . 30.8 t-20 57.92 36.24 26.06 Favored 'General case' 0 N--CA 1.493 1.682 0 CA-C-O 121.816 0.817 . . . . 0.0 109.127 179.738 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 62' ' ' VAL . . . . . . . . . . . . . 5.4 p -67.77 139.28 21.1 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.606 0 CA-C-O 121.776 0.798 . . . . 0.0 110.552 -179.653 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 49.9 tp10 -116.94 147.47 42.22 Favored 'General case' 0 N--CA 1.494 1.736 0 CA-C-O 121.65 0.738 . . . . 0.0 109.241 179.957 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 64' ' ' TYR . . . . . . . . . . . . . 48.3 p90 -149.39 166.18 29.83 Favored 'General case' 0 N--CA 1.49 1.556 0 CA-C-O 122.008 0.909 . . . . 0.0 110.798 -179.323 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 75.5 mm-40 -132.16 147.23 52.41 Favored 'General case' 0 N--CA 1.495 1.791 0 CA-C-O 121.496 0.665 . . . . 0.0 109.475 -179.711 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 66' ' ' VAL . . . . . . . . . . . . . 57.7 t -120.74 130.88 74.1 Favored 'Isoleucine or valine' 0 N--CA 1.5 2.058 0 CA-C-O 121.975 0.893 . . . . 0.0 109.968 -179.571 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -79.22 155.94 76.7 Favored Pre-proline 0 C--N 1.306 -1.299 0 N-CA-C 109.348 -0.612 . . . . 0.0 109.348 -179.484 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 68' ' ' PRO . . . . . . . . . . . . . 89.2 Cg_exo -45.71 127.94 10.39 Favored 'Trans proline' 0 N--CA 1.492 1.409 0 C-N-CA 122.612 2.208 . . . . 0.0 113.075 179.765 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 69' ' ' VAL . . . . . . . . . . . . . 47.9 t -130.89 132.46 63.88 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.898 0 CA-C-O 121.822 0.82 . . . . 0.0 110.057 179.807 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -73.29 151.96 41.14 Favored 'General case' 0 N--CA 1.49 1.527 0 CA-C-O 121.749 0.785 . . . . 0.0 110.146 179.328 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 71' ' ' ASP . . . . . 0.537 ' OD1' ' N ' ' A' ' 72' ' ' ASN . 41.5 p-10 -63.73 -35.11 79.5 Favored 'General case' 0 N--CA 1.489 1.505 0 O-C-N 121.769 -0.582 . . . . 0.0 109.607 -179.825 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 72' ' ' ASN . . . . . 0.537 ' N ' ' OD1' ' A' ' 71' ' ' ASP . 99.2 m-20 -95.59 15.3 20.23 Favored 'General case' 0 N--CA 1.494 1.742 0 N-CA-C 108.972 -0.751 . . . . 0.0 108.972 -179.556 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -61.09 146.93 45.6 Favored 'General case' 0 N--CA 1.498 1.954 0 CA-C-O 121.774 0.797 . . . . 0.0 110.704 -179.645 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 74' ' ' THR . . . . . . . . . . . . . 50.6 p -98.63 -1.68 40.28 Favored 'General case' 0 N--CA 1.498 1.943 0 O-C-N 121.751 -0.593 . . . . 0.0 109.467 -179.758 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 2.9 pp20? -156.13 160.1 39.61 Favored 'General case' 0 N--CA 1.495 1.78 0 O-C-N 121.243 -0.911 . . . . 0.0 110.395 179.695 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 5.4 tt -128.06 135.27 49.61 Favored 'General case' 0 N--CA 1.493 1.707 0 CA-C-O 121.565 0.697 . . . . 0.0 109.876 -179.869 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 77' ' ' HIS . . . . . . . . . . . . . 82.2 t60 -117.22 124.3 48.74 Favored 'General case' 0 N--CA 1.497 1.909 0 CA-C-O 122.143 0.973 . . . . 0.0 109.937 -179.883 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -152.62 159.65 43.22 Favored 'General case' 0 N--CA 1.49 1.565 0 CA-C-O 121.506 0.67 . . . . 0.0 109.591 179.708 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 96.5 mtt-85 -127.07 149.82 49.75 Favored 'General case' 0 N--CA 1.497 1.917 0 CA-C-O 121.553 0.692 . . . . 0.0 109.841 -179.528 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 80' ' ' PHE . . . . . . . . . . . . . 35.8 m-85 -122.9 149.68 43.91 Favored 'General case' 0 N--CA 1.497 1.902 0 CA-C-O 121.736 0.779 . . . . 0.0 109.62 -179.653 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 49.7 mtmt -108.56 115.12 29.51 Favored 'General case' 0 N--CA 1.494 1.749 0 CA-C-O 121.62 0.724 . . . . 0.0 109.437 -179.505 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 82' ' ' PHE . . . . . 0.677 ' C ' ' H ' ' A' ' 84' ' ' VAL . 53.6 m-85 -110.56 -0.7 17.21 Favored 'General case' 0 N--CA 1.497 1.889 0 N-CA-C 108.567 -0.901 . . . . 0.0 108.567 179.643 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 41.7 mm-40 63.62 -20.99 0.06 Allowed 'General case' 0 N--CA 1.492 1.657 0 N-CA-C 109.277 -0.638 . . . . 0.0 109.277 179.936 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 84' ' ' VAL . . . . . 0.677 ' H ' ' C ' ' A' ' 82' ' ' PHE . 3.3 m -133.83 133.58 56.49 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.519 0 CA-C-O 121.822 0.82 . . . . 0.0 109.674 -179.621 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 85' ' ' SER . . . . . 0.52 ' O ' ' N ' ' A' ' 88' ' ' LYS . 14.2 t -64.97 -41.0 95.82 Favored 'General case' 0 C--N 1.3 -1.581 0 CA-C-O 121.214 0.531 . . . . 0.0 110.156 179.919 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 86' ' ' ALA . . . . . 0.423 ' C ' ' O ' ' A' ' 85' ' ' SER . . . -41.15 -38.13 1.02 Allowed 'General case' 0 N--CA 1.496 1.854 0 O-C-N 121.514 -0.742 . . . . 0.0 110.121 -178.802 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -69.95 -32.88 71.36 Favored 'General case' 0 N--CA 1.489 1.5 0 O-C-N 121.481 -0.762 . . . . 0.0 109.517 -179.886 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 88' ' ' LYS . . . . . 0.52 ' N ' ' O ' ' A' ' 85' ' ' SER . 64.3 tttm -61.67 -47.19 86.49 Favored 'General case' 0 C--N 1.3 -1.569 0 O-C-N 121.845 -0.534 . . . . 0.0 109.88 -178.937 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 96.0 mt -64.76 -47.92 76.4 Favored 'General case' 0 N--CA 1.493 1.703 0 O-C-N 121.67 -0.644 . . . . 0.0 110.464 -178.94 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 90' ' ' ILE . . . . . . . . . . . . . 96.3 mt -69.6 -43.97 79.95 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.647 0 O-C-N 121.637 -0.665 . . . . 0.0 109.64 -179.887 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 91' ' ' PHE . . . . . . . . . . . . . 82.6 t80 -62.26 -44.74 95.85 Favored 'General case' 0 N--CA 1.493 1.717 0 O-C-N 121.59 -0.694 . . . . 0.0 109.354 -179.979 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 92' ' ' GLU . . . . . . . . . . . . . 81.4 tt0 -63.55 -43.12 97.99 Favored 'General case' 0 N--CA 1.489 1.507 0 N-CA-C 109.309 -0.626 . . . . 0.0 109.309 -179.576 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 93' ' ' LEU . . . . . 0.612 ' O ' HD23 ' A' ' 93' ' ' LEU . 2.8 tt -63.26 -47.26 83.14 Favored 'General case' 0 N--CA 1.489 1.498 0 CA-C-O 121.667 0.746 . . . . 0.0 109.624 -179.119 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 94' ' ' LYS . . . . . . . . . . . . . 55.2 mtpt -63.9 -44.97 91.4 Favored 'General case' 0 N--CA 1.49 1.559 0 O-C-N 121.492 -0.755 . . . . 0.0 109.792 -179.177 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 14.4 p -66.48 -39.86 89.0 Favored 'General case' 0 N--CA 1.492 1.625 0 O-C-N 121.794 -0.566 . . . . 0.0 110.037 -179.539 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 96' ' ' ARG . . . . . . . . . . . . . 16.1 tpt85 -70.77 -17.99 62.77 Favored 'General case' 0 C--N 1.3 -1.555 0 O-C-N 121.562 -0.711 . . . . 0.0 109.788 -179.484 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 97' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.491 1.604 0 O-C-N 121.624 -0.673 . . . . 0.0 109.761 -179.25 . . . . . . . . 0 0 . 1 . 007 nuclear build core ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 38.3 p30 . . . . . 0 N--CA 1.495 1.78 0 N-CA-C 108.822 -0.807 . . . . 0.0 108.822 . . . . . . . . . 0 0 . 1 . 007 nuclear build core ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 53.3 t -115.99 133.59 61.97 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.9 0 CA-C-O 121.795 0.807 . . . . 0.0 109.41 179.934 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -97.98 154.18 17.86 Favored 'General case' 0 N--CA 1.494 1.744 0 CA-C-O 121.871 0.843 . . . . 0.0 110.135 -179.47 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 33' ' ' GLU . . . . . 0.508 ' OE2' ' NE2' ' A' ' 77' ' ' HIS . 49.7 tp10 -101.58 124.21 46.87 Favored 'General case' 0 N--CA 1.492 1.645 0 CA-C-O 121.515 0.674 . . . . 0.0 109.528 -179.667 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 34' ' ' VAL . . . . . . . . . . . . . 55.7 t -124.24 131.99 72.02 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.791 0 CA-C-O 121.889 0.852 . . . . 0.0 109.689 179.774 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 38.1 t -136.11 138.78 42.41 Favored 'General case' 0 N--CA 1.492 1.637 0 CA-C-O 121.545 0.688 . . . . 0.0 109.35 179.498 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 47.2 tp -126.89 139.33 53.16 Favored 'General case' 0 N--CA 1.493 1.719 0 CA-C-O 121.795 0.807 . . . . 0.0 110.076 -179.664 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 37' ' ' PHE . . . . . . . . . . . . . 96.9 m-85 -112.36 144.77 41.23 Favored 'General case' 0 N--CA 1.496 1.828 0 CA-C-O 121.797 0.808 . . . . 0.0 109.694 179.917 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . -171.0 176.35 44.41 Favored Glycine 0 N--CA 1.489 2.226 0 N-CA-C 110.23 -1.148 . . . . 0.0 110.23 -179.909 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 1.7 m -83.55 -71.59 0.5 Allowed 'General case' 0 N--CA 1.489 1.482 0 O-C-N 121.854 -0.792 . . . . 0.0 109.751 -179.758 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 40' ' ' ASP . . . . . . . . . . . . . 37.0 t70 -98.78 159.06 15.22 Favored 'General case' 0 N--CA 1.498 1.96 0 CA-C-O 121.952 0.882 . . . . 0.0 110.65 -179.223 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 41' ' ' LYS . . . . . 0.43 ' O ' ' OE1' ' A' ' 45' ' ' GLU . 64.5 tttm -62.79 -42.26 99.63 Favored 'General case' 0 N--CA 1.491 1.587 0 CA-C-N 116.091 -0.504 . . . . 0.0 110.213 -179.971 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -49.88 -43.08 49.15 Favored 'General case' 0 N--CA 1.493 1.71 0 O-C-N 121.591 -0.693 . . . . 0.0 109.747 -178.828 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 43' ' ' HIS . . . . . . . . . . . . . 79.7 m-70 -67.47 -42.42 83.04 Favored 'General case' 0 N--CA 1.49 1.527 0 O-C-N 121.701 -0.624 . . . . 0.0 109.506 -179.933 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 81.8 mt -64.27 -44.0 93.07 Favored 'General case' 0 N--CA 1.494 1.737 0 O-C-N 121.742 -0.599 . . . . 0.0 109.792 -179.633 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 45' ' ' GLU . . . . . 0.503 ' OE1' ' N ' ' A' ' 45' ' ' GLU . 2.7 mp0 -66.7 -40.51 88.51 Favored 'General case' 0 N--CA 1.488 1.474 0 O-C-N 121.69 -0.631 . . . . 0.0 109.352 -179.799 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . -60.72 -44.73 97.59 Favored Glycine 0 N--CA 1.492 2.397 0 N-CA-C 109.699 -1.36 . . . . 0.0 109.699 -179.189 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 54.9 mtpt -71.16 -25.6 62.62 Favored 'General case' 0 N--CA 1.49 1.532 0 O-C-N 121.781 -0.835 . . . . 0.0 109.102 179.843 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 48' ' ' LEU . . . . . 0.59 HD13 ' O ' ' A' ' 48' ' ' LEU . 0.3 OUTLIER -61.52 -44.86 96.29 Favored 'General case' 0 C--N 1.303 -1.434 0 O-C-N 121.572 -0.705 . . . . 0.0 109.353 -179.102 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 49' ' ' ALA . . . . . . . . . . . . . . . -53.83 -35.85 61.9 Favored 'General case' 0 N--CA 1.493 1.721 0 O-C-N 121.442 -0.786 . . . . 0.0 109.488 -179.328 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 72.9 mm-40 -69.16 -37.28 78.13 Favored 'General case' 0 N--CA 1.491 1.597 0 N-CA-C 109.258 -0.645 . . . . 0.0 109.258 -179.983 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 4.4 m-85 -63.46 -39.37 94.28 Favored 'General case' 0 N--CA 1.496 1.859 0 O-C-N 121.669 -0.644 . . . . 0.0 109.496 -179.458 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 52' ' ' ILE . . . . . 0.581 HD12 ' CZ ' ' A' ' 64' ' ' TYR . 31.9 mm -64.07 -44.28 97.68 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.611 0 O-C-N 121.634 -0.666 . . . . 0.0 109.626 -179.424 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 66.9 m -60.55 -41.62 94.91 Favored 'General case' 0 N--CA 1.493 1.7 0 O-C-N 121.815 -0.553 . . . . 0.0 109.574 -179.696 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 54' ' ' LEU . . . . . . . . . . . . . 95.4 mt -64.04 -40.49 96.42 Favored 'General case' 0 N--CA 1.492 1.634 0 O-C-N 121.658 -0.651 . . . . 0.0 109.315 -179.926 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -57.92 -46.47 84.95 Favored 'General case' 0 N--CA 1.491 1.619 0 CA-C-O 121.148 0.499 . . . . 0.0 110.147 -178.984 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 56' ' ' LYS . . . . . 0.447 ' HZ2' HG22 ' A' ' 52' ' ' ILE . 62.7 mttp -64.59 -41.53 96.18 Favored 'General case' 0 N--CA 1.491 1.584 0 O-C-N 121.631 -0.668 . . . . 0.0 109.955 -179.742 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 88.2 mt-30 -64.66 -43.65 92.93 Favored 'General case' 0 N--CA 1.491 1.598 0 O-C-N 121.499 -0.751 . . . . 0.0 109.287 -179.726 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 58' ' ' VAL . . . . . . . . . . . . . 77.9 t -65.92 -44.54 92.47 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.619 0 O-C-N 121.742 -0.599 . . . . 0.0 109.419 -179.881 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 59' ' ' TYR . . . . . 0.404 ' O ' ' O ' ' A' ' 60' ' ' ALA . 75.8 t80 -137.47 151.56 48.6 Favored 'General case' 0 N--CA 1.496 1.861 0 CA-C-O 121.913 0.863 . . . . 0.0 110.318 -179.521 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 60' ' ' ALA . . . . . 0.538 ' O ' ' N ' ' A' ' 62' ' ' VAL . . . -59.85 -143.3 0.0 OUTLIER 'General case' 0 N--CA 1.491 1.587 0 CA-C-O 121.449 0.642 . . . . 0.0 110.693 -179.298 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 61' ' ' ASN . . . . . . . . . . . . . 99.3 m-20 -43.67 91.6 0.0 OUTLIER 'General case' 0 N--CA 1.495 1.802 0 CA-C-O 121.85 0.834 . . . . 0.0 109.879 -178.836 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 62' ' ' VAL . . . . . 0.538 ' N ' ' O ' ' A' ' 60' ' ' ALA . 13.2 p -99.42 132.58 44.58 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.503 0 CA-C-O 121.897 0.856 . . . . 0.0 110.279 -179.438 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 63' ' ' GLU . . . . . 0.533 ' OE1' ' N ' ' A' ' 63' ' ' GLU . 57.1 mp0 -105.42 136.51 44.84 Favored 'General case' 0 N--CA 1.492 1.637 0 CA-C-O 121.726 0.774 . . . . 0.0 109.44 -179.764 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 64' ' ' TYR . . . . . 0.581 ' CZ ' HD12 ' A' ' 52' ' ' ILE . 53.5 p90 -149.6 161.84 41.38 Favored 'General case' 0 N--CA 1.491 1.584 0 CA-C-O 121.778 0.799 . . . . 0.0 110.246 -179.516 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 48.7 tp10 -143.39 144.76 32.18 Favored 'General case' 0 N--CA 1.493 1.703 0 CA-C-O 121.736 0.779 . . . . 0.0 109.266 179.412 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 66' ' ' VAL . . . . . . . . . . . . . 14.7 p -121.27 129.95 75.13 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.713 0 CA-C-O 121.866 0.841 . . . . 0.0 109.893 -179.852 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 67' ' ' ALA . . . . . 0.479 ' HB1' ' HD2' ' A' ' 68' ' ' PRO . . . -77.76 159.85 75.63 Favored Pre-proline 0 N--CA 1.49 1.55 0 N-CA-C 109.398 -0.593 . . . . 0.0 109.398 -179.699 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 68' ' ' PRO . . . . . 0.479 ' HD2' ' HB1' ' A' ' 67' ' ' ALA . 17.9 Cg_endo -59.58 140.28 93.07 Favored 'Trans proline' 0 C--N 1.309 -1.545 0 C-N-CA 122.579 2.186 . . . . 0.0 112.57 179.41 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 69' ' ' VAL . . . . . . . . . . . . . 49.6 t -133.8 136.21 54.3 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.787 0 CA-C-O 121.835 0.826 . . . . 0.0 110.074 -179.723 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -76.69 165.52 24.63 Favored 'General case' 0 N--CA 1.492 1.654 0 CA-C-O 121.875 0.845 . . . . 0.0 110.504 -179.953 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 62.0 t0 -63.14 -44.45 95.51 Favored 'General case' 0 N--CA 1.489 1.487 0 CA-C-O 121.224 0.535 . . . . 0.0 109.926 -179.614 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 72' ' ' ASN . . . . . . . . . . . . . 98.5 m-20 -99.75 24.91 7.75 Favored 'General case' 0 N--CA 1.494 1.768 0 N-CA-C 109.347 -0.612 . . . . 0.0 109.347 -179.146 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 73' ' ' ALA . . . . . 0.55 ' C ' ' H ' ' A' ' 75' ' ' GLU . . . -64.47 -26.11 68.3 Favored 'General case' 0 N--CA 1.492 1.666 0 O-C-N 121.607 -0.683 . . . . 0.0 109.228 179.825 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 74' ' ' THR . . . . . 0.48 ' OG1' ' O ' ' A' ' 73' ' ' ALA . 63.0 p 53.35 4.04 0.04 OUTLIER 'General case' 0 N--CA 1.493 1.683 0 CA-C-O 121.256 0.55 . . . . 0.0 109.625 -179.347 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 75' ' ' GLU . . . . . 0.55 ' H ' ' C ' ' A' ' 73' ' ' ALA . 96.5 mt-10 -144.69 156.83 44.28 Favored 'General case' 0 N--CA 1.491 1.605 0 CA-C-O 121.975 0.893 . . . . 0.0 110.135 179.85 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 4.1 tt -141.24 141.09 34.03 Favored 'General case' 0 C--N 1.304 -1.405 0 CA-C-O 121.622 0.725 . . . . 0.0 109.857 -179.907 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 77' ' ' HIS . . . . . 0.508 ' NE2' ' OE2' ' A' ' 33' ' ' GLU . 63.1 t-80 -120.38 128.48 53.26 Favored 'General case' 0 N--CA 1.494 1.735 0 CA-C-O 121.928 0.87 . . . . 0.0 109.763 -179.978 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -150.16 155.21 39.37 Favored 'General case' 0 N--CA 1.49 1.536 0 CA-C-O 121.688 0.756 . . . . 0.0 109.696 179.937 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 33.2 ptt-85 -135.03 153.16 52.16 Favored 'General case' 0 N--CA 1.495 1.778 0 CA-C-O 121.814 0.816 . . . . 0.0 109.845 -179.778 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 80' ' ' PHE . . . . . . . . . . . . . 45.5 m-85 -133.16 153.38 51.58 Favored 'General case' 0 N--CA 1.495 1.821 0 CA-C-O 121.694 0.759 . . . . 0.0 110.175 -179.265 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 64.2 tttm -107.4 125.66 51.5 Favored 'General case' 0 N--CA 1.496 1.841 0 CA-C-O 121.595 0.712 . . . . 0.0 109.366 179.968 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 82' ' ' PHE . . . . . . . . . . . . . 63.1 m-85 -123.21 146.51 47.76 Favored 'General case' 0 N--CA 1.495 1.821 0 CA-C-O 121.615 0.721 . . . . 0.0 109.936 -179.896 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 81.3 tt0 -69.04 -37.88 78.83 Favored 'General case' 0 N--CA 1.491 1.595 0 N-CA-C 109.222 -0.658 . . . . 0.0 109.222 -179.579 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 84' ' ' VAL . . . . . . . . . . . . . 35.1 m -135.79 159.11 39.72 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.926 0 CA-C-O 121.889 0.852 . . . . 0.0 109.984 -179.933 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 85' ' ' SER . . . . . 0.481 ' O ' ' N ' ' A' ' 88' ' ' LYS . 11.2 t -63.62 -42.61 98.19 Favored 'General case' 0 N--CA 1.49 1.563 0 CA-C-O 121.193 0.521 . . . . 0.0 110.08 -179.775 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 86' ' ' ALA . . . . . . . . . . . . . . . -41.23 -40.95 1.73 Allowed 'General case' 0 N--CA 1.494 1.752 0 CA-C-O 121.278 0.561 . . . . 0.0 110.07 -178.976 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 96.6 mt-10 -67.52 -33.17 74.53 Favored 'General case' 0 N--CA 1.491 1.577 0 O-C-N 121.677 -0.64 . . . . 0.0 109.64 -179.829 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 88' ' ' LYS . . . . . 0.481 ' N ' ' O ' ' A' ' 85' ' ' SER . 64.4 tttm -62.37 -45.61 92.38 Favored 'General case' 0 N--CA 1.493 1.677 0 O-C-N 121.645 -0.659 . . . . 0.0 109.673 -179.627 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 89' ' ' LEU . . . . . 0.494 HD22 ' N ' ' A' ' 89' ' ' LEU . 3.8 mm? -64.3 -42.05 96.56 Favored 'General case' 0 N--CA 1.492 1.633 0 O-C-N 121.519 -0.738 . . . . 0.0 109.796 -179.447 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 90' ' ' ILE . . . . . . . . . . . . . 95.3 mt -65.99 -44.23 92.36 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.669 0 CA-C-O 121.325 0.583 . . . . 0.0 109.934 -179.398 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 91' ' ' PHE . . . . . . . . . . . . . 71.3 t80 -61.97 -45.58 93.01 Favored 'General case' 0 N--CA 1.493 1.707 0 O-C-N 121.689 -0.632 . . . . 0.0 109.993 -179.18 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 92' ' ' GLU . . . . . 0.555 ' N ' ' OE1' ' A' ' 92' ' ' GLU . 1.9 mp0 -64.8 -37.98 89.44 Favored 'General case' 0 N--CA 1.491 1.592 0 O-C-N 121.555 -0.716 . . . . 0.0 110.175 -178.976 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 93' ' ' LEU . . . . . . . . . . . . . 5.1 tt -62.11 -45.17 94.66 Favored 'General case' 0 C--N 1.299 -1.599 0 O-C-N 121.472 -0.767 . . . . 0.0 109.958 -178.845 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 94' ' ' LYS . . . . . . . . . . . . . 98.8 mttt -66.14 -43.13 87.95 Favored 'General case' 0 N--CA 1.493 1.694 0 O-C-N 121.826 -0.546 . . . . 0.0 110.045 -179.508 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 21.2 p -67.94 -38.08 82.41 Favored 'General case' 0 N--CA 1.493 1.708 0 O-C-N 121.557 -0.714 . . . . 0.0 109.629 -179.217 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 96' ' ' ARG . . . . . . . . . . . . . 73.6 mmt-85 -64.47 -40.86 96.49 Favored 'General case' 0 C--N 1.301 -1.502 0 O-C-N 121.592 -0.692 . . . . 0.0 109.639 -179.891 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 97' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.302 -1.472 0 N-CA-C 108.994 -0.743 . . . . 0.0 108.994 -179.93 . . . . . . . . 0 0 . 1 . 008 nuclear build core ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 34.8 t0 . . . . . 0 N--CA 1.491 1.608 0 CA-C-O 121.505 0.669 . . . . 0.0 109.513 . . . . . . . . . 0 0 . 1 . 008 nuclear build core ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 53.6 t -117.79 133.93 63.01 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.802 0 CA-C-O 121.854 0.835 . . . . 0.0 109.276 179.989 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 32' ' ' ALA . . . . . 0.703 ' HB1' ' HZ2' ' A' ' 88' ' ' LYS . . . -99.22 151.67 20.76 Favored 'General case' 0 N--CA 1.49 1.528 0 CA-C-O 121.698 0.761 . . . . 0.0 109.838 -179.637 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 33' ' ' GLU . . . . . 0.543 ' N ' ' OE1' ' A' ' 33' ' ' GLU . 57.4 mp0 -110.17 120.04 41.2 Favored 'General case' 0 N--CA 1.492 1.675 0 CA-C-O 121.619 0.723 . . . . 0.0 109.442 -179.853 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 34' ' ' VAL . . . . . . . . . . . . . 55.0 t -125.42 133.8 68.37 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.73 0 CA-C-O 121.88 0.848 . . . . 0.0 109.605 179.996 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 15.6 m -153.87 138.94 17.33 Favored 'General case' 0 N--CA 1.49 1.532 0 CA-C-O 121.768 0.794 . . . . 0.0 109.425 179.412 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 36' ' ' LEU . . . . . 0.452 HD12 ' N ' ' A' ' 36' ' ' LEU . 8.2 mp -107.73 152.95 23.65 Favored 'General case' 0 N--CA 1.495 1.797 0 CA-C-O 121.823 0.821 . . . . 0.0 109.833 -179.628 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 37' ' ' PHE . . . . . . . . . . . . . 91.8 m-85 -127.67 149.14 50.34 Favored 'General case' 0 N--CA 1.491 1.58 0 CA-C-O 121.929 0.871 . . . . 0.0 109.962 -179.518 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 38' ' ' GLY . . . . . 0.426 ' O ' ' O ' ' A' ' 39' ' ' SER . . . 84.63 178.17 51.23 Favored Glycine 0 N--CA 1.487 2.084 0 N-CA-C 110.396 -1.082 . . . . 0.0 110.396 179.442 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 39' ' ' SER . . . . . 0.524 ' HG ' ' CG ' ' A' ' 43' ' ' HIS . 0.3 OUTLIER 55.66 159.78 0.01 OUTLIER 'General case' 0 N--CA 1.488 1.467 0 CA-C-O 121.659 0.743 . . . . 0.0 110.483 179.819 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 40' ' ' ASP . . . . . . . . . . . . . 54.9 p-10 -79.94 174.26 11.77 Favored 'General case' 0 N--CA 1.489 1.492 0 CA-C-O 121.906 0.86 . . . . 0.0 110.785 -179.11 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 41' ' ' LYS . . . . . 0.424 ' O ' ' OE1' ' A' ' 45' ' ' GLU . 21.1 tptm -59.48 -45.54 91.36 Favored 'General case' 0 C--N 1.306 -1.306 0 CA-C-N 116.022 -0.536 . . . . 0.0 110.105 -179.362 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -57.65 -47.32 82.6 Favored 'General case' 0 N--CA 1.492 1.645 0 O-C-N 121.735 -0.603 . . . . 0.0 109.886 -178.828 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 43' ' ' HIS . . . . . 0.524 ' CG ' ' HG ' ' A' ' 39' ' ' SER . 58.7 t-80 -68.33 -35.77 78.26 Favored 'General case' 0 N--CA 1.49 1.572 0 O-C-N 121.628 -0.67 . . . . 0.0 109.683 -179.736 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 13.9 mt -61.94 -42.53 99.21 Favored 'General case' 0 N--CA 1.492 1.67 0 O-C-N 121.625 -0.672 . . . . 0.0 109.386 -179.013 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 45' ' ' GLU . . . . . 0.512 ' OE1' ' N ' ' A' ' 45' ' ' GLU . 1.2 mp0 -63.32 -46.57 86.06 Favored 'General case' 0 N--CA 1.485 1.323 0 O-C-N 121.681 -0.637 . . . . 0.0 109.389 -179.587 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . -61.81 -44.22 98.17 Favored Glycine 0 N--CA 1.49 2.279 0 N-CA-C 109.044 -1.622 . . . . 0.0 109.044 -179.602 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 41.3 tptt -67.22 -35.41 79.54 Favored 'General case' 0 N--CA 1.485 1.315 0 O-C-N 121.834 -0.804 . . . . 0.0 109.039 179.887 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 27.1 tp -58.17 -29.99 66.05 Favored 'General case' 0 N--CA 1.492 1.638 0 N-CA-C 108.805 -0.813 . . . . 0.0 108.805 -179.394 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 49' ' ' ALA . . . . . . . . . . . . . . . -49.62 -27.93 5.18 Favored 'General case' 0 N--CA 1.492 1.651 0 CA-C-O 121.154 0.502 . . . . 0.0 109.988 -179.33 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 50' ' ' GLU . . . . . 0.507 ' CG ' ' N ' ' A' ' 51' ' ' TYR . 16.4 pt-20 -69.41 -42.36 75.15 Favored 'General case' 0 N--CA 1.489 1.514 0 CA-C-O 121.647 0.737 . . . . 0.0 109.281 -179.875 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 51' ' ' TYR . . . . . 0.507 ' N ' ' CG ' ' A' ' 50' ' ' GLU . 22.4 m-85 -60.91 -48.89 79.75 Favored 'General case' 0 N--CA 1.488 1.468 0 O-C-N 121.733 -0.605 . . . . 0.0 109.787 -178.638 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 52' ' ' ILE . . . . . . . . . . . . . 94.6 mt -66.5 -43.39 90.87 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.637 0 CA-C-O 121.201 0.525 . . . . 0.0 109.817 -179.479 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 68.3 m -59.78 -58.18 9.67 Favored 'General case' 0 N--CA 1.493 1.714 0 O-C-N 121.762 -0.587 . . . . 0.0 110.047 -178.567 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 54' ' ' LEU . . . . . 0.427 ' N ' HD22 ' A' ' 54' ' ' LEU . 4.1 mm? -64.03 -40.84 97.21 Favored 'General case' 0 C--N 1.301 -1.512 0 O-C-N 121.717 -0.614 . . . . 0.0 109.943 -179.724 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -60.05 -43.07 95.62 Favored 'General case' 0 N--CA 1.489 1.523 0 N-CA-C 109.508 -0.553 . . . . 0.0 109.508 -179.126 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 56' ' ' LYS . . . . . . . . . . . . . 65.8 tttm -65.36 -43.4 90.93 Favored 'General case' 0 C--N 1.307 -1.276 0 O-C-N 121.713 -0.617 . . . . 0.0 109.534 -179.981 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 87.7 mt-30 -65.21 -44.24 88.99 Favored 'General case' 0 N--CA 1.491 1.62 0 O-C-N 121.841 -0.537 . . . . 0.0 109.693 -179.393 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 58' ' ' VAL . . . . . . . . . . . . . 77.3 t -64.47 -44.8 97.0 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.536 0 N-CA-C 109.143 -0.688 . . . . 0.0 109.143 -179.667 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 59' ' ' TYR . . . . . 0.434 ' CE1' ' O ' ' A' ' 60' ' ' ALA . 54.5 t80 -130.58 120.25 23.74 Favored 'General case' 0 N--CA 1.495 1.806 0 CA-C-O 121.829 0.823 . . . . 0.0 109.727 -179.874 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 60' ' ' ALA . . . . . 0.434 ' O ' ' CE1' ' A' ' 59' ' ' TYR . . . -69.2 145.71 52.98 Favored 'General case' 0 N--CA 1.489 1.487 0 CA-C-O 121.623 0.725 . . . . 0.0 110.55 -179.771 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 61' ' ' ASN . . . . . . . . . . . . . 32.2 t-20 57.82 42.24 23.62 Favored 'General case' 0 N--CA 1.494 1.765 0 CA-C-O 121.325 0.583 . . . . 0.0 109.745 179.643 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 62' ' ' VAL . . . . . . . . . . . . . 12.6 p -68.87 137.85 23.52 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.628 0 CA-C-O 121.551 0.691 . . . . 0.0 110.179 179.959 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 63' ' ' GLU . . . . . 0.541 ' OE1' ' N ' ' A' ' 63' ' ' GLU . 57.1 mp0 -112.06 137.71 49.71 Favored 'General case' 0 N--CA 1.494 1.769 0 CA-C-O 121.81 0.814 . . . . 0.0 109.587 -179.752 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 64' ' ' TYR . . . . . . . . . . . . . 55.5 p90 -155.8 164.84 38.03 Favored 'General case' 0 N--CA 1.487 1.417 0 CA-C-O 121.931 0.872 . . . . 0.0 110.413 -179.693 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 83.0 tt0 -142.5 153.69 43.84 Favored 'General case' 0 N--CA 1.491 1.622 0 CA-C-O 121.56 0.695 . . . . 0.0 109.318 179.832 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 66' ' ' VAL . . . . . . . . . . . . . 2.9 p -123.53 132.32 71.58 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.794 0 CA-C-O 122.085 0.945 . . . . 0.0 109.887 -179.744 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 67' ' ' ALA . . . . . 0.481 ' HB1' ' HD2' ' A' ' 68' ' ' PRO . . . -85.89 160.23 53.05 Favored Pre-proline 0 N--CA 1.491 1.585 0 N-CA-C 109.221 -0.659 . . . . 0.0 109.221 179.945 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 68' ' ' PRO . . . . . 0.481 ' HD2' ' HB1' ' A' ' 67' ' ' ALA . 28.4 Cg_endo -59.83 134.67 58.56 Favored 'Trans proline' 0 C--N 1.307 -1.631 0 C-N-CA 122.728 2.286 . . . . 0.0 112.593 179.666 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 69' ' ' VAL . . . . . . . . . . . . . 99.5 t -138.63 139.15 41.67 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.8 0 CA-C-O 121.766 0.793 . . . . 0.0 110.442 179.82 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -67.08 154.64 40.7 Favored 'General case' 0 N--CA 1.488 1.47 0 CA-C-O 121.794 0.807 . . . . 0.0 110.018 179.787 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 71' ' ' ASP . . . . . 0.545 ' OD1' ' N ' ' A' ' 72' ' ' ASN . 42.3 p-10 -63.92 -34.44 77.96 Favored 'General case' 0 C--N 1.302 -1.465 0 CA-C-O 121.424 0.631 . . . . 0.0 109.45 -179.597 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 72' ' ' ASN . . . . . 0.545 ' N ' ' OD1' ' A' ' 71' ' ' ASP . 87.6 m-20 -104.28 28.32 6.97 Favored 'General case' 0 N--CA 1.494 1.773 0 N-CA-C 109.114 -0.699 . . . . 0.0 109.114 -179.474 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 73' ' ' ALA . . . . . 0.445 ' C ' ' H ' ' A' ' 75' ' ' GLU . . . -70.43 -11.54 60.99 Favored 'General case' 0 N--CA 1.493 1.695 0 N-CA-C 109.135 -0.691 . . . . 0.0 109.135 -179.88 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 74' ' ' THR . . . . . . . . . . . . . 47.5 p 52.4 10.31 0.13 Allowed 'General case' 0 N--CA 1.493 1.697 0 CA-C-O 121.27 0.557 . . . . 0.0 109.513 179.854 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 75' ' ' GLU . . . . . 0.445 ' H ' ' C ' ' A' ' 73' ' ' ALA . 15.3 pt-20 -153.01 179.91 8.26 Favored 'General case' 0 N--CA 1.49 1.571 0 CA-C-O 121.806 0.812 . . . . 0.0 110.095 179.834 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 7.3 tp -146.06 133.48 20.75 Favored 'General case' 0 C--N 1.303 -1.422 0 CA-C-O 121.708 0.766 . . . . 0.0 109.988 179.878 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 77' ' ' HIS . . . . . . . . . . . . . 97.8 m-70 -116.53 118.32 32.32 Favored 'General case' 0 N--CA 1.493 1.717 0 CA-C-O 121.854 0.835 . . . . 0.0 109.438 179.533 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -151.25 161.53 42.54 Favored 'General case' 0 N--CA 1.49 1.547 0 CA-C-O 121.657 0.742 . . . . 0.0 109.871 -179.885 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 81.0 mtp85 -130.31 150.61 51.47 Favored 'General case' 0 N--CA 1.495 1.789 0 CA-C-O 121.695 0.759 . . . . 0.0 109.803 -179.631 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 80' ' ' PHE . . . . . . . . . . . . . 28.9 m-85 -126.17 150.77 48.07 Favored 'General case' 0 N--CA 1.496 1.847 0 CA-C-O 121.574 0.702 . . . . 0.0 109.852 -179.711 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 88.4 tttt -113.66 126.8 55.66 Favored 'General case' 0 N--CA 1.494 1.755 0 CA-C-O 121.738 0.78 . . . . 0.0 109.593 -179.835 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 82' ' ' PHE . . . . . 0.524 ' CG ' ' OE2' ' A' ' 87' ' ' GLU . 73.0 m-85 -125.41 148.77 48.67 Favored 'General case' 0 N--CA 1.495 1.813 0 CA-C-O 121.796 0.808 . . . . 0.0 109.996 179.907 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 45.6 tp10 -70.51 -33.75 71.54 Favored 'General case' 0 N--CA 1.488 1.462 0 N-CA-C 109.346 -0.613 . . . . 0.0 109.346 -179.586 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 84' ' ' VAL . . . . . . . . . . . . . 33.1 m -131.68 162.52 39.33 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.936 0 CA-C-O 121.965 0.888 . . . . 0.0 110.411 -179.12 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 69.3 m -88.25 -15.65 35.29 Favored 'General case' 0 N--CA 1.492 1.672 0 N-CA-C 109.578 -0.527 . . . . 0.0 109.578 -179.643 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 86' ' ' ALA . . . . . . . . . . . . . . . -60.11 -46.23 90.3 Favored 'General case' 0 N--CA 1.492 1.642 0 O-C-N 121.444 -0.785 . . . . 0.0 109.475 -179.234 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 87' ' ' GLU . . . . . 0.524 ' OE2' ' CG ' ' A' ' 82' ' ' PHE . 2.9 pp20? -67.33 -30.68 70.58 Favored 'General case' 0 N--CA 1.488 1.45 0 O-C-N 121.738 -0.601 . . . . 0.0 109.411 -179.715 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 88' ' ' LYS . . . . . 0.703 ' HZ2' ' HB1' ' A' ' 32' ' ' ALA . 56.8 tttp -62.79 -45.54 92.17 Favored 'General case' 0 N--CA 1.491 1.582 0 O-C-N 121.73 -0.606 . . . . 0.0 109.379 -179.58 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 96.0 mt -62.89 -50.46 70.79 Favored 'General case' 0 N--CA 1.492 1.641 0 O-C-N 121.852 -0.53 . . . . 0.0 110.025 -179.036 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 90' ' ' ILE . . . . . . . . . . . . . 93.5 mt -69.77 -43.79 79.63 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.591 0 O-C-N 121.731 -0.605 . . . . 0.0 110.013 -179.971 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 91' ' ' PHE . . . . . 0.462 ' O ' HG23 ' A' ' 95' ' ' THR . 74.6 t80 -62.6 -45.81 91.15 Favored 'General case' 0 N--CA 1.491 1.614 0 O-C-N 121.57 -0.707 . . . . 0.0 109.799 -179.052 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 92' ' ' GLU . . . . . 0.54 ' CG ' ' NH1' ' A' ' 96' ' ' ARG . 82.1 tt0 -66.12 -40.65 90.83 Favored 'General case' 0 N--CA 1.491 1.599 0 O-C-N 121.662 -0.649 . . . . 0.0 109.332 -179.64 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 93' ' ' LEU . . . . . . . . . . . . . 4.7 tp -65.45 -43.35 90.63 Favored 'General case' 0 N--CA 1.489 1.495 0 O-C-N 121.584 -0.697 . . . . 0.0 109.749 -179.868 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 94' ' ' LYS . . . . . . . . . . . . . 6.9 ttpm? -68.58 -36.61 78.98 Favored 'General case' 0 N--CA 1.491 1.62 0 CA-C-O 121.24 0.543 . . . . 0.0 110.099 -179.073 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 95' ' ' THR . . . . . 0.462 HG23 ' O ' ' A' ' 91' ' ' PHE . 7.0 p -62.02 -50.5 71.8 Favored 'General case' 0 N--CA 1.491 1.606 0 O-C-N 121.64 -0.663 . . . . 0.0 109.824 -178.802 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 96' ' ' ARG . . . . . 0.54 ' NH1' ' CG ' ' A' ' 92' ' ' GLU . 72.5 mtt85 -64.62 -39.61 94.02 Favored 'General case' 0 N--CA 1.488 1.449 0 N-CA-C 108.864 -0.791 . . . . 0.0 108.864 179.39 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 97' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.488 1.444 0 N-CA-C 108.995 -0.743 . . . . 0.0 108.995 179.995 . . . . . . . . 0 0 . 1 . 009 nuclear build core ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 90.1 m-20 . . . . . 0 N--CA 1.489 1.481 0 N-CA-C 108.414 -0.958 . . . . 0.0 108.414 . . . . . . . . . 0 0 . 1 . 009 nuclear build core ' A' A ' 31' ' ' VAL . . . . . 0.611 HG11 HH21 ' A' ' 79' ' ' ARG . 52.2 t -126.64 135.38 63.9 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.9 0 N-CA-C 109.109 -0.7 . . . . 0.0 109.109 179.827 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -112.25 155.83 23.39 Favored 'General case' 0 N--CA 1.495 1.777 0 CA-C-O 121.629 0.728 . . . . 0.0 109.906 -179.378 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 83.6 tt0 -107.07 123.05 47.66 Favored 'General case' 0 N--CA 1.494 1.757 0 O-C-N 121.647 -0.658 . . . . 0.0 109.614 -179.578 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 34' ' ' VAL . . . . . . . . . . . . . 55.0 t -127.51 132.92 68.81 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.727 0 CA-C-O 121.681 0.753 . . . . 0.0 109.436 179.757 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 37.3 t -148.71 141.0 24.11 Favored 'General case' 0 N--CA 1.49 1.529 0 N-CA-C 109.143 -0.688 . . . . 0.0 109.143 179.61 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 4.9 mp -130.74 151.12 51.52 Favored 'General case' 0 N--CA 1.494 1.766 0 CA-C-O 121.76 0.79 . . . . 0.0 109.928 -179.683 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 37' ' ' PHE . . . . . . . . . . . . . 32.4 p90 -143.69 159.73 41.95 Favored 'General case' 0 C--N 1.301 -1.501 0 CA-C-O 121.551 0.691 . . . . 0.0 109.656 -179.733 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . 114.33 152.96 10.66 Favored Glycine 0 N--CA 1.493 2.475 0 N-CA-C 110.263 -1.135 . . . . 0.0 110.263 179.6 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 39' ' ' SER . . . . . 0.561 ' OG ' ' N ' ' A' ' 40' ' ' ASP . 16.8 t 52.59 -169.24 0.04 OUTLIER 'General case' 0 N--CA 1.491 1.598 0 CA-C-O 122.019 0.914 . . . . 0.0 110.883 179.622 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 40' ' ' ASP . . . . . 0.561 ' N ' ' OG ' ' A' ' 39' ' ' SER . 54.5 p-10 -85.42 178.48 7.43 Favored 'General case' 0 C--N 1.306 -1.318 0 CA-C-O 121.654 0.74 . . . . 0.0 110.178 -179.606 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 88.5 tttt -62.35 -39.0 91.69 Favored 'General case' 0 N--CA 1.49 1.559 0 CA-C-O 121.393 0.616 . . . . 0.0 110.32 -179.577 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -53.31 -41.91 66.13 Favored 'General case' 0 N--CA 1.493 1.714 0 O-C-N 121.286 -0.884 . . . . 0.0 109.825 -179.437 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 43' ' ' HIS . . . . . . . . . . . . . 86.5 t60 -66.76 -41.25 88.05 Favored 'General case' 0 N--CA 1.493 1.712 0 O-C-N 121.242 -0.911 . . . . 0.0 109.488 179.513 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 96.7 mt -63.18 -40.07 96.47 Favored 'General case' 0 N--CA 1.495 1.78 0 O-C-N 121.327 -0.858 . . . . 0.0 109.216 -180.0 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 97.1 mt-10 -61.23 -39.41 90.2 Favored 'General case' 0 N--CA 1.493 1.714 0 O-C-N 121.439 -0.788 . . . . 0.0 109.724 -179.921 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . -60.43 -49.12 82.06 Favored Glycine 0 N--CA 1.492 2.394 0 N-CA-C 109.814 -1.314 . . . . 0.0 109.814 179.96 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 52.1 mtpt -65.9 -37.91 87.35 Favored 'General case' 0 C--N 1.301 -1.526 0 O-C-N 121.429 -1.042 . . . . 0.0 109.565 179.62 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 48' ' ' LEU . . . . . 0.558 HD13 ' O ' ' A' ' 48' ' ' LEU . 0.2 OUTLIER -62.58 -44.39 96.44 Favored 'General case' 0 C--N 1.302 -1.486 0 O-C-N 121.324 -0.86 . . . . 0.0 109.596 -178.805 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 49' ' ' ALA . . . . . . . . . . . . . . . -62.23 -41.76 98.69 Favored 'General case' 0 C--N 1.299 -1.601 0 O-C-N 121.069 -1.019 . . . . 0.0 109.471 -179.617 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 77.1 tt0 -69.47 -36.83 76.93 Favored 'General case' 0 C--N 1.306 -1.316 0 O-C-N 121.419 -0.8 . . . . 0.0 109.199 179.718 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 3.1 m-85 -61.98 -43.49 98.73 Favored 'General case' 0 N--CA 1.496 1.828 0 O-C-N 121.579 -0.701 . . . . 0.0 109.361 -179.996 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 52' ' ' ILE . . . . . 0.407 HD13 ' CZ ' ' A' ' 64' ' ' TYR . 76.7 mt -63.66 -43.19 98.02 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.606 0 O-C-N 121.539 -0.726 . . . . 0.0 109.726 -179.883 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 78.1 p -61.13 -41.71 97.21 Favored 'General case' 0 N--CA 1.493 1.687 0 O-C-N 121.423 -0.798 . . . . 0.0 110.19 -179.253 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 54' ' ' LEU . . . . . . . . . . . . . 93.6 mt -64.98 -42.48 94.51 Favored 'General case' 0 N--CA 1.494 1.737 0 O-C-N 121.264 -0.897 . . . . 0.0 109.4 179.822 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 55' ' ' ALA . . . . . 0.408 ' HB2' ' CE1' ' A' ' 91' ' ' PHE . . . -67.07 -37.06 83.34 Favored 'General case' 0 N--CA 1.491 1.596 0 O-C-N 121.504 -0.748 . . . . 0.0 109.568 179.799 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 56' ' ' LYS . . . . . . . . . . . . . 56.4 tttp -63.27 -43.97 96.43 Favored 'General case' 0 N--CA 1.487 1.377 0 O-C-N 121.491 -0.756 . . . . 0.0 109.568 -179.718 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 77.5 mt-30 -66.13 -44.4 84.35 Favored 'General case' 0 N--CA 1.493 1.687 0 O-C-N 121.324 -0.86 . . . . 0.0 109.433 179.898 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 58' ' ' VAL . . . . . . . . . . . . . 72.3 t -65.18 -45.09 94.98 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.554 0 O-C-N 121.498 -0.751 . . . . 0.0 109.47 179.627 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 59' ' ' TYR . . . . . . . . . . . . . 87.1 t80 -125.05 127.45 46.96 Favored 'General case' 0 N--CA 1.497 1.901 0 CA-C-O 121.748 0.785 . . . . 0.0 109.666 -179.653 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -66.17 148.74 51.38 Favored 'General case' 0 N--CA 1.49 1.554 0 CA-C-O 121.829 0.824 . . . . 0.0 110.848 -179.182 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 61' ' ' ASN . . . . . . . . . . . . . 6.3 p-10 42.93 66.72 0.73 Allowed 'General case' 0 N--CA 1.493 1.71 0 CA-C-O 121.844 0.83 . . . . 0.0 109.966 179.904 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 62' ' ' VAL . . . . . . . . . . . . . 11.7 p -85.55 136.29 23.14 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.616 0 O-C-N 121.549 -0.719 . . . . 0.0 109.794 179.824 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 96.1 mt-10 -111.97 145.24 39.95 Favored 'General case' 0 N--CA 1.496 1.872 0 CA-C-O 121.734 0.778 . . . . 0.0 109.971 -179.517 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 64' ' ' TYR . . . . . 0.407 ' CZ ' HD13 ' A' ' 52' ' ' ILE . 46.9 p90 -149.52 161.54 41.93 Favored 'General case' 0 N--CA 1.49 1.552 0 CA-C-O 121.798 0.809 . . . . 0.0 110.212 -179.424 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 78.4 mm-40 -141.19 146.18 36.6 Favored 'General case' 0 N--CA 1.494 1.734 0 N-CA-C 109.034 -0.728 . . . . 0.0 109.034 179.851 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 66' ' ' VAL . . . . . . . . . . . . . 8.8 p -127.2 131.45 70.64 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.967 0 CA-C-O 121.608 0.718 . . . . 0.0 110.184 -179.744 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 67' ' ' ALA . . . . . 0.462 ' HB1' ' HD2' ' A' ' 68' ' ' PRO . . . -78.95 167.18 36.95 Favored Pre-proline 0 C--N 1.305 -1.356 0 N-CA-C 109.155 -0.683 . . . . 0.0 109.155 -179.95 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 68' ' ' PRO . . . . . 0.462 ' HD2' ' HB1' ' A' ' 67' ' ' ALA . 53.0 Cg_exo -52.27 127.49 23.96 Favored 'Trans proline' 0 N--CA 1.495 1.57 0 C-N-CA 122.383 2.055 . . . . 0.0 112.905 179.573 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 69' ' ' VAL . . . . . . . . . . . . . 70.9 t -132.5 133.27 59.9 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.845 0 O-C-N 121.541 -0.724 . . . . 0.0 109.621 179.482 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -82.04 157.86 24.0 Favored 'General case' 0 C--N 1.302 -1.495 0 O-C-N 121.607 -0.683 . . . . 0.0 109.951 179.637 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 43.4 t0 -64.01 -37.98 89.42 Favored 'General case' 0 N--CA 1.493 1.696 0 CA-C-O 121.606 0.717 . . . . 0.0 109.697 179.552 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 72' ' ' ASN . . . . . . . . . . . . . 90.4 m-20 -92.45 12.9 21.24 Favored 'General case' 0 N--CA 1.494 1.743 0 O-C-N 121.422 -0.799 . . . . 0.0 109.467 -179.567 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -64.25 146.51 54.22 Favored 'General case' 0 N--CA 1.496 1.83 0 O-C-N 121.19 -0.944 . . . . 0.0 110.406 -179.551 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 74' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -101.08 -4.35 27.53 Favored 'General case' 0 N--CA 1.494 1.748 0 O-C-N 121.515 -0.741 . . . . 0.0 109.69 179.819 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 82.9 tt0 -144.13 148.02 34.5 Favored 'General case' 0 N--CA 1.497 1.91 0 O-C-N 120.901 -1.125 . . . . 0.0 109.748 179.898 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 3.5 tt -126.17 135.31 51.49 Favored 'General case' 0 N--CA 1.49 1.573 0 CA-C-O 121.502 0.668 . . . . 0.0 109.549 -179.925 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 77' ' ' HIS . . . . . . . . . . . . . 99.1 m-70 -107.78 129.63 55.04 Favored 'General case' 0 N--CA 1.494 1.727 0 CA-C-O 121.578 0.704 . . . . 0.0 109.705 -179.519 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -148.03 153.99 39.67 Favored 'General case' 0 N--CA 1.49 1.529 0 O-C-N 121.587 -0.696 . . . . 0.0 109.438 -179.866 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 79' ' ' ARG . . . . . 0.611 HH21 HG11 ' A' ' 31' ' ' VAL . 79.7 mtp85 -132.74 149.36 52.29 Favored 'General case' 0 N--CA 1.494 1.726 0 CA-C-O 121.393 0.616 . . . . 0.0 109.387 -179.817 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 80' ' ' PHE . . . . . . . . . . . . . 61.8 m-85 -127.53 150.63 49.6 Favored 'General case' 0 N--CA 1.495 1.802 0 CA-C-O 121.536 0.684 . . . . 0.0 109.455 -179.872 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 53.7 tttp -110.5 112.85 25.05 Favored 'General case' 0 N--CA 1.493 1.678 0 CA-C-O 121.569 0.7 . . . . 0.0 109.35 179.874 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 82' ' ' PHE . . . . . . . . . . . . . 59.1 m-85 -111.24 145.22 39.12 Favored 'General case' 0 N--CA 1.495 1.788 0 CA-C-O 121.598 0.713 . . . . 0.0 109.71 179.915 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 46.2 tp10 -66.46 -38.65 87.81 Favored 'General case' 0 C--N 1.301 -1.505 0 O-C-N 121.692 -0.63 . . . . 0.0 109.904 -179.818 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 84' ' ' VAL . . . . . 0.431 ' CG2' ' OE2' ' A' ' 87' ' ' GLU . 16.6 m -136.17 161.24 37.88 Favored 'Isoleucine or valine' 0 N--CA 1.499 1.994 0 O-C-N 121.322 -0.861 . . . . 0.0 110.52 -179.421 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 33.9 m -70.57 -16.54 62.87 Favored 'General case' 0 N--CA 1.49 1.556 0 CA-C-O 121.367 0.604 . . . . 0.0 109.883 -179.902 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 86' ' ' ALA . . . . . . . . . . . . . . . -60.78 -42.37 97.38 Favored 'General case' 0 N--CA 1.493 1.724 0 O-C-N 121.188 -0.945 . . . . 0.0 109.567 -179.876 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 87' ' ' GLU . . . . . 0.551 ' N ' ' OE1' ' A' ' 87' ' ' GLU . 0.4 OUTLIER -70.36 -34.06 72.16 Favored 'General case' 0 N--CA 1.491 1.605 0 O-C-N 121.33 -0.856 . . . . 0.0 109.224 179.858 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 88' ' ' LYS . . . . . . . . . . . . . 88.5 tttt -61.79 -47.07 86.79 Favored 'General case' 0 N--CA 1.49 1.53 0 O-C-N 121.293 -0.88 . . . . 0.0 109.77 -179.921 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 56.6 tp -63.38 -45.77 89.57 Favored 'General case' 0 N--CA 1.489 1.515 0 O-C-N 121.288 -0.883 . . . . 0.0 109.715 -179.489 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 90' ' ' ILE . . . . . . . . . . . . . 96.5 mt -66.04 -44.54 92.03 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.611 0 O-C-N 121.508 -0.745 . . . . 0.0 109.839 -179.832 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 91' ' ' PHE . . . . . 0.408 ' CE1' ' HB2' ' A' ' 55' ' ' ALA . 54.1 t80 -62.98 -43.95 97.38 Favored 'General case' 0 N--CA 1.492 1.629 0 CA-C-O 121.64 0.733 . . . . 0.0 109.799 -179.636 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 92' ' ' GLU . . . . . . . . . . . . . 40.6 tp10 -56.28 -58.98 5.66 Favored 'General case' 0 N--CA 1.493 1.682 0 O-C-N 121.461 -0.775 . . . . 0.0 110.444 -178.897 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 93' ' ' LEU . . . . . 0.476 ' N ' HD12 ' A' ' 93' ' ' LEU . 10.8 mp -64.53 -39.27 93.46 Favored 'General case' 0 N--CA 1.495 1.778 0 O-C-N 121.266 -0.896 . . . . 0.0 110.553 -179.444 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 94' ' ' LYS . . . . . . . . . . . . . 38.6 ttmt -61.73 -46.96 87.41 Favored 'General case' 0 N--CA 1.493 1.719 0 O-C-N 120.997 -1.064 . . . . 0.0 110.639 -178.764 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 21.0 p -69.0 -40.6 78.61 Favored 'General case' 0 N--CA 1.493 1.719 0 O-C-N 120.887 -1.133 . . . . 0.0 109.686 -179.667 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 96' ' ' ARG . . . . . . . . . . . . . 82.6 mtp180 -64.89 -40.61 95.37 Favored 'General case' 0 N--CA 1.491 1.603 0 O-C-N 121.395 -0.816 . . . . 0.0 109.337 179.52 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 97' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 1.559 0 O-C-N 121.448 -0.783 . . . . 0.0 109.518 179.907 . . . . . . . . 0 0 . 1 . 010 nuclear build core ' A' A ' 30' ' ' ASP . . . . . 0.459 ' N ' ' OD1' ' A' ' 30' ' ' ASP . 9.0 p-10 . . . . . 0 N--CA 1.487 1.384 0 CA-C-O 121.485 0.659 . . . . 0.0 109.777 . . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 31' ' ' VAL . . . . . 0.596 ' CG1' HH11 ' A' ' 79' ' ' ARG . 53.5 t -124.96 135.33 64.42 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.881 0 CA-C-O 121.426 0.632 . . . . 0.0 109.433 179.858 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -130.56 140.98 50.46 Favored 'General case' 0 N--CA 1.494 1.759 0 CA-C-O 121.585 0.707 . . . . 0.0 109.471 -179.915 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 22.2 pt-20 -96.01 140.36 30.86 Favored 'General case' 0 N--CA 1.493 1.686 0 CA-C-O 121.501 0.667 . . . . 0.0 110.055 -179.495 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 34' ' ' VAL . . . . . 0.4 HG21 ' CD1' ' A' ' 80' ' ' PHE . 55.4 t -127.0 132.8 69.58 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.763 0 CA-C-O 121.513 0.673 . . . . 0.0 109.304 179.885 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 35' ' ' SER . . . . . 0.506 ' C ' HD12 ' A' ' 36' ' ' LEU . 39.4 t -140.35 128.27 21.99 Favored 'General case' 0 N--CA 1.493 1.701 0 CA-C-O 121.506 0.669 . . . . 0.0 109.724 -179.968 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 36' ' ' LEU . . . . . 0.506 HD12 ' C ' ' A' ' 35' ' ' SER . 11.0 mp -111.25 154.06 24.99 Favored 'General case' 0 N--CA 1.499 2.0 0 CA-C-O 121.509 0.671 . . . . 0.0 109.434 179.977 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 37' ' ' PHE . . . . . . . . . . . . . 92.3 t80 -124.58 130.24 52.07 Favored 'General case' 0 N--CA 1.493 1.679 0 CA-C-O 121.644 0.735 . . . . 0.0 109.508 -179.794 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . -164.95 -171.34 31.07 Favored Glycine 0 N--CA 1.491 2.314 0 N-CA-C 110.182 -1.167 . . . . 0.0 110.182 -179.697 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 14.0 p -85.99 -90.06 0.11 Allowed 'General case' 0 N--CA 1.497 1.903 0 O-C-N 121.909 -0.759 . . . . 0.0 110.738 -179.312 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 40' ' ' ASP . . . . . . . . . . . . . 52.6 p-10 -84.67 168.65 15.08 Favored 'General case' 0 N--CA 1.494 1.742 0 CA-C-O 121.777 0.799 . . . . 0.0 110.525 -178.944 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 88.9 tttt -65.2 -38.08 89.33 Favored 'General case' 0 N--CA 1.496 1.874 0 CA-C-O 121.311 0.577 . . . . 0.0 110.584 -179.506 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -55.1 -41.7 71.97 Favored 'General case' 0 N--CA 1.498 1.933 0 O-C-N 121.358 -0.839 . . . . 0.0 110.413 -178.974 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 43' ' ' HIS . . . . . . . . . . . . . 54.8 t-80 -66.63 -42.09 87.31 Favored 'General case' 0 N--CA 1.496 1.854 0 O-C-N 121.473 -0.767 . . . . 0.0 110.258 -179.555 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 74.1 mt -63.94 -40.34 96.24 Favored 'General case' 0 N--CA 1.497 1.897 0 O-C-N 121.469 -0.769 . . . . 0.0 109.767 -179.412 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 71.7 mm-40 -61.44 -43.46 98.83 Favored 'General case' 0 N--CA 1.492 1.655 0 CA-C-O 121.54 0.686 . . . . 0.0 109.794 -179.451 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . -62.2 -48.33 83.59 Favored Glycine 0 N--CA 1.494 2.534 0 N-CA-C 110.226 -1.15 . . . . 0.0 110.226 -179.648 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 61.5 tttp -66.82 -30.2 70.33 Favored 'General case' 0 N--CA 1.495 1.786 0 O-C-N 121.527 -0.984 . . . . 0.0 109.536 179.936 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 45.3 tp -62.23 -38.24 88.45 Favored 'General case' 0 N--CA 1.491 1.624 0 CA-C-O 121.492 0.663 . . . . 0.0 109.574 -179.509 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 49' ' ' ALA . . . . . . . . . . . . . . . -51.53 -33.47 32.16 Favored 'General case' 0 N--CA 1.493 1.687 0 O-C-N 121.565 -0.71 . . . . 0.0 109.559 -179.588 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 97.8 mt-10 -63.65 -43.2 97.44 Favored 'General case' 0 N--CA 1.493 1.695 0 O-C-N 121.585 -0.697 . . . . 0.0 109.622 -179.906 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 51' ' ' TYR . . . . . 0.468 ' CE1' HD21 ' A' ' 36' ' ' LEU . 32.8 m-85 -62.13 -46.39 89.23 Favored 'General case' 0 N--CA 1.494 1.764 0 O-C-N 121.466 -0.771 . . . . 0.0 109.706 -179.975 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 52' ' ' ILE . . . . . . . . . . . . . 96.5 mt -65.08 -43.99 95.79 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.652 0 O-C-N 121.649 -0.657 . . . . 0.0 109.871 -179.444 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 9.7 t -63.01 -46.63 86.72 Favored 'General case' 0 N--CA 1.495 1.807 0 O-C-N 121.48 -0.762 . . . . 0.0 109.656 -179.701 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 54' ' ' LEU . . . . . . . . . . . . . 91.0 mt -67.32 -40.0 85.92 Favored 'General case' 0 N--CA 1.494 1.732 0 CA-C-O 121.743 0.782 . . . . 0.0 109.181 179.54 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -58.83 -46.33 87.91 Favored 'General case' 0 N--CA 1.494 1.735 0 CA-C-O 121.46 0.648 . . . . 0.0 109.858 -179.447 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 56' ' ' LYS . . . . . . . . . . . . . 68.0 mttm -64.2 -41.21 97.16 Favored 'General case' 0 N--CA 1.492 1.668 0 O-C-N 121.537 -0.727 . . . . 0.0 109.647 179.834 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 67.2 tp60 -65.41 -46.1 81.32 Favored 'General case' 0 N--CA 1.491 1.608 0 O-C-N 121.591 -0.693 . . . . 0.0 109.506 -179.739 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 58' ' ' VAL . . . . . . . . . . . . . 71.5 t -65.89 -44.08 92.78 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.568 0 O-C-N 121.622 -0.673 . . . . 0.0 109.441 -179.98 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 59' ' ' TYR . . . . . 0.412 ' O ' ' O ' ' A' ' 60' ' ' ALA . 52.8 t80 -125.37 133.1 52.66 Favored 'General case' 0 N--CA 1.498 1.964 0 CA-C-O 121.799 0.809 . . . . 0.0 109.758 -179.874 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 60' ' ' ALA . . . . . 0.412 ' O ' ' O ' ' A' ' 59' ' ' TYR . . . -46.45 -100.04 0.0 OUTLIER 'General case' 0 N--CA 1.494 1.733 0 CA-C-O 121.562 0.696 . . . . 0.0 111.042 -179.471 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 61' ' ' ASN . . . . . . . . . . . . . 97.7 m-20 -86.01 90.09 8.0 Favored 'General case' 0 N--CA 1.491 1.612 0 CA-C-O 121.805 0.812 . . . . 0.0 109.79 -178.676 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 62' ' ' VAL . . . . . . . . . . . . . 9.6 p -90.89 140.45 15.96 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.587 0 CA-C-O 121.488 0.661 . . . . 0.0 109.952 179.947 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 76.1 mm-40 -112.67 134.44 54.19 Favored 'General case' 0 N--CA 1.494 1.741 0 CA-C-O 121.589 0.709 . . . . 0.0 109.445 -179.809 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 64' ' ' TYR . . . . . . . . . . . . . 47.0 p90 -148.9 162.5 39.73 Favored 'General case' 0 N--CA 1.492 1.661 0 CA-C-O 121.718 0.771 . . . . 0.0 110.078 -179.333 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 15.7 pt-20 -143.18 154.37 43.8 Favored 'General case' 0 N--CA 1.494 1.732 0 N-CA-C 109.2 -0.667 . . . . 0.0 109.2 179.905 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 66' ' ' VAL . . . . . . . . . . . . . 77.3 t -119.83 130.42 74.2 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.878 0 CA-C-O 121.686 0.755 . . . . 0.0 109.856 -179.569 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 67' ' ' ALA . . . . . 0.601 ' HB1' ' HD2' ' A' ' 68' ' ' PRO . . . -84.36 170.99 12.12 Favored Pre-proline 0 N--CA 1.49 1.559 0 N-CA-C 109.423 -0.584 . . . . 0.0 109.423 -179.932 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 68' ' ' PRO . . . . . 0.601 ' HD2' ' HB1' ' A' ' 67' ' ' ALA . 62.9 Cg_exo -52.01 131.47 38.97 Favored 'Trans proline' 0 N--CA 1.496 1.659 0 C-N-CA 122.699 2.266 . . . . 0.0 112.971 -179.806 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 69' ' ' VAL . . . . . . . . . . . . . 53.3 t -132.33 131.99 60.6 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.897 0 CA-C-O 121.651 0.738 . . . . 0.0 109.896 179.838 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -74.9 152.72 38.84 Favored 'General case' 0 N--CA 1.491 1.59 0 CA-C-O 121.731 0.776 . . . . 0.0 110.021 179.625 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 53.3 m-20 -64.11 -36.0 82.6 Favored 'General case' 0 N--CA 1.493 1.677 0 CA-C-O 121.541 0.686 . . . . 0.0 109.267 179.969 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 72' ' ' ASN . . . . . . . . . . . . . 63.2 t30 -94.58 13.37 24.35 Favored 'General case' 0 N--CA 1.494 1.745 0 O-C-N 121.279 -0.888 . . . . 0.0 109.279 179.977 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -58.05 145.38 36.58 Favored 'General case' 0 N--CA 1.497 1.889 0 CA-C-O 121.74 0.781 . . . . 0.0 110.806 -179.273 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 74' ' ' THR . . . . . . . . . . . . . 41.0 p -98.45 -1.03 42.34 Favored 'General case' 0 N--CA 1.493 1.717 0 N-CA-C 109.309 -0.626 . . . . 0.0 109.309 179.6 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 18.9 pt-20 -154.3 163.04 40.76 Favored 'General case' 0 N--CA 1.494 1.747 0 O-C-N 121.259 -0.9 . . . . 0.0 109.912 179.887 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 5.3 tt -126.41 127.81 46.02 Favored 'General case' 0 N--CA 1.494 1.738 0 CA-C-O 121.574 0.702 . . . . 0.0 109.728 -179.855 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 77' ' ' HIS . . . . . . . . . . . . . 60.6 t-80 -97.83 124.01 42.04 Favored 'General case' 0 N--CA 1.491 1.606 0 CA-C-O 121.775 0.798 . . . . 0.0 109.88 -179.765 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -142.75 158.03 44.05 Favored 'General case' 0 N--CA 1.491 1.618 0 N-CA-C 108.881 -0.785 . . . . 0.0 108.881 179.693 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 79' ' ' ARG . . . . . 0.596 HH11 ' CG1' ' A' ' 31' ' ' VAL . 63.2 ttm-85 -128.83 137.67 51.62 Favored 'General case' 0 N--CA 1.493 1.693 0 CA-C-O 121.536 0.684 . . . . 0.0 109.551 -179.685 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 80' ' ' PHE . . . . . 0.4 ' CD1' HG21 ' A' ' 34' ' ' VAL . 59.3 m-85 -123.78 146.67 48.16 Favored 'General case' 0 N--CA 1.496 1.844 0 CA-C-O 121.521 0.677 . . . . 0.0 109.524 -179.803 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 63.6 tttp -115.76 128.91 56.21 Favored 'General case' 0 N--CA 1.496 1.845 0 N-CA-C 109.115 -0.698 . . . . 0.0 109.115 -179.859 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 82' ' ' PHE . . . . . 0.402 ' O ' ' OD2' ' A' ' 30' ' ' ASP . 94.4 m-85 -122.55 -122.01 0.28 Allowed 'General case' 0 N--CA 1.499 1.979 0 CA-C-O 121.346 0.593 . . . . 0.0 109.902 -179.413 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 52.8 tp10 -150.71 -39.84 0.13 Allowed 'General case' 0 N--CA 1.489 1.521 0 N-CA-C 108.747 -0.834 . . . . 0.0 108.747 -179.544 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 84' ' ' VAL . . . . . . . . . . . . . 25.6 m -137.12 157.7 35.48 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.888 0 O-C-N 121.469 -0.77 . . . . 0.0 109.686 179.928 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 85' ' ' SER . . . . . 0.482 ' O ' ' N ' ' A' ' 88' ' ' LYS . 11.3 t -64.08 -42.03 97.11 Favored 'General case' 0 N--CA 1.494 1.726 0 CA-C-O 121.33 0.586 . . . . 0.0 110.329 -179.979 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 86' ' ' ALA . . . . . 0.42 ' C ' ' O ' ' A' ' 85' ' ' SER . . . -39.22 -46.06 1.45 Allowed 'General case' 0 N--CA 1.5 2.026 0 CA-C-O 121.45 0.643 . . . . 0.0 110.587 -179.01 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 96.1 mt-10 -62.73 -33.94 76.16 Favored 'General case' 0 N--CA 1.494 1.73 0 O-C-N 121.469 -0.769 . . . . 0.0 110.008 -179.779 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 88' ' ' LYS . . . . . 0.482 ' N ' ' O ' ' A' ' 85' ' ' SER . 88.2 tttt -63.02 -43.11 99.62 Favored 'General case' 0 N--CA 1.492 1.664 0 O-C-N 121.414 -0.804 . . . . 0.0 109.648 -179.802 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 89' ' ' LEU . . . . . 0.55 ' N ' HD12 ' A' ' 89' ' ' LEU . 10.6 mp -63.47 -48.47 77.53 Favored 'General case' 0 N--CA 1.495 1.788 0 O-C-N 121.604 -0.685 . . . . 0.0 110.371 -179.093 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 90' ' ' ILE . . . . . 0.52 ' N ' HD12 ' A' ' 90' ' ' ILE . 1.4 mp -69.67 -43.65 80.03 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.756 0 O-C-N 121.355 -0.84 . . . . 0.0 108.972 179.962 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 91' ' ' PHE . . . . . . . . . . . . . 88.3 t80 -59.2 -47.6 84.74 Favored 'General case' 0 C--N 1.302 -1.478 0 CA-C-O 121.725 0.774 . . . . 0.0 109.184 -179.585 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 92' ' ' GLU . . . . . . . . . . . . . 84.2 tt0 -69.97 -31.83 69.74 Favored 'General case' 0 N--CA 1.49 1.56 0 CA-C-O 121.533 0.682 . . . . 0.0 109.431 179.681 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 93' ' ' LEU . . . . . . . . . . . . . 61.6 tp -62.99 -45.46 92.3 Favored 'General case' 0 N--CA 1.492 1.651 0 O-C-N 121.328 -0.857 . . . . 0.0 109.754 -179.455 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 94' ' ' LYS . . . . . . . . . . . . . 52.4 mtmt -65.24 -42.38 93.43 Favored 'General case' 0 N--CA 1.491 1.6 0 CA-C-O 121.467 0.651 . . . . 0.0 110.088 -179.386 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 34.2 p -67.02 -38.35 85.79 Favored 'General case' 0 N--CA 1.492 1.669 0 O-C-N 121.514 -0.741 . . . . 0.0 110.193 -179.325 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 96' ' ' ARG . . . . . . . . . . . . . 77.8 mmt-85 -66.19 -39.02 89.38 Favored 'General case' 0 N--CA 1.493 1.686 0 O-C-N 121.302 -0.874 . . . . 0.0 109.563 -179.954 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 97' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.301 -1.535 0 CA-C-O 121.635 0.731 . . . . 0.0 109.187 179.997 . . . . . . . . 0 0 . 1 . 011 nuclear build core ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 39.1 p-10 . . . . . 0 N--CA 1.494 1.743 0 N-CA-C 109.366 -0.605 . . . . 0.0 109.366 . . . . . . . . . 0 0 . 1 . 011 nuclear build core ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 50.3 t -123.64 133.6 68.76 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.955 0 CA-C-O 121.602 0.715 . . . . 0.0 109.985 179.519 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 32' ' ' ALA . . . . . 0.626 ' HB1' ' NZ ' ' A' ' 88' ' ' LYS . . . -116.96 150.6 38.28 Favored 'General case' 0 N--CA 1.497 1.919 0 CA-C-O 121.977 0.894 . . . . 0.0 110.113 179.825 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 16.4 pt-20 -98.34 142.23 30.24 Favored 'General case' 0 N--CA 1.494 1.727 0 CA-C-O 121.615 0.722 . . . . 0.0 110.118 -179.821 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 34' ' ' VAL . . . . . . . . . . . . . 53.0 t -125.96 134.5 66.4 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.833 0 CA-C-O 121.789 0.804 . . . . 0.0 109.459 179.881 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 34.7 p -137.87 129.51 28.22 Favored 'General case' 0 N--CA 1.494 1.742 0 CA-C-O 121.726 0.774 . . . . 0.0 110.15 179.825 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 25.6 tp -127.99 139.83 52.34 Favored 'General case' 0 N--CA 1.492 1.64 0 CA-C-O 121.725 0.774 . . . . 0.0 109.574 179.656 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 37' ' ' PHE . . . . . . . . . . . . . 46.8 p90 -139.7 148.23 42.05 Favored 'General case' 0 N--CA 1.492 1.663 0 CA-C-O 121.902 0.858 . . . . 0.0 110.109 179.934 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . 155.31 128.52 1.15 Allowed Glycine 0 N--CA 1.49 2.234 0 N-CA-C 109.831 -1.308 . . . . 0.0 109.831 179.796 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 14.7 m 47.84 -146.6 0.25 Allowed 'General case' 0 N--CA 1.488 1.45 0 O-C-N 121.75 -0.853 . . . . 0.0 110.205 179.625 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 40' ' ' ASP . . . . . . . . . . . . . 56.1 p30 -86.94 -177.74 6.13 Favored 'General case' 0 N--CA 1.492 1.666 0 CA-C-O 121.606 0.717 . . . . 0.0 110.451 -178.903 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 88.8 tttt -62.66 -42.03 99.39 Favored 'General case' 0 N--CA 1.494 1.733 0 O-C-N 121.93 -0.481 . . . . 0.0 110.085 -179.091 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -49.86 -41.76 46.07 Favored 'General case' 0 N--CA 1.495 1.825 0 O-C-N 121.662 -0.648 . . . . 0.0 109.738 -178.645 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 43' ' ' HIS . . . . . . . . . . . . . 84.7 t60 -64.01 -41.55 97.42 Favored 'General case' 0 N--CA 1.491 1.614 0 CA-C-O 121.353 0.597 . . . . 0.0 109.619 -179.809 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 49.8 mt -64.11 -40.11 95.5 Favored 'General case' 0 N--CA 1.492 1.64 0 O-C-N 121.628 -0.67 . . . . 0.0 109.627 -179.467 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 79.6 mm-40 -62.93 -39.59 95.05 Favored 'General case' 0 N--CA 1.493 1.68 0 O-C-N 121.769 -0.582 . . . . 0.0 109.474 -179.263 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . -62.34 -42.4 99.71 Favored Glycine 0 N--CA 1.492 2.383 0 N-CA-C 109.604 -1.398 . . . . 0.0 109.604 -179.646 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 55.1 mtpt -83.19 -18.24 39.99 Favored 'General case' 0 N--CA 1.491 1.594 0 O-C-N 121.661 -0.905 . . . . 0.0 109.255 -179.634 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 58.2 tp -64.13 -39.83 94.88 Favored 'General case' 0 N--CA 1.488 1.45 0 N-CA-C 108.901 -0.777 . . . . 0.0 108.901 179.719 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 49' ' ' ALA . . . . . . . . . . . . . . . -58.02 -41.2 82.65 Favored 'General case' 0 N--CA 1.494 1.758 0 N-CA-C 109.588 -0.523 . . . . 0.0 109.588 -179.018 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 79.5 mm-40 -68.92 -37.16 78.76 Favored 'General case' 0 N--CA 1.494 1.753 0 O-C-N 121.648 -0.657 . . . . 0.0 109.244 179.966 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 3.6 m-85 -61.54 -43.88 98.06 Favored 'General case' 0 N--CA 1.496 1.836 0 O-C-N 121.615 -0.678 . . . . 0.0 109.505 -179.326 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 52' ' ' ILE . . . . . . . . . . . . . 90.8 mt -64.22 -42.38 95.3 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.653 0 N-CA-C 109.0 -0.741 . . . . 0.0 109.0 -179.973 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 11.5 t -59.01 -42.69 90.73 Favored 'General case' 0 N--CA 1.489 1.523 0 N-CA-C 109.092 -0.707 . . . . 0.0 109.092 -179.017 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 54' ' ' LEU . . . . . . . . . . . . . 88.8 mt -63.15 -40.95 99.05 Favored 'General case' 0 C--N 1.301 -1.541 0 N-CA-C 109.231 -0.655 . . . . 0.0 109.231 -179.962 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -65.93 -38.86 89.75 Favored 'General case' 0 N--CA 1.494 1.758 0 O-C-N 121.939 -0.476 . . . . 0.0 110.002 -179.253 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 56' ' ' LYS . . . . . . . . . . . . . 64.7 mttm -64.81 -41.46 95.76 Favored 'General case' 0 N--CA 1.493 1.717 0 O-C-N 121.528 -0.732 . . . . 0.0 109.79 -179.821 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 87.8 mt-30 -61.66 -46.23 90.64 Favored 'General case' 0 N--CA 1.488 1.474 0 N-CA-C 109.074 -0.713 . . . . 0.0 109.074 -179.502 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 58' ' ' VAL . . . . . . . . . . . . . 76.0 t -66.41 -44.27 90.75 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.591 0 N-CA-C 109.235 -0.654 . . . . 0.0 109.235 179.794 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 59' ' ' TYR . . . . . . . . . . . . . 87.7 t80 -140.42 118.53 11.95 Favored 'General case' 0 N--CA 1.498 1.929 0 CA-C-O 121.813 0.816 . . . . 0.0 110.046 -179.844 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -70.79 149.15 47.15 Favored 'General case' 0 N--CA 1.495 1.797 0 CA-C-O 121.572 0.701 . . . . 0.0 110.895 -179.854 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 61' ' ' ASN . . . . . . . . . . . . . 50.2 t-20 61.42 42.47 11.54 Favored 'General case' 0 N--CA 1.493 1.687 0 CA-C-O 121.602 0.715 . . . . 0.0 109.089 179.671 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 62' ' ' VAL . . . . . . . . . . . . . 9.4 p -80.37 137.27 21.78 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.531 0 CA-C-O 121.636 0.731 . . . . 0.0 110.383 -179.811 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 96.6 mt-10 -111.39 146.17 37.62 Favored 'General case' 0 N--CA 1.495 1.793 0 CA-C-O 121.967 0.889 . . . . 0.0 109.932 -179.844 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 64' ' ' TYR . . . . . . . . . . . . . 55.1 p90 -151.47 161.03 43.4 Favored 'General case' 0 N--CA 1.489 1.516 0 CA-C-O 121.503 0.668 . . . . 0.0 110.023 -179.667 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 74.6 mm-40 -138.13 151.02 47.37 Favored 'General case' 0 N--CA 1.5 2.049 0 CA-C-O 121.707 0.765 . . . . 0.0 110.406 -179.481 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 66' ' ' VAL . . . . . . . . . . . . . 53.4 t -122.62 130.84 74.21 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.969 0 CA-C-O 121.923 0.868 . . . . 0.0 110.163 -179.549 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 67' ' ' ALA . . . . . 0.591 ' HB1' ' HD2' ' A' ' 68' ' ' PRO . . . -81.41 170.28 15.88 Favored Pre-proline 0 N--CA 1.487 1.38 0 CA-C-O 121.167 0.508 . . . . 0.0 109.739 179.812 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 68' ' ' PRO . . . . . 0.591 ' HD2' ' HB1' ' A' ' 67' ' ' ALA . 31.5 Cg_exo -56.55 122.86 12.54 Favored 'Trans proline' 0 N--CA 1.494 1.557 0 C-N-CA 122.537 2.158 . . . . 0.0 112.601 179.922 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 69' ' ' VAL . . . . . . . . . . . . . 67.8 t -135.45 134.1 52.16 Favored 'Isoleucine or valine' 0 N--CA 1.499 1.975 0 CA-C-O 121.789 0.804 . . . . 0.0 110.379 179.903 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -71.55 151.64 43.67 Favored 'General case' 0 N--CA 1.497 1.877 0 CA-C-O 121.578 0.704 . . . . 0.0 110.583 179.934 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 98.4 m-20 -62.43 -35.93 80.81 Favored 'General case' 0 N--CA 1.493 1.722 0 N-CA-C 109.531 -0.544 . . . . 0.0 109.531 -179.537 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 72' ' ' ASN . . . . . . . . . . . . . 56.6 p30 -92.04 11.54 24.92 Favored 'General case' 0 N--CA 1.495 1.775 0 O-C-N 121.555 -0.716 . . . . 0.0 109.363 -179.288 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -66.14 144.03 56.92 Favored 'General case' 0 N--CA 1.493 1.723 0 O-C-N 121.496 -0.752 . . . . 0.0 109.736 179.833 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 74' ' ' THR . . . . . . . . . . . . . 3.8 m -99.18 -3.54 34.17 Favored 'General case' 0 N--CA 1.493 1.681 0 N-CA-C 108.697 -0.853 . . . . 0.0 108.697 -179.873 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 84.0 tt0 -135.88 150.49 49.38 Favored 'General case' 0 N--CA 1.492 1.656 0 CA-C-O 121.792 0.806 . . . . 0.0 109.522 179.977 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 4.7 tt -131.21 128.29 39.66 Favored 'General case' 0 N--CA 1.489 1.52 0 CA-C-O 121.806 0.812 . . . . 0.0 109.841 -179.725 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 77' ' ' HIS . . . . . . . . . . . . . 80.5 m80 -96.92 131.41 43.72 Favored 'General case' 0 N--CA 1.493 1.686 0 CA-C-O 121.857 0.836 . . . . 0.0 109.435 -179.805 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -147.64 155.78 42.12 Favored 'General case' 0 N--CA 1.49 1.551 0 CA-C-O 121.716 0.77 . . . . 0.0 109.995 -179.85 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 95.2 mtt180 -128.54 137.66 51.86 Favored 'General case' 0 N--CA 1.496 1.849 0 CA-C-O 121.794 0.807 . . . . 0.0 109.728 -179.881 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 80' ' ' PHE . . . . . . . . . . . . . 30.0 m-85 -129.44 147.78 51.29 Favored 'General case' 0 N--CA 1.495 1.809 0 CA-C-O 121.723 0.773 . . . . 0.0 109.629 179.885 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -124.96 146.24 49.48 Favored 'General case' 0 N--CA 1.495 1.813 0 CA-C-O 121.622 0.725 . . . . 0.0 109.774 179.902 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 82' ' ' PHE . . . . . . . . . . . . . 97.7 m-85 -132.67 -97.6 0.3 Allowed 'General case' 0 N--CA 1.496 1.873 0 CA-C-O 121.351 0.596 . . . . 0.0 109.701 -179.869 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 6.1 pt-20 -177.32 -28.87 0.01 OUTLIER 'General case' 0 N--CA 1.494 1.757 0 O-C-N 121.341 -0.85 . . . . 0.0 108.812 -179.82 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 84' ' ' VAL . . . . . . . . . . . . . 33.7 m -134.27 160.11 41.79 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.903 0 CA-C-O 121.814 0.816 . . . . 0.0 110.208 -179.918 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 35.6 m -79.61 -18.06 52.43 Favored 'General case' 0 N--CA 1.493 1.706 0 CA-C-O 121.348 0.595 . . . . 0.0 109.679 -179.711 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 86' ' ' ALA . . . . . . . . . . . . . . . -63.27 -42.93 99.19 Favored 'General case' 0 N--CA 1.493 1.712 0 O-C-N 121.519 -0.738 . . . . 0.0 109.515 -179.337 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 92.5 mt-10 -67.31 -29.64 69.27 Favored 'General case' 0 N--CA 1.493 1.708 0 O-C-N 121.523 -0.736 . . . . 0.0 109.471 -179.701 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 88' ' ' LYS . . . . . 0.626 ' NZ ' ' HB1' ' A' ' 32' ' ' ALA . 64.6 tttp -63.22 -46.06 88.74 Favored 'General case' 0 N--CA 1.489 1.498 0 O-C-N 121.681 -0.637 . . . . 0.0 109.531 -179.413 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 96.6 mt -64.14 -48.87 74.36 Favored 'General case' 0 N--CA 1.491 1.606 0 O-C-N 121.685 -0.634 . . . . 0.0 110.095 -178.965 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 90' ' ' ILE . . . . . 0.521 ' N ' HD12 ' A' ' 90' ' ' ILE . 1.3 mp -68.68 -44.21 82.6 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.612 0 O-C-N 121.766 -0.584 . . . . 0.0 109.735 179.904 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 91' ' ' PHE . . . . . . . . . . . . . 85.7 t80 -61.81 -44.73 96.28 Favored 'General case' 0 C--N 1.301 -1.542 0 N-CA-C 108.723 -0.843 . . . . 0.0 108.723 -178.972 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 92' ' ' GLU . . . . . . . . . . . . . 50.8 tp10 -63.16 -37.52 87.54 Favored 'General case' 0 C--N 1.302 -1.463 0 N-CA-C 109.28 -0.637 . . . . 0.0 109.28 -179.628 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 93' ' ' LEU . . . . . . . . . . . . . 6.3 tt -63.27 -46.6 86.06 Favored 'General case' 0 N--CA 1.489 1.511 0 CA-C-O 121.426 0.631 . . . . 0.0 109.677 -179.43 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 94' ' ' LYS . . . . . . . . . . . . . 67.8 mttm -66.5 -44.84 81.46 Favored 'General case' 0 N--CA 1.491 1.589 0 O-C-N 121.792 -0.568 . . . . 0.0 110.262 -179.408 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 22.3 p -69.13 -41.77 76.91 Favored 'General case' 0 N--CA 1.494 1.765 0 O-C-N 121.518 -0.738 . . . . 0.0 109.847 -179.188 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 96' ' ' ARG . . . . . . . . . . . . . 64.0 ttm-85 -68.23 -42.3 79.97 Favored 'General case' 0 N--CA 1.491 1.623 0 O-C-N 121.536 -0.727 . . . . 0.0 109.042 -179.818 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 97' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 1.526 0 N-CA-C 109.217 -0.661 . . . . 0.0 109.217 -179.499 . . . . . . . . 0 0 . 1 . 012 nuclear build core ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 62.3 t0 . . . . . 0 N--CA 1.492 1.662 0 N-CA-C 108.674 -0.861 . . . . 0.0 108.674 . . . . . . . . . 0 0 . 1 . 012 nuclear build core ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 4.2 p -129.25 153.98 39.45 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.804 0 CA-C-O 121.349 0.595 . . . . 0.0 109.851 -179.58 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -133.18 148.12 52.06 Favored 'General case' 0 N--CA 1.493 1.71 0 CA-C-O 121.661 0.744 . . . . 0.0 109.575 -179.953 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 98.2 mt-10 -92.17 148.06 22.45 Favored 'General case' 0 N--CA 1.49 1.557 0 CA-C-O 121.559 0.695 . . . . 0.0 110.084 -179.877 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 34' ' ' VAL . . . . . . . . . . . . . 51.6 t -127.01 132.64 69.73 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.671 0 CA-C-O 121.556 0.693 . . . . 0.0 109.385 -179.962 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 70.7 m -125.48 122.75 37.53 Favored 'General case' 0 N--CA 1.492 1.65 0 N-CA-C 109.342 -0.614 . . . . 0.0 109.342 179.918 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 39.8 tp -120.85 133.07 55.31 Favored 'General case' 0 N--CA 1.496 1.841 0 CA-C-O 121.602 0.715 . . . . 0.0 109.336 179.741 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 37' ' ' PHE . . . . . . . . . . . . . 83.4 m-85 -93.94 147.79 22.77 Favored 'General case' 0 N--CA 1.49 1.557 0 CA-C-O 121.646 0.736 . . . . 0.0 110.083 -179.526 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . 179.96 -179.29 48.81 Favored Glycine 0 N--CA 1.487 2.045 0 N-CA-C 110.05 -1.22 . . . . 0.0 110.05 179.877 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 39' ' ' SER . . . . . 0.43 ' O ' ' O ' ' A' ' 73' ' ' ALA . 13.3 p -82.7 -102.85 0.04 OUTLIER 'General case' 0 N--CA 1.49 1.54 0 O-C-N 121.692 -0.887 . . . . 0.0 110.325 -179.715 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 40' ' ' ASP . . . . . . . . . . . . . 52.4 p-10 -83.8 174.97 9.98 Favored 'General case' 0 N--CA 1.492 1.629 0 O-C-N 121.371 -0.83 . . . . 0.0 110.777 -179.037 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 37.5 ttmt -62.95 -39.91 96.06 Favored 'General case' 0 N--CA 1.49 1.54 0 O-C-N 121.712 -0.617 . . . . 0.0 110.63 -179.353 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -56.17 -43.32 78.26 Favored 'General case' 0 N--CA 1.495 1.815 0 O-C-N 121.223 -0.923 . . . . 0.0 109.893 -179.166 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 43' ' ' HIS . . . . . . . . . . . . . 83.2 t60 -66.9 -43.11 84.27 Favored 'General case' 0 N--CA 1.494 1.773 0 O-C-N 121.408 -0.808 . . . . 0.0 109.878 -179.853 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 47.5 mt -63.86 -40.58 96.9 Favored 'General case' 0 N--CA 1.494 1.774 0 O-C-N 121.302 -0.874 . . . . 0.0 109.939 -179.642 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 97.1 mt-10 -65.09 -36.12 83.29 Favored 'General case' 0 N--CA 1.494 1.765 0 O-C-N 121.315 -0.865 . . . . 0.0 109.662 -179.708 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . -61.02 -42.47 99.81 Favored Glycine 0 N--CA 1.492 2.395 0 N-CA-C 109.407 -1.477 . . . . 0.0 109.407 179.993 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 97.4 mttt -83.19 -17.11 44.0 Favored 'General case' 0 N--CA 1.492 1.633 0 O-C-N 121.533 -0.98 . . . . 0.0 109.308 179.548 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 48' ' ' LEU . . . . . 0.564 HD13 ' CD2' ' A' ' 76' ' ' LEU . 51.5 tp -65.18 -39.44 92.91 Favored 'General case' 0 N--CA 1.491 1.611 0 O-C-N 121.536 -0.728 . . . . 0.0 109.697 179.954 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 49' ' ' ALA . . . . . . . . . . . . . . . -54.25 -28.59 42.52 Favored 'General case' 0 N--CA 1.491 1.618 0 O-C-N 121.591 -0.693 . . . . 0.0 109.571 -179.131 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 80.5 mm-40 -66.72 -42.75 85.83 Favored 'General case' 0 N--CA 1.492 1.638 0 O-C-N 121.384 -0.822 . . . . 0.0 109.335 179.78 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 32.0 m-85 -61.2 -44.62 96.99 Favored 'General case' 0 N--CA 1.495 1.811 0 O-C-N 121.551 -0.718 . . . . 0.0 109.891 -179.969 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 52' ' ' ILE . . . . . . . . . . . . . 96.6 mt -65.28 -43.75 95.09 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.59 0 O-C-N 121.676 -0.64 . . . . 0.0 110.58 -179.208 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 5.2 t -61.06 -51.62 68.39 Favored 'General case' 0 N--CA 1.494 1.741 0 O-C-N 121.271 -0.893 . . . . 0.0 110.316 -179.037 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 54' ' ' LEU . . . . . . . . . . . . . 4.0 mm? -66.0 -38.07 87.53 Favored 'General case' 0 N--CA 1.492 1.657 0 O-C-N 121.525 -0.734 . . . . 0.0 109.886 179.716 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -55.39 -48.12 74.82 Favored 'General case' 0 N--CA 1.49 1.572 0 O-C-N 121.513 -0.742 . . . . 0.0 110.332 -179.029 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 56' ' ' LYS . . . . . . . . . . . . . 61.4 mttp -65.65 -42.68 91.12 Favored 'General case' 0 N--CA 1.493 1.683 0 O-C-N 121.299 -0.876 . . . . 0.0 110.121 -179.921 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 95.9 mt-30 -65.62 -45.69 82.14 Favored 'General case' 0 N--CA 1.493 1.7 0 O-C-N 121.402 -0.811 . . . . 0.0 109.488 -179.656 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 58' ' ' VAL . . . . . . . . . . . . . 71.7 t -65.15 -45.86 92.76 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.478 0 O-C-N 121.589 -0.695 . . . . 0.0 109.343 179.783 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 59' ' ' TYR . . . . . . . . . . . . . 52.4 t80 -132.33 119.52 20.85 Favored 'General case' 0 N--CA 1.496 1.853 0 CA-C-O 121.616 0.722 . . . . 0.0 109.108 -179.979 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -70.51 144.39 51.36 Favored 'General case' 0 N--CA 1.491 1.592 0 CA-C-O 121.813 0.816 . . . . 0.0 110.913 -179.236 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 61' ' ' ASN . . . . . . . . . . . . . 40.3 t-20 57.79 41.81 24.4 Favored 'General case' 0 N--CA 1.492 1.63 0 CA-C-O 121.851 0.834 . . . . 0.0 109.349 179.926 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 62' ' ' VAL . . . . . . . . . . . . . 8.2 p -74.09 138.84 20.35 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.48 0 CA-C-O 121.631 0.729 . . . . 0.0 110.452 -179.776 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 71.7 mm-40 -112.64 137.59 50.68 Favored 'General case' 0 N--CA 1.494 1.751 0 CA-C-O 121.609 0.719 . . . . 0.0 109.402 179.968 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 64' ' ' TYR . . . . . . . . . . . . . 50.9 p90 -149.64 161.08 42.88 Favored 'General case' 0 N--CA 1.489 1.493 0 CA-C-O 121.721 0.772 . . . . 0.0 110.337 -179.585 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 50.8 tp10 -142.4 148.72 38.29 Favored 'General case' 0 N--CA 1.49 1.573 0 N-CA-C 108.997 -0.742 . . . . 0.0 108.997 179.782 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 66' ' ' VAL . . . . . . . . . . . . . 54.9 t -111.62 130.87 64.41 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.791 0 CA-C-O 121.79 0.805 . . . . 0.0 109.839 -179.59 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -82.18 158.91 66.22 Favored Pre-proline 0 N--CA 1.488 1.425 0 N-CA-C 109.605 -0.517 . . . . 0.0 109.605 -179.759 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 68' ' ' PRO . . . . . . . . . . . . . 48.6 Cg_exo -51.26 128.8 26.58 Favored 'Trans proline' 0 N--CA 1.493 1.45 0 C-N-CA 122.233 1.955 . . . . 0.0 112.178 179.039 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 69' ' ' VAL . . . . . . . . . . . . . 54.0 t -131.27 135.31 59.83 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.754 0 CA-C-O 121.649 0.738 . . . . 0.0 110.02 -179.827 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -69.71 152.47 44.62 Favored 'General case' 0 C--N 1.303 -1.451 0 CA-C-O 121.75 0.786 . . . . 0.0 110.006 179.554 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 12.9 m-20 -64.27 -34.49 78.24 Favored 'General case' 0 N--CA 1.491 1.586 0 O-C-N 121.629 -0.67 . . . . 0.0 109.424 179.886 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 72' ' ' ASN . . . . . . . . . . . . . 57.1 p30 -94.8 16.32 16.18 Favored 'General case' 0 N--CA 1.493 1.704 0 O-C-N 121.348 -0.845 . . . . 0.0 109.435 -179.445 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 73' ' ' ALA . . . . . 0.43 ' O ' ' O ' ' A' ' 39' ' ' SER . . . -66.6 144.95 56.11 Favored 'General case' 0 N--CA 1.491 1.594 0 O-C-N 121.525 -0.734 . . . . 0.0 110.059 179.964 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 74' ' ' THR . . . . . . . . . . . . . 61.4 p -101.13 -0.96 35.2 Favored 'General case' 0 N--CA 1.493 1.688 0 O-C-N 121.551 -0.718 . . . . 0.0 109.299 179.857 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 95.3 mt-10 -139.58 160.05 40.76 Favored 'General case' 0 N--CA 1.496 1.856 0 O-C-N 121.256 -0.903 . . . . 0.0 109.835 -179.856 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 76' ' ' LEU . . . . . 0.564 ' CD2' HD13 ' A' ' 48' ' ' LEU . 6.5 tp -123.8 131.15 53.53 Favored 'General case' 0 N--CA 1.491 1.617 0 CA-C-O 121.524 0.678 . . . . 0.0 109.37 -179.95 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 77' ' ' HIS . . . . . . . . . . . . . 97.2 m-70 -106.35 126.77 52.65 Favored 'General case' 0 N--CA 1.493 1.681 0 CA-C-O 121.541 0.686 . . . . 0.0 109.689 -179.767 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -149.4 159.75 44.03 Favored 'General case' 0 N--CA 1.49 1.529 0 CA-C-O 121.507 0.67 . . . . 0.0 109.848 -179.763 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 86.4 mtm-85 -127.47 142.37 51.42 Favored 'General case' 0 N--CA 1.495 1.8 0 CA-C-O 121.508 0.671 . . . . 0.0 109.433 -179.847 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 80' ' ' PHE . . . . . . . . . . . . . 44.1 m-85 -127.87 149.47 50.28 Favored 'General case' 0 N--CA 1.498 1.931 0 CA-C-O 121.401 0.619 . . . . 0.0 109.741 -179.482 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 82.8 tttt -111.73 133.36 54.01 Favored 'General case' 0 N--CA 1.493 1.698 0 CA-C-O 121.554 0.692 . . . . 0.0 109.685 -179.861 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 82' ' ' PHE . . . . . . . . . . . . . 71.8 m-85 -137.54 -128.53 0.13 Allowed 'General case' 0 N--CA 1.494 1.73 0 CA-C-O 121.442 0.639 . . . . 0.0 109.711 -179.665 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 81.3 tt0 -149.8 -34.14 0.18 Allowed 'General case' 0 N--CA 1.489 1.489 0 O-C-N 121.519 -0.738 . . . . 0.0 109.132 -179.765 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 84' ' ' VAL . . . . . . . . . . . . . 34.8 m -135.08 158.28 41.05 Favored 'Isoleucine or valine' 0 N--CA 1.499 1.98 0 O-C-N 121.31 -0.869 . . . . 0.0 110.348 -179.971 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 82.8 p -74.07 -16.77 61.02 Favored 'General case' 0 N--CA 1.491 1.582 0 CA-C-O 121.327 0.584 . . . . 0.0 109.823 -179.952 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 86' ' ' ALA . . . . . . . . . . . . . . . -63.89 -38.2 90.22 Favored 'General case' 0 N--CA 1.492 1.667 0 O-C-N 121.367 -0.833 . . . . 0.0 109.457 -179.761 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 94.4 mt-10 -68.08 -35.05 77.56 Favored 'General case' 0 N--CA 1.491 1.624 0 O-C-N 121.499 -0.75 . . . . 0.0 109.302 179.683 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 88' ' ' LYS . . . . . . . . . . . . . 49.1 tptt -61.95 -44.48 96.67 Favored 'General case' 0 C--N 1.302 -1.491 0 O-C-N 121.436 -0.79 . . . . 0.0 109.211 179.82 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 42.5 tp -62.07 -50.16 73.08 Favored 'General case' 0 C--N 1.303 -1.431 0 O-C-N 121.651 -0.655 . . . . 0.0 109.817 -179.029 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 90' ' ' ILE . . . . . . . . . . . . . 96.6 mt -66.66 -43.03 90.5 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.773 0 O-C-N 121.529 -0.732 . . . . 0.0 109.878 179.929 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 91' ' ' PHE . . . . . 0.422 ' O ' HG23 ' A' ' 95' ' ' THR . 71.1 t80 -59.35 -46.09 89.59 Favored 'General case' 0 N--CA 1.493 1.679 0 O-C-N 121.468 -0.77 . . . . 0.0 109.649 -179.186 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 92' ' ' GLU . . . . . . . . . . . . . 9.5 tm-20 -66.98 -41.18 87.22 Favored 'General case' 0 N--CA 1.49 1.536 0 CA-C-O 121.691 0.758 . . . . 0.0 109.191 179.881 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 93' ' ' LEU . . . . . 0.544 ' O ' HD13 ' A' ' 93' ' ' LEU . 0.3 OUTLIER -63.87 -47.71 79.61 Favored 'General case' 0 C--N 1.303 -1.437 0 CA-C-O 121.932 0.873 . . . . 0.0 109.651 -179.226 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 94' ' ' LYS . . . . . . . . . . . . . 54.9 mtpt -65.04 -43.52 92.05 Favored 'General case' 0 C--N 1.3 -1.567 0 O-C-N 121.411 -0.806 . . . . 0.0 109.786 -179.252 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 95' ' ' THR . . . . . 0.422 HG23 ' O ' ' A' ' 91' ' ' PHE . 40.9 p -69.06 -35.56 76.69 Favored 'General case' 0 N--CA 1.491 1.6 0 O-C-N 121.608 -0.683 . . . . 0.0 109.847 -179.867 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 96' ' ' ARG . . . . . . . . . . . . . 74.1 ttt180 -64.63 -42.9 95.16 Favored 'General case' 0 N--CA 1.491 1.587 0 O-C-N 121.487 -0.758 . . . . 0.0 109.267 179.798 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 97' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.493 1.704 0 CA-C-O 121.477 0.656 . . . . 0.0 109.482 -179.946 . . . . . . . . 0 0 . 1 . 013 nuclear build core ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 97.3 m-20 . . . . . 0 N--CA 1.488 1.472 0 CA-C-O 121.515 0.674 . . . . 0.0 109.846 . . . . . . . . . 0 0 . 1 . 013 nuclear build core ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 8.6 p -123.13 144.62 32.06 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.708 0 CA-C-O 121.354 0.597 . . . . 0.0 109.487 179.955 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -116.71 155.46 28.82 Favored 'General case' 0 N--CA 1.495 1.781 0 CA-C-O 121.473 0.654 . . . . 0.0 109.383 -179.404 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 77.7 mm-40 -108.26 136.06 48.55 Favored 'General case' 0 N--CA 1.494 1.729 0 CA-C-O 121.598 0.713 . . . . 0.0 109.61 179.858 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 34' ' ' VAL . . . . . . . . . . . . . 56.0 t -127.26 134.38 66.02 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.874 0 CA-C-O 121.592 0.711 . . . . 0.0 109.937 -179.579 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 45.8 p -136.68 122.42 19.86 Favored 'General case' 0 N--CA 1.493 1.704 0 N-CA-C 108.73 -0.841 . . . . 0.0 108.73 179.299 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 51.0 tp -117.7 143.59 46.05 Favored 'General case' 0 N--CA 1.497 1.882 0 CA-C-O 121.645 0.736 . . . . 0.0 110.109 -179.443 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 37' ' ' PHE . . . . . . . . . . . . . 82.9 m-85 -105.84 145.62 30.98 Favored 'General case' 0 N--CA 1.494 1.752 0 CA-C-O 121.657 0.741 . . . . 0.0 109.998 -179.858 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 38' ' ' GLY . . . . . 0.426 ' N ' HD21 ' A' ' 44' ' ' LEU . . . -173.55 175.28 46.27 Favored Glycine 0 N--CA 1.487 2.081 0 N-CA-C 109.77 -1.332 . . . . 0.0 109.77 -179.972 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 52.5 p -81.85 -92.28 0.06 Allowed 'General case' 0 N--CA 1.492 1.633 0 O-C-N 121.582 -0.952 . . . . 0.0 109.989 -179.819 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 40' ' ' ASP . . . . . . . . . . . . . 99.8 m-20 -82.24 168.82 17.25 Favored 'General case' 0 N--CA 1.495 1.779 0 O-C-N 121.225 -0.922 . . . . 0.0 110.631 -179.387 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 65.8 tttm -64.04 -38.82 92.46 Favored 'General case' 0 N--CA 1.497 1.908 0 O-C-N 121.652 -0.655 . . . . 0.0 110.514 -179.933 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -56.01 -39.21 71.55 Favored 'General case' 0 N--CA 1.494 1.766 0 O-C-N 121.314 -0.866 . . . . 0.0 109.935 -179.246 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 43' ' ' HIS . . . . . 0.68 ' CE1' ' HZ3' ' A' ' 47' ' ' LYS . 78.1 t60 -66.79 -45.2 79.16 Favored 'General case' 0 N--CA 1.494 1.743 0 O-C-N 121.315 -0.866 . . . . 0.0 109.861 -179.928 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 44' ' ' LEU . . . . . 0.426 HD21 ' N ' ' A' ' 38' ' ' GLY . 81.8 mt -64.69 -41.67 95.87 Favored 'General case' 0 N--CA 1.497 1.91 0 O-C-N 121.382 -0.823 . . . . 0.0 109.955 -179.69 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 71.1 mm-40 -63.91 -38.4 90.93 Favored 'General case' 0 N--CA 1.491 1.593 0 CA-C-O 121.66 0.743 . . . . 0.0 109.573 -179.81 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . -57.86 -54.81 34.45 Favored Glycine 0 N--CA 1.492 2.394 0 N-CA-C 109.823 -1.311 . . . . 0.0 109.823 -179.589 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 47' ' ' LYS . . . . . 0.68 ' HZ3' ' CE1' ' A' ' 43' ' ' HIS . 50.5 mttp -66.29 -37.8 86.27 Favored 'General case' 0 N--CA 1.494 1.755 0 O-C-N 121.497 -1.002 . . . . 0.0 109.761 179.45 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 50.5 tp -49.45 -36.17 21.71 Favored 'General case' 0 N--CA 1.492 1.632 0 O-C-N 121.497 -0.752 . . . . 0.0 109.394 -179.525 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 49' ' ' ALA . . . . . . . . . . . . . . . -55.03 -40.1 69.87 Favored 'General case' 0 N--CA 1.493 1.718 0 O-C-N 121.407 -0.808 . . . . 0.0 109.715 -179.918 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 96.8 mt-10 -67.21 -39.43 86.28 Favored 'General case' 0 N--CA 1.497 1.887 0 O-C-N 121.355 -0.84 . . . . 0.0 109.939 -179.888 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 12.4 m-85 -61.6 -47.41 85.61 Favored 'General case' 0 N--CA 1.496 1.856 0 O-C-N 121.36 -0.837 . . . . 0.0 109.918 -179.556 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 52' ' ' ILE . . . . . . . . . . . . . 96.8 mt -66.17 -43.13 92.15 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.629 0 O-C-N 121.524 -0.735 . . . . 0.0 109.884 -179.619 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 80.5 p -58.93 -43.21 91.14 Favored 'General case' 0 N--CA 1.494 1.769 0 O-C-N 121.371 -0.831 . . . . 0.0 109.498 -179.328 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 54' ' ' LEU . . . . . . . . . . . . . 79.7 mt -64.95 -39.88 94.17 Favored 'General case' 0 N--CA 1.494 1.734 0 O-C-N 121.461 -0.774 . . . . 0.0 109.366 179.358 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -58.56 -42.68 88.48 Favored 'General case' 0 N--CA 1.49 1.546 0 CA-C-O 121.535 0.683 . . . . 0.0 109.595 -179.774 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 56' ' ' LYS . . . . . . . . . . . . . 54.0 mtmt -64.9 -45.31 86.44 Favored 'General case' 0 N--CA 1.492 1.672 0 O-C-N 121.326 -0.859 . . . . 0.0 109.554 179.658 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 99.3 mm-40 -63.47 -44.13 95.33 Favored 'General case' 0 N--CA 1.494 1.736 0 O-C-N 121.589 -0.694 . . . . 0.0 109.64 -179.866 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 58' ' ' VAL . . . . . . . . . . . . . 79.4 t -65.17 -45.43 93.98 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.691 0 O-C-N 121.283 -0.885 . . . . 0.0 109.443 179.823 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 59' ' ' TYR . . . . . . . . . . . . . 82.8 t80 -140.25 120.06 13.45 Favored 'General case' 0 N--CA 1.497 1.881 0 O-C-N 121.272 -0.893 . . . . 0.0 109.589 -179.975 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -68.09 148.1 51.42 Favored 'General case' 0 N--CA 1.491 1.586 0 CA-C-O 121.819 0.818 . . . . 0.0 110.631 -179.717 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 61' ' ' ASN . . . . . . . . . . . . . 8.5 t-20 59.44 40.73 20.42 Favored 'General case' 0 N--CA 1.493 1.68 0 CA-C-O 121.689 0.757 . . . . 0.0 109.693 -179.879 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 62' ' ' VAL . . . . . . . . . . . . . 14.9 p -74.84 139.62 18.85 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.618 0 O-C-N 121.52 -0.737 . . . . 0.0 110.056 179.782 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 63' ' ' GLU . . . . . 0.548 ' OE1' ' N ' ' A' ' 63' ' ' GLU . 56.6 mp0 -109.84 137.15 48.04 Favored 'General case' 0 N--CA 1.495 1.785 0 CA-C-O 121.583 0.706 . . . . 0.0 109.474 -179.656 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 64' ' ' TYR . . . . . . . . . . . . . 53.4 p90 -148.68 163.37 37.51 Favored 'General case' 0 N--CA 1.492 1.643 0 CA-C-O 121.718 0.771 . . . . 0.0 110.252 -179.22 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 44.9 tt0 -141.96 147.81 37.59 Favored 'General case' 0 N--CA 1.494 1.762 0 N-CA-C 108.979 -0.749 . . . . 0.0 108.979 179.711 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 66' ' ' VAL . . . . . . . . . . . . . 92.1 t -120.13 130.19 74.6 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.965 0 CA-C-O 121.654 0.74 . . . . 0.0 110.204 -179.825 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 67' ' ' ALA . . . . . 0.413 ' O ' HG23 ' A' ' 69' ' ' VAL . . . -75.72 152.35 85.01 Favored Pre-proline 0 N--CA 1.485 1.319 0 N-CA-C 109.349 -0.611 . . . . 0.0 109.349 -179.888 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 68' ' ' PRO . . . . . . . . . . . . . 80.4 Cg_exo -42.44 131.39 5.09 Favored 'Trans proline' 0 C--N 1.31 -1.449 0 C-N-CA 122.637 2.224 . . . . 0.0 112.89 179.672 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 69' ' ' VAL . . . . . 0.413 HG23 ' O ' ' A' ' 67' ' ' ALA . 88.3 t -125.32 131.21 72.58 Favored 'Isoleucine or valine' 0 N--CA 1.499 1.985 0 CA-C-O 121.722 0.772 . . . . 0.0 109.978 -179.955 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -76.98 156.33 31.98 Favored 'General case' 0 C--N 1.302 -1.495 0 CA-C-O 121.619 0.723 . . . . 0.0 110.016 179.863 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 71' ' ' ASP . . . . . 0.404 ' O ' ' OD1' ' A' ' 71' ' ' ASP . 62.9 t0 -63.13 -37.77 88.55 Favored 'General case' 0 N--CA 1.493 1.692 0 O-C-N 121.542 -0.724 . . . . 0.0 109.694 179.727 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 72' ' ' ASN . . . . . . . . . . . . . 96.0 m-20 -94.23 13.05 24.62 Favored 'General case' 0 N--CA 1.496 1.846 0 O-C-N 121.226 -0.922 . . . . 0.0 109.171 -179.948 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -60.03 141.82 55.04 Favored 'General case' 0 N--CA 1.493 1.723 0 O-C-N 121.34 -0.85 . . . . 0.0 109.972 -179.696 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 74' ' ' THR . . . . . . . . . . . . . 16.4 p -104.83 0.23 27.86 Favored 'General case' 0 N--CA 1.494 1.73 0 N-CA-C 109.013 -0.736 . . . . 0.0 109.013 179.585 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 84.3 tt0 -144.46 149.84 36.65 Favored 'General case' 0 N--CA 1.494 1.772 0 O-C-N 121.143 -0.973 . . . . 0.0 109.614 179.766 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 6.3 tt -124.47 130.35 52.31 Favored 'General case' 0 N--CA 1.494 1.726 0 CA-C-O 121.325 0.583 . . . . 0.0 109.512 179.885 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 77' ' ' HIS . . . . . . . . . . . . . 96.4 m-70 -107.59 130.76 54.86 Favored 'General case' 0 N--CA 1.495 1.808 0 CA-C-O 121.655 0.74 . . . . 0.0 109.679 -179.711 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -146.15 156.82 43.69 Favored 'General case' 0 N--CA 1.49 1.561 0 O-C-N 121.6 -0.687 . . . . 0.0 109.318 -179.697 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 84.6 mtt85 -129.67 145.91 51.49 Favored 'General case' 0 N--CA 1.495 1.82 0 O-C-N 121.646 -0.659 . . . . 0.0 109.629 -179.62 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 80' ' ' PHE . . . . . . . . . . . . . 92.8 m-85 -129.64 145.92 51.47 Favored 'General case' 0 N--CA 1.495 1.816 0 O-C-N 121.637 -0.664 . . . . 0.0 109.353 -179.862 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 27.6 ttpt -117.04 121.53 41.6 Favored 'General case' 0 N--CA 1.494 1.752 0 CA-C-O 121.507 0.67 . . . . 0.0 109.721 -179.785 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 82' ' ' PHE . . . . . . . . . . . . . 68.8 m-85 -111.42 148.81 32.29 Favored 'General case' 0 N--CA 1.495 1.816 0 CA-C-O 121.637 0.732 . . . . 0.0 109.756 179.784 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 80.6 tt0 -64.16 -31.79 73.12 Favored 'General case' 0 N--CA 1.49 1.555 0 O-C-N 121.733 -0.604 . . . . 0.0 109.521 179.957 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 84' ' ' VAL . . . . . 0.425 HG23 ' H ' ' A' ' 87' ' ' GLU . 27.6 m -134.11 156.48 40.88 Favored 'Isoleucine or valine' 0 N--CA 1.5 2.044 0 O-C-N 121.359 -0.838 . . . . 0.0 110.139 -179.853 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 78.3 p -70.26 -24.02 62.99 Favored 'General case' 0 N--CA 1.492 1.64 0 CA-C-O 121.51 0.672 . . . . 0.0 109.962 179.802 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 86' ' ' ALA . . . . . . . . . . . . . . . -59.21 -46.08 89.4 Favored 'General case' 0 N--CA 1.494 1.736 0 O-C-N 121.316 -0.865 . . . . 0.0 109.663 -179.712 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 87' ' ' GLU . . . . . 0.425 ' H ' HG23 ' A' ' 84' ' ' VAL . 98.4 mt-10 -70.52 -32.43 69.9 Favored 'General case' 0 N--CA 1.495 1.799 0 CA-C-O 121.742 0.782 . . . . 0.0 109.36 179.593 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 88' ' ' LYS . . . . . . . . . . . . . 14.1 tmtt? -61.98 -47.22 85.81 Favored 'General case' 0 C--N 1.301 -1.539 0 O-C-N 121.52 -0.737 . . . . 0.0 110.081 -179.713 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 95.8 mt -64.34 -43.26 95.15 Favored 'General case' 0 N--CA 1.494 1.766 0 O-C-N 121.419 -0.801 . . . . 0.0 109.639 -179.988 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 90' ' ' ILE . . . . . . . . . . . . . 96.9 mt -65.64 -43.54 93.86 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.667 0 CA-C-O 121.569 0.7 . . . . 0.0 109.793 -179.631 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 91' ' ' PHE . . . . . . . . . . . . . 76.5 t80 -61.4 -45.48 94.14 Favored 'General case' 0 N--CA 1.493 1.717 0 O-C-N 121.573 -0.704 . . . . 0.0 110.05 -179.465 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 92' ' ' GLU . . . . . . . . . . . . . 48.2 tp10 -66.01 -45.79 80.25 Favored 'General case' 0 N--CA 1.492 1.659 0 O-C-N 121.334 -0.854 . . . . 0.0 109.595 -179.691 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 93' ' ' LEU . . . . . . . . . . . . . 82.8 mt -64.44 -43.22 94.99 Favored 'General case' 0 N--CA 1.497 1.881 0 O-C-N 121.327 -0.858 . . . . 0.0 109.934 -179.917 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 94' ' ' LYS . . . . . . . . . . . . . 38.0 ttmt -66.57 -44.41 82.32 Favored 'General case' 0 N--CA 1.494 1.75 0 O-C-N 121.356 -0.84 . . . . 0.0 109.956 -179.824 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 20.9 p -66.35 -43.74 85.22 Favored 'General case' 0 N--CA 1.494 1.747 0 O-C-N 121.407 -0.808 . . . . 0.0 109.632 -179.716 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 96' ' ' ARG . . . . . . . . . . . . . 41.6 mmm-85 -65.94 -38.92 89.9 Favored 'General case' 0 N--CA 1.493 1.693 0 O-C-N 121.485 -0.759 . . . . 0.0 109.547 179.97 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 97' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.493 1.712 0 O-C-N 121.525 -0.734 . . . . 0.0 109.581 -179.957 . . . . . . . . 0 0 . 1 . 014 nuclear build core ' A' A ' 30' ' ' ASP . . . . . 0.431 ' OD2' ' O ' ' A' ' 83' ' ' GLU . 98.1 m-20 . . . . . 0 N--CA 1.493 1.683 0 CA-C-O 121.56 0.695 . . . . 0.0 110.262 . . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 31' ' ' VAL . . . . . 0.412 HG11 HH21 ' A' ' 79' ' ' ARG . 9.8 p -128.23 139.24 52.43 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.904 0 N-CA-C 108.717 -0.846 . . . . 0.0 108.717 179.544 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -114.93 153.6 30.26 Favored 'General case' 0 N--CA 1.498 1.958 0 O-C-N 121.633 -0.667 . . . . 0.0 109.353 -179.515 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 33' ' ' GLU . . . . . 0.547 ' N ' ' OE1' ' A' ' 33' ' ' GLU . 55.7 mp0 -103.13 145.56 29.73 Favored 'General case' 0 N--CA 1.495 1.777 0 O-C-N 121.619 -0.676 . . . . 0.0 109.381 -179.438 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 34' ' ' VAL . . . . . . . . . . . . . 46.3 t -126.14 133.75 68.11 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.936 0 N-CA-C 108.85 -0.796 . . . . 0.0 108.85 179.879 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 40.8 t -129.88 131.56 46.1 Favored 'General case' 0 N--CA 1.495 1.806 0 N-CA-C 108.86 -0.793 . . . . 0.0 108.86 179.756 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 44.5 tp -126.01 131.38 52.22 Favored 'General case' 0 N--CA 1.499 2.014 0 O-C-N 121.418 -0.801 . . . . 0.0 108.967 179.717 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 37' ' ' PHE . . . . . . . . . . . . . 93.7 m-85 -115.74 144.99 43.19 Favored 'General case' 0 N--CA 1.497 1.911 0 N-CA-C 109.294 -0.632 . . . . 0.0 109.294 -179.614 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . -174.07 176.94 46.49 Favored Glycine 0 N--CA 1.491 2.301 0 N-CA-C 109.585 -1.406 . . . . 0.0 109.585 179.907 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 34.6 p -61.36 -98.98 0.0 OUTLIER 'General case' 0 C--N 1.301 -1.528 0 O-C-N 121.267 -1.137 . . . . 0.0 110.776 -179.268 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 40' ' ' ASP . . . . . 0.418 ' OD1' ' N ' ' A' ' 41' ' ' LYS . 51.4 t0 -76.84 153.43 34.83 Favored 'General case' 0 N--CA 1.494 1.727 0 CA-C-O 121.71 0.766 . . . . 0.0 110.938 -178.67 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 41' ' ' LYS . . . . . 0.418 ' N ' ' OD1' ' A' ' 40' ' ' ASP . 65.5 tttm -64.97 -35.64 81.84 Favored 'General case' 0 N--CA 1.491 1.597 0 O-C-N 121.614 -0.679 . . . . 0.0 109.978 -179.974 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -55.94 -39.53 71.83 Favored 'General case' 0 N--CA 1.492 1.659 0 O-C-N 121.276 -0.89 . . . . 0.0 109.496 -179.382 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 43' ' ' HIS . . . . . . . . . . . . . 11.7 t-160 -62.97 -38.56 91.6 Favored 'General case' 0 N--CA 1.489 1.494 0 O-C-N 121.307 -0.871 . . . . 0.0 109.127 179.865 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 46.2 mt -61.3 -40.71 95.18 Favored 'General case' 0 N--CA 1.489 1.497 0 O-C-N 121.23 -0.919 . . . . 0.0 109.299 -179.724 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 97.7 mt-10 -62.76 -36.35 82.78 Favored 'General case' 0 N--CA 1.491 1.579 0 O-C-N 121.344 -0.848 . . . . 0.0 109.306 -179.939 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . -60.86 -41.62 99.29 Favored Glycine 0 N--CA 1.492 2.402 0 N-CA-C 109.501 -1.44 . . . . 0.0 109.501 -179.902 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 97.5 mttt -77.37 -25.13 50.65 Favored 'General case' 0 N--CA 1.493 1.702 0 O-C-N 121.118 -1.225 . . . . 0.0 109.687 179.776 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 57.8 tp -61.66 -39.2 90.54 Favored 'General case' 0 N--CA 1.49 1.554 0 O-C-N 121.432 -0.793 . . . . 0.0 109.44 179.975 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 49' ' ' ALA . . . . . . . . . . . . . . . -53.66 -42.2 67.61 Favored 'General case' 0 N--CA 1.491 1.621 0 O-C-N 121.3 -0.875 . . . . 0.0 109.948 -179.315 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 50' ' ' GLU . . . . . 0.476 ' OE1' ' N ' ' A' ' 50' ' ' GLU . 58.2 mp0 -69.96 -42.35 73.31 Favored 'General case' 0 N--CA 1.494 1.742 0 O-C-N 121.236 -0.915 . . . . 0.0 109.84 -179.679 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 51' ' ' TYR . . . . . 0.461 ' CZ ' ' CG2' ' A' ' 95' ' ' THR . 4.3 m-85 -50.85 -49.11 59.63 Favored 'General case' 0 N--CA 1.489 1.516 0 O-C-N 121.138 -0.976 . . . . 0.0 108.779 -179.193 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 52' ' ' ILE . . . . . 0.47 HD13 ' OH ' ' A' ' 64' ' ' TYR . 93.6 mt -65.52 -43.57 94.26 Favored 'Isoleucine or valine' 0 C--N 1.297 -1.675 0 O-C-N 121.57 -0.706 . . . . 0.0 110.066 179.878 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 48.0 t -58.2 -49.51 76.78 Favored 'General case' 0 N--CA 1.493 1.696 0 O-C-N 121.132 -0.98 . . . . 0.0 110.503 -178.583 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 54' ' ' LEU . . . . . 0.654 HD12 ' NZ ' ' A' ' 94' ' ' LYS . 4.3 mm? -64.35 -41.25 96.84 Favored 'General case' 0 N--CA 1.491 1.622 0 O-C-N 121.099 -1.001 . . . . 0.0 109.105 179.554 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -62.78 -36.35 82.82 Favored 'General case' 0 N--CA 1.49 1.527 0 O-C-N 121.382 -0.823 . . . . 0.0 109.531 -179.831 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 56' ' ' LYS . . . . . . . . . . . . . 30.3 mmtm -62.27 -45.56 92.74 Favored 'General case' 0 N--CA 1.492 1.649 0 O-C-N 121.385 -0.822 . . . . 0.0 109.934 -179.963 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 58.5 tt0 -68.87 -41.78 77.92 Favored 'General case' 0 N--CA 1.49 1.554 0 O-C-N 121.242 -0.911 . . . . 0.0 109.625 -179.86 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 58' ' ' VAL . . . . . 0.478 ' CG1' ' OE1' ' A' ' 87' ' ' GLU . 66.8 t -64.09 -45.71 95.77 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.455 0 O-C-N 121.308 -0.87 . . . . 0.0 109.607 179.883 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 59' ' ' TYR . . . . . 0.44 ' O ' ' O ' ' A' ' 60' ' ' ALA . 62.9 t80 -126.89 136.22 52.02 Favored 'General case' 0 N--CA 1.5 2.032 0 O-C-N 121.494 -0.754 . . . . 0.0 109.586 -179.46 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 60' ' ' ALA . . . . . 0.44 ' O ' ' O ' ' A' ' 59' ' ' TYR . . . -48.25 -102.99 0.0 OUTLIER 'General case' 0 N--CA 1.494 1.741 0 O-C-N 121.693 -0.63 . . . . 0.0 110.867 -179.286 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 61' ' ' ASN . . . . . . . . . . . . . 83.2 m-20 -85.51 86.9 7.34 Favored 'General case' 0 N--CA 1.492 1.637 0 O-C-N 121.266 -0.896 . . . . 0.0 109.439 -179.119 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 62' ' ' VAL . . . . . . . . . . . . . 14.7 p -81.72 136.74 22.44 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.585 0 O-C-N 121.333 -0.855 . . . . 0.0 109.687 -179.927 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 96.8 mt-10 -108.45 137.09 46.99 Favored 'General case' 0 N--CA 1.5 2.05 0 O-C-N 121.407 -0.808 . . . . 0.0 108.95 179.842 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 64' ' ' TYR . . . . . 0.47 ' OH ' HD13 ' A' ' 52' ' ' ILE . 48.6 p90 -152.56 164.11 38.27 Favored 'General case' 0 N--CA 1.49 1.565 0 O-C-N 121.226 -0.921 . . . . 0.0 109.511 -179.615 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 79.7 mm-40 -138.81 154.34 48.46 Favored 'General case' 0 N--CA 1.497 1.895 0 N-CA-C 108.756 -0.831 . . . . 0.0 108.756 179.793 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 66' ' ' VAL . . . . . . . . . . . . . 2.7 p -125.75 129.07 72.61 Favored 'Isoleucine or valine' 0 N--CA 1.499 1.989 0 N-CA-C 109.088 -0.708 . . . . 0.0 109.088 -179.735 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -88.03 119.32 70.38 Favored Pre-proline 0 N--CA 1.494 1.76 0 O-C-N 121.378 -0.826 . . . . 0.0 109.014 -179.972 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 68' ' ' PRO . . . . . . . . . . . . . 84.8 Cg_exo -47.74 136.91 21.66 Favored 'Trans proline' 0 N--CA 1.499 1.847 0 C-N-CA 121.824 1.683 . . . . 0.0 112.916 179.687 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 69' ' ' VAL . . . . . . . . . . . . . 3.1 t -133.08 162.19 40.37 Favored 'Isoleucine or valine' 0 N--CA 1.503 2.182 0 O-C-N 121.601 -0.687 . . . . 0.0 109.935 -179.847 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 70' ' ' ALA . . . . . 0.821 ' HB3' ' HB2' ' A' ' 73' ' ' ALA . . . -62.22 145.68 52.9 Favored 'General case' 0 N--CA 1.496 1.844 0 O-C-N 121.378 -0.826 . . . . 0.0 110.087 -179.734 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 90.3 m-20 -70.01 -29.96 67.15 Favored 'General case' 0 N--CA 1.491 1.591 0 O-C-N 121.429 -0.795 . . . . 0.0 109.68 179.502 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 72' ' ' ASN . . . . . . . . . . . . . 98.6 m-20 -94.21 6.07 49.79 Favored 'General case' 0 N--CA 1.491 1.614 0 O-C-N 121.596 -0.69 . . . . 0.0 109.188 -179.882 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 73' ' ' ALA . . . . . 0.821 ' HB2' ' HB3' ' A' ' 70' ' ' ALA . . . -87.92 155.08 20.03 Favored 'General case' 0 N--CA 1.491 1.614 0 N-CA-C 108.644 -0.873 . . . . 0.0 108.644 179.583 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 74' ' ' THR . . . . . 0.634 ' O ' ' OG1' ' A' ' 74' ' ' THR . 0.0 OUTLIER -77.82 16.97 0.61 Allowed 'General case' 0 C--N 1.293 -1.881 0 CA-C-O 117.574 -1.203 . . . . 0.0 112.801 -179.808 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -158.81 165.85 33.29 Favored 'General case' 0 N--CA 1.523 3.179 0 C-N-CA 113.187 -3.405 . . . . 0.0 119.864 -175.045 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 76' ' ' LEU . . . . . 0.489 ' C ' HD23 ' A' ' 76' ' ' LEU . 7.5 tt -139.03 131.7 28.94 Favored 'General case' 0 C--N 1.297 -1.68 0 CA-C-N 109.348 -3.569 . . . . 0.0 104.952 -178.802 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 77' ' ' HIS . . . . . 0.488 ' N ' HD23 ' A' ' 76' ' ' LEU . 82.9 t60 -133.76 135.09 43.69 Favored 'General case' 0 N--CA 1.506 2.332 0 O-C-N 120.476 -1.39 . . . . 0.0 107.411 179.54 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -141.19 167.65 21.67 Favored 'General case' 0 N--CA 1.496 1.845 0 O-C-N 121.223 -0.923 . . . . 0.0 109.558 -178.989 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 79' ' ' ARG . . . . . 0.412 HH21 HG11 ' A' ' 31' ' ' VAL . 84.3 mtp180 -123.31 148.79 45.61 Favored 'General case' 0 N--CA 1.498 1.949 0 N-CA-C 108.625 -0.879 . . . . 0.0 108.625 179.827 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 80' ' ' PHE . . . . . . . . . . . . . 62.6 m-85 -130.06 150.27 51.4 Favored 'General case' 0 N--CA 1.5 2.042 0 N-CA-C 109.131 -0.692 . . . . 0.0 109.131 -179.565 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 35.6 ttpt -106.83 119.51 39.54 Favored 'General case' 0 N--CA 1.496 1.848 0 O-C-N 121.429 -0.794 . . . . 0.0 109.319 -179.975 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 82' ' ' PHE . . . . . . . . . . . . . 56.2 m-85 -128.65 153.23 47.5 Favored 'General case' 0 N--CA 1.501 2.078 0 O-C-N 121.606 -0.684 . . . . 0.0 109.299 -179.982 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 83' ' ' GLU . . . . . 0.431 ' O ' ' OD2' ' A' ' 30' ' ' ASP . 27.2 mm-40 -64.84 -41.96 95.3 Favored 'General case' 0 C--N 1.299 -1.594 0 O-C-N 121.51 -0.744 . . . . 0.0 109.854 -179.13 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 84' ' ' VAL . . . . . . . . . . . . . 2.9 m -136.34 160.78 37.91 Favored 'Isoleucine or valine' 0 N--CA 1.501 2.082 0 O-C-N 121.354 -0.841 . . . . 0.0 110.424 -179.145 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 85' ' ' SER . . . . . 0.522 ' O ' ' N ' ' A' ' 88' ' ' LYS . 11.6 t -63.75 -41.06 98.08 Favored 'General case' 0 N--CA 1.491 1.6 0 O-C-N 121.597 -0.689 . . . . 0.0 110.24 179.553 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 86' ' ' ALA . . . . . . . . . . . . . . . -40.75 -36.19 0.58 Allowed 'General case' 0 N--CA 1.5 2.04 0 O-C-N 121.621 -0.675 . . . . 0.0 110.02 -179.005 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 87' ' ' GLU . . . . . 0.478 ' OE1' ' CG1' ' A' ' 58' ' ' VAL . 70.3 mm-40 -65.71 -37.7 87.15 Favored 'General case' 0 C--N 1.301 -1.5 0 O-C-N 121.353 -0.842 . . . . 0.0 109.077 179.249 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 88' ' ' LYS . . . . . 0.522 ' N ' ' O ' ' A' ' 85' ' ' SER . 28.2 tptp -63.65 -46.38 85.92 Favored 'General case' 0 C--N 1.303 -1.428 0 O-C-N 121.26 -0.9 . . . . 0.0 109.398 179.875 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 89' ' ' LEU . . . . . 0.537 ' N ' HD12 ' A' ' 89' ' ' LEU . 10.8 mp -61.56 -46.95 87.72 Favored 'General case' 0 C--N 1.302 -1.48 0 O-C-N 121.319 -0.863 . . . . 0.0 109.465 -179.301 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 90' ' ' ILE . . . . . . . . . . . . . 96.8 mt -68.18 -44.2 84.37 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.522 0 O-C-N 121.212 -0.93 . . . . 0.0 109.668 179.81 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 91' ' ' PHE . . . . . . . . . . . . . 88.8 t80 -61.39 -46.48 90.01 Favored 'General case' 0 N--CA 1.491 1.599 0 O-C-N 121.395 -0.815 . . . . 0.0 109.54 -179.722 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 92' ' ' GLU . . . . . . . . . . . . . 84.0 tt0 -66.11 -40.02 90.4 Favored 'General case' 0 C--N 1.303 -1.441 0 O-C-N 121.272 -0.893 . . . . 0.0 109.151 179.98 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 93' ' ' LEU . . . . . . . . . . . . . 8.2 tp -62.93 -48.71 77.76 Favored 'General case' 0 N--CA 1.488 1.471 0 O-C-N 121.397 -0.814 . . . . 0.0 109.343 -179.701 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 94' ' ' LYS . . . . . 0.654 ' NZ ' HD12 ' A' ' 54' ' ' LEU . 17.3 ttpp -70.17 -45.36 66.87 Favored 'General case' 0 N--CA 1.491 1.609 0 O-C-N 121.475 -0.766 . . . . 0.0 109.827 179.74 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 95' ' ' THR . . . . . 0.461 ' CG2' ' CZ ' ' A' ' 51' ' ' TYR . 92.2 m -62.11 -44.26 97.04 Favored 'General case' 0 C--N 1.301 -1.523 0 O-C-N 121.558 -0.714 . . . . 0.0 109.419 -179.825 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 96' ' ' ARG . . . . . . . . . . . . . 71.1 ttp85 -57.99 -42.44 85.13 Favored 'General case' 0 N--CA 1.489 1.497 0 O-C-N 121.389 -0.819 . . . . 0.0 109.161 179.803 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 97' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.301 -1.507 0 O-C-N 121.379 -0.826 . . . . 0.0 108.86 179.733 . . . . . . . . 0 0 . 1 . 015 nuclear build core ' A' A ' 30' ' ' ASP . . . . . 0.533 ' OD2' ' NZ ' ' A' ' 81' ' ' LYS . 25.9 p-10 . . . . . 0 N--CA 1.492 1.658 0 N-CA-C 109.373 -0.603 . . . . 0.0 109.373 . . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 53.1 t -116.7 135.28 57.54 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.845 0 CA-C-O 121.499 0.666 . . . . 0.0 109.647 -179.381 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -109.01 156.21 20.01 Favored 'General case' 0 N--CA 1.492 1.637 0 N-CA-C 109.191 -0.67 . . . . 0.0 109.191 179.92 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 99.4 mt-10 -107.1 128.15 54.13 Favored 'General case' 0 N--CA 1.496 1.825 0 O-C-N 121.551 -0.718 . . . . 0.0 110.113 -179.111 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 34' ' ' VAL . . . . . . . . . . . . . 53.2 t -123.45 135.17 64.17 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.693 0 O-C-N 121.618 -0.677 . . . . 0.0 109.343 -179.864 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 28.1 p -132.33 142.35 49.31 Favored 'General case' 0 N--CA 1.495 1.781 0 O-C-N 121.518 -0.739 . . . . 0.0 109.273 179.608 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 36' ' ' LEU . . . . . 0.457 HD21 ' CE2' ' A' ' 51' ' ' TYR . 85.6 mt -125.43 148.9 48.63 Favored 'General case' 0 N--CA 1.496 1.854 0 O-C-N 121.651 -0.656 . . . . 0.0 109.283 179.854 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 37' ' ' PHE . . . . . . . . . . . . . 91.9 m-85 -127.07 144.94 50.9 Favored 'General case' 0 N--CA 1.493 1.686 0 O-C-N 121.757 -0.59 . . . . 0.0 109.588 -179.746 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . 164.86 -156.14 27.93 Favored Glycine 0 N--CA 1.485 1.913 0 N-CA-C 109.926 -1.27 . . . . 0.0 109.926 179.92 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 9.8 m -80.4 -141.53 0.04 OUTLIER 'General case' 0 N--CA 1.49 1.546 0 O-C-N 121.547 -0.972 . . . . 0.0 110.655 -179.325 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 40' ' ' ASP . . . . . 0.407 ' CG ' ' H ' ' A' ' 41' ' ' LYS . 44.9 t0 -54.31 179.0 0.02 OUTLIER 'General case' 0 N--CA 1.488 1.471 0 CA-C-O 121.773 0.797 . . . . 0.0 110.59 -179.008 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 41' ' ' LYS . . . . . 0.407 ' H ' ' CG ' ' A' ' 40' ' ' ASP . 26.9 ttmt -61.28 -39.84 91.91 Favored 'General case' 0 N--CA 1.49 1.566 0 O-C-N 121.702 -0.624 . . . . 0.0 110.378 -179.394 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -47.08 -49.78 21.09 Favored 'General case' 0 N--CA 1.494 1.76 0 O-C-N 121.248 -0.908 . . . . 0.0 110.289 -178.788 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 43' ' ' HIS . . . . . . . . . . . . . 6.0 t60 -61.64 -41.98 98.26 Favored 'General case' 0 N--CA 1.49 1.573 0 O-C-N 121.346 -0.846 . . . . 0.0 109.564 -179.353 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 54.8 mt -63.96 -39.03 93.21 Favored 'General case' 0 N--CA 1.49 1.554 0 O-C-N 121.415 -0.803 . . . . 0.0 109.623 -179.861 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 96.6 mt-10 -58.22 -41.23 83.6 Favored 'General case' 0 N--CA 1.489 1.488 0 O-C-N 121.319 -0.863 . . . . 0.0 109.428 -179.743 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . -62.43 -43.41 99.08 Favored Glycine 0 N--CA 1.489 2.189 0 N-CA-C 109.244 -1.542 . . . . 0.0 109.244 179.972 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 68.6 mttm -65.28 -39.82 93.09 Favored 'General case' 0 N--CA 1.489 1.506 0 O-C-N 121.364 -1.08 . . . . 0.0 109.285 179.466 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 53.5 tp -62.02 -40.37 95.47 Favored 'General case' 0 N--CA 1.489 1.519 0 O-C-N 121.477 -0.764 . . . . 0.0 109.604 -179.545 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 49' ' ' ALA . . . . . . . . . . . . . . . -57.25 -40.84 78.45 Favored 'General case' 0 N--CA 1.49 1.535 0 O-C-N 121.346 -0.846 . . . . 0.0 109.505 -179.156 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 75.4 mt-10 -68.64 -37.41 79.68 Favored 'General case' 0 N--CA 1.489 1.505 0 O-C-N 121.515 -0.741 . . . . 0.0 109.443 179.828 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 51' ' ' TYR . . . . . 0.457 ' CE2' HD21 ' A' ' 36' ' ' LEU . 3.7 m-85 -61.78 -43.69 98.35 Favored 'General case' 0 N--CA 1.491 1.587 0 O-C-N 121.656 -0.652 . . . . 0.0 109.533 -179.34 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 52' ' ' ILE . . . . . . . . . . . . . 93.3 mt -63.71 -42.96 97.77 Favored 'Isoleucine or valine' 0 C--N 1.302 -1.46 0 N-CA-C 108.892 -0.781 . . . . 0.0 108.892 -179.904 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 25.2 m -49.75 -55.31 14.47 Favored 'General case' 0 N--CA 1.49 1.552 0 O-C-N 121.368 -0.832 . . . . 0.0 109.747 -179.529 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 54' ' ' LEU . . . . . 0.483 HD22 ' N ' ' A' ' 54' ' ' LEU . 4.0 mm? -65.17 -38.48 90.67 Favored 'General case' 0 N--CA 1.489 1.512 0 O-C-N 121.438 -0.789 . . . . 0.0 109.101 179.725 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -55.78 -46.82 77.88 Favored 'General case' 0 N--CA 1.488 1.429 0 O-C-N 121.487 -0.758 . . . . 0.0 109.391 -179.517 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 56' ' ' LYS . . . . . . . . . . . . . 66.0 mttm -63.65 -41.3 98.23 Favored 'General case' 0 C--N 1.303 -1.455 0 O-C-N 121.575 -0.703 . . . . 0.0 109.816 179.922 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 98.8 mm-40 -63.12 -47.21 83.75 Favored 'General case' 0 N--CA 1.487 1.417 0 O-C-N 121.448 -0.783 . . . . 0.0 109.607 -179.618 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 58' ' ' VAL . . . . . . . . . . . . . 75.1 t -66.13 -45.16 91.04 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.452 0 O-C-N 121.363 -0.836 . . . . 0.0 109.801 -179.916 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 59' ' ' TYR . . . . . . . . . . . . . 83.4 t80 -140.64 119.83 12.9 Favored 'General case' 0 N--CA 1.496 1.85 0 O-C-N 121.381 -0.825 . . . . 0.0 109.924 -179.528 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -71.66 154.66 41.23 Favored 'General case' 0 N--CA 1.491 1.608 0 O-C-N 121.629 -0.669 . . . . 0.0 110.939 -179.679 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 61' ' ' ASN . . . . . . . . . . . . . 10.4 m120 60.23 35.96 20.89 Favored 'General case' 0 N--CA 1.493 1.68 0 CA-C-O 121.465 0.65 . . . . 0.0 109.286 179.828 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 62' ' ' VAL . . . . . . . . . . . . . 12.4 p -71.89 137.88 22.73 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.491 0 O-C-N 121.548 -0.72 . . . . 0.0 109.912 -179.995 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 84.5 tt0 -113.01 146.04 39.8 Favored 'General case' 0 N--CA 1.492 1.675 0 CA-C-O 121.488 0.661 . . . . 0.0 109.397 -179.768 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 64' ' ' TYR . . . . . . . . . . . . . 53.3 p90 -150.89 162.94 39.82 Favored 'General case' 0 N--CA 1.487 1.413 0 O-C-N 121.295 -0.878 . . . . 0.0 110.047 179.964 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 65' ' ' GLU . . . . . 0.485 ' CD ' ' N ' ' A' ' 66' ' ' VAL . 9.6 tm-20 -142.6 148.8 38.08 Favored 'General case' 0 N--CA 1.489 1.523 0 N-CA-C 108.949 -0.76 . . . . 0.0 108.949 179.5 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 66' ' ' VAL . . . . . 0.485 ' N ' ' CD ' ' A' ' 65' ' ' GLU . 54.5 t -116.41 131.0 70.27 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.55 0 CA-C-O 121.741 0.782 . . . . 0.0 109.846 -179.652 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -84.76 156.65 61.33 Favored Pre-proline 0 C--N 1.306 -1.294 0 N-CA-C 108.811 -0.811 . . . . 0.0 108.811 179.526 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 68' ' ' PRO . . . . . . . . . . . . . 96.6 Cg_exo -43.03 138.72 3.94 Favored 'Trans proline' 0 N--CA 1.493 1.484 0 C-N-CA 122.588 2.192 . . . . 0.0 112.801 179.626 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 69' ' ' VAL . . . . . 0.496 ' C ' ' H ' ' A' ' 71' ' ' ASP . 67.2 t -124.42 134.06 67.71 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.735 0 CA-C-O 121.569 0.699 . . . . 0.0 109.828 -179.448 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 70' ' ' ALA . . . . . 0.655 ' O ' ' N ' ' A' ' 72' ' ' ASN . . . -73.2 35.89 0.08 Allowed 'General case' 0 N--CA 1.487 1.408 0 O-C-N 121.606 -0.684 . . . . 0.0 109.556 179.828 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 71' ' ' ASP . . . . . 0.496 ' H ' ' C ' ' A' ' 69' ' ' VAL . 97.9 m-20 53.39 -73.45 0.01 OUTLIER 'General case' 0 N--CA 1.496 1.827 0 CA-C-O 121.59 0.709 . . . . 0.0 110.059 179.76 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 72' ' ' ASN . . . . . 0.655 ' N ' ' O ' ' A' ' 70' ' ' ALA . 51.7 t30 -86.96 18.41 3.56 Favored 'General case' 0 C--N 1.299 -1.618 0 N-CA-C 108.136 -1.061 . . . . 0.0 108.136 179.492 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 73' ' ' ALA . . . . . 0.518 ' C ' ' H ' ' A' ' 75' ' ' GLU . . . -52.78 -6.96 0.06 Allowed 'General case' 0 N--CA 1.492 1.673 0 N-CA-C 109.274 -0.639 . . . . 0.0 109.274 -179.986 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 74' ' ' THR . . . . . 0.544 HG23 ' O ' ' A' ' 72' ' ' ASN . 6.1 p 61.96 -4.65 0.18 Allowed 'General case' 0 N--CA 1.492 1.674 0 O-C-N 121.625 -0.672 . . . . 0.0 109.624 -179.866 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 75' ' ' GLU . . . . . 0.518 ' H ' ' C ' ' A' ' 73' ' ' ALA . 22.4 pt-20 -149.08 150.44 32.76 Favored 'General case' 0 N--CA 1.49 1.534 0 O-C-N 121.161 -0.962 . . . . 0.0 109.41 179.404 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 6.2 tt -122.72 129.44 51.78 Favored 'General case' 0 N--CA 1.493 1.704 0 CA-C-O 121.566 0.698 . . . . 0.0 109.49 179.647 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 77' ' ' HIS . . . . . . . . . . . . . 97.7 m-70 -97.87 130.7 44.75 Favored 'General case' 0 N--CA 1.488 1.462 0 O-C-N 121.562 -0.711 . . . . 0.0 109.651 -179.658 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -146.64 153.88 40.82 Favored 'General case' 0 N--CA 1.489 1.498 0 O-C-N 121.37 -0.831 . . . . 0.0 109.582 179.939 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 99.6 mtt180 -129.78 148.02 51.61 Favored 'General case' 0 N--CA 1.491 1.582 0 N-CA-C 109.249 -0.648 . . . . 0.0 109.249 -179.949 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 80' ' ' PHE . . . . . . . . . . . . . 30.1 m-85 -126.12 149.92 48.6 Favored 'General case' 0 N--CA 1.493 1.722 0 O-C-N 121.629 -0.669 . . . . 0.0 109.419 -179.777 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 81' ' ' LYS . . . . . 0.533 ' NZ ' ' OD2' ' A' ' 30' ' ' ASP . 63.9 tttp -105.93 124.04 48.94 Favored 'General case' 0 N--CA 1.491 1.58 0 O-C-N 121.548 -0.72 . . . . 0.0 109.323 -179.969 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 82' ' ' PHE . . . . . 0.405 ' CD1' ' OE2' ' A' ' 87' ' ' GLU . 62.2 m-85 -124.95 144.52 50.31 Favored 'General case' 0 N--CA 1.493 1.675 0 CA-C-O 121.594 0.711 . . . . 0.0 109.56 -179.876 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 83.9 tt0 -67.03 -29.22 68.98 Favored 'General case' 0 N--CA 1.488 1.429 0 O-C-N 121.61 -0.681 . . . . 0.0 109.8 -179.627 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 84' ' ' VAL . . . . . 0.435 HG23 ' H ' ' A' ' 87' ' ' GLU . 35.0 m -131.51 150.37 34.08 Favored 'Isoleucine or valine' 0 N--CA 1.499 2.015 0 CA-C-O 121.832 0.825 . . . . 0.0 110.37 -179.483 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 36.9 m -72.6 -32.29 65.85 Favored 'General case' 0 N--CA 1.49 1.528 0 CA-C-O 121.451 0.643 . . . . 0.0 109.586 179.939 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 86' ' ' ALA . . . . . . . . . . . . . . . -54.36 -34.98 62.27 Favored 'General case' 0 N--CA 1.489 1.514 0 O-C-N 121.299 -0.875 . . . . 0.0 108.79 -179.669 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 87' ' ' GLU . . . . . 0.435 ' H ' HG23 ' A' ' 84' ' ' VAL . 80.4 tt0 -65.33 -32.17 73.69 Favored 'General case' 0 C--N 1.303 -1.437 0 N-CA-C 109.096 -0.705 . . . . 0.0 109.096 179.765 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 88' ' ' LYS . . . . . . . . . . . . . 88.8 tttt -63.2 -44.33 95.67 Favored 'General case' 0 N--CA 1.49 1.551 0 O-C-N 121.373 -0.829 . . . . 0.0 109.39 179.975 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 93.9 mt -62.05 -49.27 76.67 Favored 'General case' 0 N--CA 1.491 1.607 0 O-C-N 121.39 -0.818 . . . . 0.0 110.145 -179.217 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 90' ' ' ILE . . . . . 0.535 ' N ' HD12 ' A' ' 90' ' ' ILE . 1.4 mp -70.32 -42.11 78.65 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.582 0 O-C-N 121.366 -0.834 . . . . 0.0 109.403 -179.971 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 91' ' ' PHE . . . . . . . . . . . . . 70.3 t80 -57.45 -45.85 84.27 Favored 'General case' 0 C--N 1.303 -1.445 0 O-C-N 121.406 -0.809 . . . . 0.0 108.886 -179.137 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 92' ' ' GLU . . . . . . . . . . . . . 98.1 mt-10 -68.23 -33.58 74.66 Favored 'General case' 0 C--N 1.301 -1.506 0 N-CA-C 109.116 -0.698 . . . . 0.0 109.116 179.263 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 93' ' ' LEU . . . . . . . . . . . . . 59.0 tp -62.82 -43.19 99.46 Favored 'General case' 0 N--CA 1.488 1.459 0 O-C-N 121.496 -0.753 . . . . 0.0 109.401 -179.736 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 94' ' ' LYS . . . . . . . . . . . . . 67.2 mmtt -65.25 -42.5 93.27 Favored 'General case' 0 N--CA 1.487 1.407 0 O-C-N 121.468 -0.77 . . . . 0.0 109.735 -179.581 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 18.0 p -66.11 -43.06 88.28 Favored 'General case' 0 N--CA 1.488 1.454 0 O-C-N 121.253 -0.904 . . . . 0.0 109.497 -179.732 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 96' ' ' ARG . . . . . . . . . . . . . 17.3 tpp180 -62.61 -44.76 95.49 Favored 'General case' 0 N--CA 1.487 1.388 0 O-C-N 121.305 -0.872 . . . . 0.0 109.396 -179.81 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 97' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.488 1.434 0 N-CA-C 108.778 -0.823 . . . . 0.0 108.778 -179.835 . . . . . . . . 0 0 . 1 . 016 nuclear build core ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 90.7 m-20 . . . . . 0 N--CA 1.487 1.4 0 N-CA-C 109.651 -0.5 . . . . 0.0 109.651 . . . . . . . . . 0 0 . 1 . 016 nuclear build core ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 51.1 t -119.92 133.85 65.33 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.958 0 O-C-N 121.616 -0.678 . . . . 0.0 109.29 -179.828 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -126.65 149.45 49.51 Favored 'General case' 0 N--CA 1.494 1.766 0 CA-C-O 121.505 0.669 . . . . 0.0 109.603 -179.646 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 17.3 pt-20 -91.54 140.14 30.03 Favored 'General case' 0 N--CA 1.49 1.548 0 O-C-N 121.565 -0.709 . . . . 0.0 109.929 -179.577 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 34' ' ' VAL . . . . . 0.46 HG21 ' CD1' ' A' ' 80' ' ' PHE . 48.4 t -130.16 135.42 60.91 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.793 0 N-CA-C 108.566 -0.901 . . . . 0.0 108.566 179.293 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 44.8 t -134.96 142.71 46.55 Favored 'General case' 0 N--CA 1.493 1.709 0 N-CA-C 109.196 -0.668 . . . . 0.0 109.196 179.877 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 36' ' ' LEU . . . . . 0.53 HD21 ' CE2' ' A' ' 51' ' ' TYR . 76.7 mt -119.72 156.75 29.93 Favored 'General case' 0 N--CA 1.498 1.963 0 N-CA-C 109.256 -0.646 . . . . 0.0 109.256 -179.743 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 37' ' ' PHE . . . . . . . . . . . . . 92.4 m-85 -119.48 138.82 52.9 Favored 'General case' 0 N--CA 1.494 1.772 0 N-CA-C 109.445 -0.576 . . . . 0.0 109.445 -179.582 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 38' ' ' GLY . . . . . 0.52 ' N ' HD21 ' A' ' 44' ' ' LEU . . . -178.14 -175.62 45.43 Favored Glycine 0 N--CA 1.486 2.028 0 N-CA-C 109.781 -1.328 . . . . 0.0 109.781 -179.908 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 39' ' ' SER . . . . . 0.514 ' OG ' ' N ' ' A' ' 40' ' ' ASP . 93.7 p -98.93 -77.39 0.52 Allowed 'General case' 0 N--CA 1.494 1.739 0 O-C-N 121.643 -0.916 . . . . 0.0 109.637 179.89 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 40' ' ' ASP . . . . . 0.543 ' OD1' ' N ' ' A' ' 41' ' ' LYS . 58.3 t0 -80.59 156.44 26.43 Favored 'General case' 0 N--CA 1.49 1.558 0 O-C-N 121.322 -0.861 . . . . 0.0 110.015 -179.169 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 41' ' ' LYS . . . . . 0.543 ' N ' ' OD1' ' A' ' 40' ' ' ASP . 4.5 tmtt? -62.26 -42.13 99.06 Favored 'General case' 0 N--CA 1.488 1.44 0 O-C-N 121.316 -0.865 . . . . 0.0 109.757 -179.306 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -55.7 -41.19 73.42 Favored 'General case' 0 N--CA 1.492 1.628 0 O-C-N 120.984 -1.072 . . . . 0.0 110.291 -179.038 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 43' ' ' HIS . . . . . . . . . . . . . 82.0 t60 -61.24 -42.39 98.53 Favored 'General case' 0 C--N 1.301 -1.536 0 O-C-N 121.135 -0.978 . . . . 0.0 109.537 -179.78 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 44' ' ' LEU . . . . . 0.52 HD21 ' N ' ' A' ' 38' ' ' GLY . 84.0 mt -63.4 -40.06 96.19 Favored 'General case' 0 N--CA 1.49 1.534 0 O-C-N 121.346 -0.846 . . . . 0.0 109.838 -179.775 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 96.5 mt-10 -60.83 -37.22 81.29 Favored 'General case' 0 C--N 1.301 -1.516 0 O-C-N 121.197 -0.94 . . . . 0.0 109.139 179.874 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . -62.16 -42.87 99.73 Favored Glycine 0 N--CA 1.489 2.202 0 N-CA-C 109.341 -1.504 . . . . 0.0 109.341 179.855 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 54.9 mtpt -65.48 -36.61 84.39 Favored 'General case' 0 N--CA 1.488 1.454 0 O-C-N 121.312 -1.111 . . . . 0.0 109.577 179.421 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 57.5 tp -60.89 -40.41 92.94 Favored 'General case' 0 N--CA 1.489 1.485 0 O-C-N 121.497 -0.752 . . . . 0.0 109.593 -179.109 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 49' ' ' ALA . . . . . . . . . . . . . . . -56.11 -42.41 76.8 Favored 'General case' 0 C--N 1.302 -1.491 0 O-C-N 121.178 -0.951 . . . . 0.0 109.433 -179.352 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 97.3 mt-10 -66.48 -39.13 88.59 Favored 'General case' 0 C--N 1.302 -1.488 0 O-C-N 121.467 -0.771 . . . . 0.0 109.512 179.834 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 51' ' ' TYR . . . . . 0.53 ' CE2' HD21 ' A' ' 36' ' ' LEU . 4.3 m-85 -62.2 -40.77 97.19 Favored 'General case' 0 N--CA 1.491 1.598 0 O-C-N 121.519 -0.738 . . . . 0.0 109.638 -179.527 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 52' ' ' ILE . . . . . . . . . . . . . 96.8 mt -63.27 -42.61 97.04 Favored 'Isoleucine or valine' 0 C--N 1.298 -1.641 0 O-C-N 121.364 -0.835 . . . . 0.0 109.402 -179.671 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 66.6 m -57.82 -49.99 74.77 Favored 'General case' 0 N--CA 1.491 1.586 0 O-C-N 121.18 -0.95 . . . . 0.0 110.642 -179.022 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 54' ' ' LEU . . . . . 0.448 ' N ' HD22 ' A' ' 54' ' ' LEU . 4.2 mm? -66.05 -41.16 91.2 Favored 'General case' 0 N--CA 1.493 1.683 0 O-C-N 121.05 -1.031 . . . . 0.0 109.495 179.732 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -64.25 -39.14 93.34 Favored 'General case' 0 C--N 1.301 -1.516 0 O-C-N 121.46 -0.775 . . . . 0.0 109.476 -179.512 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 56' ' ' LYS . . . . . . . . . . . . . 88.8 tttt -64.05 -43.98 93.87 Favored 'General case' 0 C--N 1.304 -1.4 0 O-C-N 121.418 -0.801 . . . . 0.0 110.076 -179.478 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 15.5 mm100 -66.54 -41.64 88.41 Favored 'General case' 0 N--CA 1.489 1.497 0 O-C-N 121.236 -0.915 . . . . 0.0 109.635 -179.624 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 58' ' ' VAL . . . . . 0.469 ' CG1' ' OE1' ' A' ' 87' ' ' GLU . 74.7 t -64.92 -45.3 95.21 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.507 0 O-C-N 121.424 -0.797 . . . . 0.0 110.626 -179.27 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 59' ' ' TYR . . . . . . . . . . . . . 83.5 t80 -127.86 129.93 47.74 Favored 'General case' 0 N--CA 1.499 2.0 0 O-C-N 121.499 -0.751 . . . . 0.0 110.111 -178.898 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 60' ' ' ALA . . . . . 0.441 ' O ' ' CG ' ' A' ' 61' ' ' ASN . . . -68.51 154.99 40.81 Favored 'General case' 0 N--CA 1.489 1.478 0 O-C-N 121.59 -0.693 . . . . 0.0 110.234 -179.787 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 61' ' ' ASN . . . . . 0.441 ' CG ' ' O ' ' A' ' 60' ' ' ALA . 12.9 p30 45.4 58.31 4.27 Favored 'General case' 0 N--CA 1.493 1.724 0 CA-C-O 121.749 0.785 . . . . 0.0 109.347 -179.744 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 62' ' ' VAL . . . . . . . . . . . . . 14.7 p -74.09 136.5 25.15 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.458 0 CA-C-O 121.48 0.657 . . . . 0.0 110.211 -179.508 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 96.9 mt-10 -124.44 140.05 53.31 Favored 'General case' 0 N--CA 1.492 1.661 0 N-CA-C 109.248 -0.649 . . . . 0.0 109.248 179.826 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 64' ' ' TYR . . . . . . . . . . . . . 50.7 p90 -149.93 161.79 41.62 Favored 'General case' 0 C--N 1.303 -1.444 0 O-C-N 121.447 -0.783 . . . . 0.0 109.132 -179.854 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 49.4 tp10 -142.57 147.03 35.22 Favored 'General case' 0 N--CA 1.491 1.599 0 N-CA-C 108.66 -0.867 . . . . 0.0 108.66 179.694 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 66' ' ' VAL . . . . . . . . . . . . . 75.5 t -117.45 128.39 74.72 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.699 0 O-C-N 121.763 -0.586 . . . . 0.0 109.563 -179.85 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 67' ' ' ALA . . . . . 0.466 ' HB1' ' HD2' ' A' ' 68' ' ' PRO . . . -81.84 168.29 25.14 Favored Pre-proline 0 N--CA 1.489 1.487 0 O-C-N 121.533 -0.729 . . . . 0.0 109.158 -179.878 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 68' ' ' PRO . . . . . 0.466 ' HD2' ' HB1' ' A' ' 67' ' ' ALA . 51.1 Cg_exo -53.36 131.7 44.7 Favored 'Trans proline' 0 N--CA 1.497 1.717 0 C-N-CA 122.198 1.932 . . . . 0.0 112.537 179.588 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 69' ' ' VAL . . . . . . . . . . . . . 54.4 t -133.75 136.68 53.8 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.872 0 O-C-N 121.613 -0.679 . . . . 0.0 109.632 179.58 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -67.83 150.64 48.34 Favored 'General case' 0 N--CA 1.49 1.534 0 O-C-N 121.54 -0.725 . . . . 0.0 110.489 -179.694 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 96.8 m-20 -63.08 -37.16 86.1 Favored 'General case' 0 N--CA 1.492 1.669 0 O-C-N 121.426 -0.796 . . . . 0.0 109.979 179.904 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 72' ' ' ASN . . . . . . . . . . . . . 20.2 t-20 -86.64 9.33 18.97 Favored 'General case' 0 N--CA 1.493 1.677 0 O-C-N 121.296 -0.877 . . . . 0.0 108.891 -179.916 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -63.24 142.92 58.2 Favored 'General case' 0 N--CA 1.489 1.505 0 O-C-N 121.412 -0.805 . . . . 0.0 110.157 -179.465 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 74' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -105.84 5.54 30.83 Favored 'General case' 0 N--CA 1.493 1.686 0 N-CA-C 108.405 -0.961 . . . . 0.0 108.405 179.245 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 96.8 mt-10 -141.96 160.49 40.1 Favored 'General case' 0 N--CA 1.496 1.835 0 O-C-N 121.402 -0.811 . . . . 0.0 109.141 179.372 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 6.6 tp -129.1 134.09 47.93 Favored 'General case' 0 N--CA 1.496 1.868 0 O-C-N 121.669 -0.645 . . . . 0.0 109.349 179.912 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 77' ' ' HIS . . . . . . . . . . . . . 77.7 m80 -104.94 124.07 48.85 Favored 'General case' 0 N--CA 1.494 1.726 0 CA-C-O 121.425 0.631 . . . . 0.0 109.587 179.688 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -150.66 162.17 41.2 Favored 'General case' 0 N--CA 1.488 1.469 0 O-C-N 121.492 -0.755 . . . . 0.0 109.019 -179.995 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 84.4 mtt85 -128.89 149.54 50.73 Favored 'General case' 0 N--CA 1.493 1.711 0 N-CA-C 109.114 -0.698 . . . . 0.0 109.114 179.872 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 80' ' ' PHE . . . . . 0.46 ' CD1' HG21 ' A' ' 34' ' ' VAL . 34.4 m-85 -128.14 152.1 48.43 Favored 'General case' 0 N--CA 1.494 1.734 0 O-C-N 121.665 -0.647 . . . . 0.0 109.452 -179.821 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 65.7 tttm -107.81 140.21 41.24 Favored 'General case' 0 N--CA 1.492 1.653 0 CA-C-O 121.324 0.583 . . . . 0.0 109.924 -179.373 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 82' ' ' PHE . . . . . . . . . . . . . 82.7 m-85 -141.67 -164.6 1.81 Allowed 'General case' 0 N--CA 1.492 1.67 0 O-C-N 121.52 -0.738 . . . . 0.0 109.404 179.896 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 83.0 tt0 -100.46 -50.56 3.87 Favored 'General case' 0 N--CA 1.492 1.632 0 O-C-N 121.607 -0.683 . . . . 0.0 109.285 179.806 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 84' ' ' VAL . . . . . . . . . . . . . 2.5 m -134.72 164.88 32.82 Favored 'Isoleucine or valine' 0 N--CA 1.499 2.001 0 O-C-N 121.451 -0.781 . . . . 0.0 110.311 -179.534 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 38.1 t -61.87 -19.05 62.21 Favored 'General case' 0 N--CA 1.489 1.523 0 O-C-N 121.755 -0.591 . . . . 0.0 109.61 -179.908 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 86' ' ' ALA . . . . . . . . . . . . . . . -61.45 -37.21 82.73 Favored 'General case' 0 N--CA 1.489 1.487 0 O-C-N 121.241 -0.912 . . . . 0.0 109.618 -179.899 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 87' ' ' GLU . . . . . 0.469 ' OE1' ' CG1' ' A' ' 58' ' ' VAL . 79.6 mm-40 -66.61 -34.99 79.11 Favored 'General case' 0 N--CA 1.49 1.556 0 O-C-N 121.315 -0.865 . . . . 0.0 109.386 -179.916 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 88' ' ' LYS . . . . . . . . . . . . . 88.7 tttt -62.85 -46.48 87.71 Favored 'General case' 0 N--CA 1.49 1.552 0 O-C-N 121.328 -0.858 . . . . 0.0 109.628 -179.791 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 87.1 mt -63.26 -44.38 95.3 Favored 'General case' 0 N--CA 1.488 1.468 0 O-C-N 121.346 -0.846 . . . . 0.0 109.409 -179.669 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 90' ' ' ILE . . . . . . . . . . . . . 97.0 mt -66.55 -45.15 89.47 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.461 0 O-C-N 121.34 -0.85 . . . . 0.0 109.791 -179.954 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 91' ' ' PHE . . . . . . . . . . . . . 86.2 t80 -64.4 -43.41 94.53 Favored 'General case' 0 N--CA 1.489 1.484 0 O-C-N 121.477 -0.764 . . . . 0.0 109.78 -179.919 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 92' ' ' GLU . . . . . . . . . . . . . 47.6 tp10 -59.21 -39.24 82.04 Favored 'General case' 0 N--CA 1.488 1.46 0 O-C-N 121.409 -0.807 . . . . 0.0 108.887 -179.36 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 93' ' ' LEU . . . . . 0.411 ' HA ' ' HE ' ' A' ' 96' ' ' ARG . 5.5 tt -62.96 -43.56 98.47 Favored 'General case' 0 C--N 1.301 -1.529 0 O-C-N 121.434 -0.792 . . . . 0.0 109.633 179.928 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 94' ' ' LYS . . . . . . . . . . . . . 99.2 mttt -64.68 -40.83 96.07 Favored 'General case' 0 N--CA 1.489 1.482 0 O-C-N 121.529 -0.732 . . . . 0.0 109.428 -179.795 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 95' ' ' THR . . . . . 0.506 ' CG2' ' CE2' ' A' ' 51' ' ' TYR . 21.1 p -64.84 -42.97 94.49 Favored 'General case' 0 N--CA 1.49 1.534 0 O-C-N 121.317 -0.864 . . . . 0.0 109.304 -179.914 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 96' ' ' ARG . . . . . 0.411 ' HE ' ' HA ' ' A' ' 93' ' ' LEU . 89.4 mtm180 -63.81 -38.69 92.03 Favored 'General case' 0 N--CA 1.488 1.441 0 O-C-N 121.467 -0.771 . . . . 0.0 109.136 179.483 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 97' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.488 1.473 0 O-C-N 121.369 -0.832 . . . . 0.0 109.686 -179.931 . . . . . . . . 0 0 . 1 . 017 nuclear build core ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 31.6 p30 . . . . . 0 N--CA 1.49 1.537 0 N-CA-C 108.774 -0.824 . . . . 0.0 108.774 . . . . . . . . . 0 0 . 1 . 017 nuclear build core ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 53.5 t -126.02 133.7 68.31 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.864 0 N-CA-C 109.27 -0.641 . . . . 0.0 109.27 179.802 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -138.33 151.19 47.32 Favored 'General case' 0 N--CA 1.492 1.665 0 O-C-N 121.469 -0.769 . . . . 0.0 109.573 179.897 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 15.4 pt-20 -94.21 145.91 24.38 Favored 'General case' 0 N--CA 1.492 1.671 0 O-C-N 121.528 -0.733 . . . . 0.0 109.961 -179.552 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 34' ' ' VAL . . . . . . . . . . . . . 92.7 t -119.36 127.57 75.85 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.789 0 N-CA-C 108.64 -0.874 . . . . 0.0 108.64 179.893 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 26.1 t -117.36 128.0 54.61 Favored 'General case' 0 N--CA 1.494 1.736 0 N-CA-C 109.103 -0.703 . . . . 0.0 109.103 -179.829 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 36' ' ' LEU . . . . . 0.562 HD13 ' CZ ' ' A' ' 51' ' ' TYR . 55.1 tp -124.98 142.66 51.34 Favored 'General case' 0 N--CA 1.497 1.922 0 CA-C-O 121.381 0.61 . . . . 0.0 109.614 -179.996 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 37' ' ' PHE . . . . . . . . . . . . . 92.8 m-85 -104.69 147.01 28.14 Favored 'General case' 0 N--CA 1.493 1.723 0 O-C-N 121.685 -0.634 . . . . 0.0 109.818 179.992 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . -172.9 179.31 44.43 Favored Glycine 0 N--CA 1.488 2.128 0 N-CA-C 109.759 -1.336 . . . . 0.0 109.759 179.748 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 19.0 t -78.52 -99.27 0.02 OUTLIER 'General case' 0 N--CA 1.49 1.562 0 O-C-N 121.476 -1.014 . . . . 0.0 110.05 -179.809 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 40' ' ' ASP . . . . . . . . . . . . . 55.7 p-10 -85.59 175.44 8.78 Favored 'General case' 0 N--CA 1.49 1.573 0 O-C-N 121.424 -0.798 . . . . 0.0 110.453 -179.114 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 88.8 tttt -63.32 -41.96 98.95 Favored 'General case' 0 N--CA 1.491 1.581 0 O-C-N 121.528 -0.733 . . . . 0.0 109.196 179.905 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -53.5 -43.13 68.0 Favored 'General case' 0 N--CA 1.49 1.543 0 O-C-N 121.602 -0.686 . . . . 0.0 109.542 -179.65 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 43' ' ' HIS . . . . . . . . . . . . . 28.8 t-80 -63.21 -44.0 96.57 Favored 'General case' 0 N--CA 1.489 1.509 0 O-C-N 121.468 -0.77 . . . . 0.0 109.306 -179.851 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 84.5 mt -63.6 -39.87 95.48 Favored 'General case' 0 N--CA 1.491 1.575 0 O-C-N 121.52 -0.737 . . . . 0.0 109.306 179.982 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 97.1 mt-10 -59.65 -37.87 79.9 Favored 'General case' 0 N--CA 1.488 1.45 0 O-C-N 121.346 -0.846 . . . . 0.0 109.689 -179.782 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . -64.22 -52.01 47.82 Favored Glycine 0 N--CA 1.492 2.41 0 N-CA-C 109.588 -1.405 . . . . 0.0 109.588 -179.445 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 97.3 mttt -67.04 -32.61 73.92 Favored 'General case' 0 N--CA 1.49 1.54 0 O-C-N 121.395 -1.062 . . . . 0.0 109.376 179.299 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 48' ' ' LEU . . . . . 0.483 HD13 ' CD2' ' A' ' 76' ' ' LEU . 52.6 tp -58.07 -40.74 81.8 Favored 'General case' 0 C--N 1.301 -1.53 0 O-C-N 121.569 -0.707 . . . . 0.0 109.286 -179.341 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 49' ' ' ALA . . . . . . . . . . . . . . . -59.74 -39.43 84.71 Favored 'General case' 0 N--CA 1.488 1.468 0 O-C-N 121.395 -0.816 . . . . 0.0 109.442 -179.597 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 97.8 mt-10 -70.17 -39.21 75.41 Favored 'General case' 0 N--CA 1.49 1.565 0 O-C-N 121.452 -0.78 . . . . 0.0 109.616 179.797 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 51' ' ' TYR . . . . . 0.562 ' CZ ' HD13 ' A' ' 36' ' ' LEU . 4.4 m-85 -61.71 -48.61 79.99 Favored 'General case' 0 N--CA 1.492 1.627 0 O-C-N 121.361 -0.837 . . . . 0.0 109.547 -179.514 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 52' ' ' ILE . . . . . . . . . . . . . 95.4 mt -65.61 -44.45 93.71 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.444 0 O-C-N 121.346 -0.846 . . . . 0.0 109.359 -179.664 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 66.2 m -63.03 -42.07 99.69 Favored 'General case' 0 N--CA 1.488 1.465 0 O-C-N 121.557 -0.715 . . . . 0.0 109.637 -179.705 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 54' ' ' LEU . . . . . . . . . . . . . 56.0 tp -63.59 -42.25 98.28 Favored 'General case' 0 N--CA 1.489 1.48 0 O-C-N 121.497 -0.752 . . . . 0.0 109.329 -179.705 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -62.48 -41.4 98.76 Favored 'General case' 0 N--CA 1.489 1.505 0 O-C-N 121.523 -0.736 . . . . 0.0 109.477 -179.04 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 56' ' ' LYS . . . . . 0.479 ' O ' ' N ' ' A' ' 60' ' ' ALA . 97.8 mttt -64.93 -42.5 94.61 Favored 'General case' 0 C--N 1.302 -1.48 0 O-C-N 121.496 -0.752 . . . . 0.0 110.084 -179.797 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 58.4 tt0 -64.65 -42.03 95.71 Favored 'General case' 0 N--CA 1.49 1.534 0 O-C-N 121.118 -0.989 . . . . 0.0 109.314 -179.597 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 58' ' ' VAL . . . . . . . . . . . . . 71.6 t -68.46 -45.71 81.62 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.517 0 O-C-N 121.443 -0.785 . . . . 0.0 110.124 -179.834 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 59' ' ' TYR . . . . . 0.671 ' O ' ' HB3' ' A' ' 60' ' ' ALA . 53.8 t80 -110.39 -57.18 2.25 Favored 'General case' 0 N--CA 1.496 1.866 0 O-C-N 121.56 -0.713 . . . . 0.0 109.913 -178.818 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 60' ' ' ALA . . . . . 0.671 ' HB3' ' O ' ' A' ' 59' ' ' TYR . . . 82.98 145.22 0.07 Allowed 'General case' 0 N--CA 1.499 2.013 0 CA-C-O 121.27 0.557 . . . . 0.0 109.707 -179.757 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 61' ' ' ASN . . . . . . . . . . . . . 20.7 m-20 59.49 33.46 22.22 Favored 'General case' 0 N--CA 1.491 1.61 0 N-CA-C 108.534 -0.913 . . . . 0.0 108.534 -179.253 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 62' ' ' VAL . . . . . . . . . . . . . 9.9 p -90.97 152.82 3.29 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.655 0 O-C-N 121.577 -0.702 . . . . 0.0 110.343 -179.524 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 96.9 mt-10 -113.43 132.5 55.61 Favored 'General case' 0 N--CA 1.494 1.727 0 N-CA-C 108.892 -0.781 . . . . 0.0 108.892 179.556 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 64' ' ' TYR . . . . . . . . . . . . . 52.4 p90 -142.83 162.22 36.04 Favored 'General case' 0 N--CA 1.489 1.516 0 O-C-N 121.432 -0.792 . . . . 0.0 109.428 -179.58 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 79.6 mm-40 -138.53 157.72 45.63 Favored 'General case' 0 N--CA 1.49 1.526 0 O-C-N 121.53 -0.731 . . . . 0.0 109.041 -179.946 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 66' ' ' VAL . . . . . . . . . . . . . 3.3 p -125.5 132.47 70.92 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.696 0 CA-C-O 121.648 0.737 . . . . 0.0 109.478 -179.6 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 67' ' ' ALA . . . . . 0.542 ' HB1' ' HD2' ' A' ' 68' ' ' PRO . . . -86.27 170.5 12.48 Favored Pre-proline 0 N--CA 1.489 1.501 0 O-C-N 121.527 -0.733 . . . . 0.0 109.381 -179.719 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 68' ' ' PRO . . . . . 0.542 ' HD2' ' HB1' ' A' ' 67' ' ' ALA . 37.1 Cg_exo -54.73 132.38 51.35 Favored 'Trans proline' 0 N--CA 1.494 1.534 0 C-N-CA 122.171 1.914 . . . . 0.0 112.209 179.776 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 69' ' ' VAL . . . . . 0.446 HG21 HD12 ' A' ' 76' ' ' LEU . 55.0 t -130.51 133.29 63.89 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.792 0 CA-C-O 121.479 0.657 . . . . 0.0 109.599 179.664 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -74.07 156.0 37.9 Favored 'General case' 0 N--CA 1.487 1.425 0 CA-C-O 121.635 0.731 . . . . 0.0 110.529 -179.711 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 92.2 m-20 -62.47 -39.78 94.53 Favored 'General case' 0 N--CA 1.492 1.628 0 O-C-N 121.545 -0.722 . . . . 0.0 109.92 -179.94 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 72' ' ' ASN . . . . . . . . . . . . . 90.9 m-20 -95.38 16.14 17.62 Favored 'General case' 0 N--CA 1.495 1.79 0 O-C-N 121.345 -0.847 . . . . 0.0 109.404 -179.396 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -59.06 143.47 48.4 Favored 'General case' 0 N--CA 1.491 1.624 0 O-C-N 121.364 -0.835 . . . . 0.0 110.311 -179.321 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 74' ' ' THR . . . . . . . . . . . . . 61.2 p -105.44 -1.0 25.5 Favored 'General case' 0 N--CA 1.494 1.735 0 N-CA-C 108.876 -0.787 . . . . 0.0 108.876 179.708 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 95.9 mt-10 -138.99 158.34 44.38 Favored 'General case' 0 N--CA 1.493 1.703 0 O-C-N 121.475 -0.766 . . . . 0.0 109.596 -179.734 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 76' ' ' LEU . . . . . 0.483 ' CD2' HD13 ' A' ' 48' ' ' LEU . 6.2 tp -124.78 133.49 53.12 Favored 'General case' 0 N--CA 1.492 1.632 0 O-C-N 121.641 -0.662 . . . . 0.0 109.419 -179.912 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 77' ' ' HIS . . . . . . . . . . . . . 80.8 m80 -112.13 121.12 44.07 Favored 'General case' 0 N--CA 1.491 1.623 0 N-CA-C 109.085 -0.709 . . . . 0.0 109.085 179.556 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -147.1 160.69 42.11 Favored 'General case' 0 N--CA 1.489 1.522 0 O-C-N 121.239 -0.913 . . . . 0.0 109.12 -179.977 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 95.6 mtt180 -126.63 141.97 51.69 Favored 'General case' 0 N--CA 1.494 1.767 0 CA-C-O 121.593 0.711 . . . . 0.0 109.966 -179.715 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 80' ' ' PHE . . . . . . . . . . . . . 42.9 m-85 -128.66 148.53 50.82 Favored 'General case' 0 N--CA 1.493 1.676 0 N-CA-C 109.041 -0.725 . . . . 0.0 109.041 179.819 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 88.3 tttt -104.54 117.07 33.25 Favored 'General case' 0 N--CA 1.492 1.66 0 O-C-N 121.591 -0.693 . . . . 0.0 109.443 -179.757 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 82' ' ' PHE . . . . . . . . . . . . . 65.0 m-85 -112.68 141.78 46.06 Favored 'General case' 0 N--CA 1.494 1.748 0 CA-C-O 121.55 0.691 . . . . 0.0 109.854 -179.889 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 1.4 tm-20 -66.42 -34.19 77.39 Favored 'General case' 0 N--CA 1.488 1.444 0 N-CA-C 109.042 -0.725 . . . . 0.0 109.042 179.484 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 84' ' ' VAL . . . . . 0.448 HG23 ' H ' ' A' ' 87' ' ' GLU . 31.5 m -135.07 161.3 40.21 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.734 0 CA-C-O 121.607 0.717 . . . . 0.0 109.724 -179.784 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 25.0 m -75.67 -20.55 58.35 Favored 'General case' 0 N--CA 1.491 1.576 0 O-C-N 121.586 -0.696 . . . . 0.0 109.61 -179.903 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 86' ' ' ALA . . . . . . . . . . . . . . . -62.09 -39.38 92.25 Favored 'General case' 0 N--CA 1.494 1.726 0 O-C-N 121.333 -0.854 . . . . 0.0 109.633 -179.468 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 87' ' ' GLU . . . . . 0.448 ' H ' HG23 ' A' ' 84' ' ' VAL . 72.8 mm-40 -67.96 -32.28 72.6 Favored 'General case' 0 C--N 1.299 -1.594 0 O-C-N 121.604 -0.685 . . . . 0.0 109.163 -179.814 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 88' ' ' LYS . . . . . . . . . . . . . 4.6 tmtt? -64.36 -49.83 70.09 Favored 'General case' 0 N--CA 1.49 1.539 0 O-C-N 121.288 -0.882 . . . . 0.0 109.069 -179.712 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 17.9 mt -63.64 -44.84 92.68 Favored 'General case' 0 N--CA 1.489 1.519 0 O-C-N 121.276 -0.89 . . . . 0.0 109.662 -179.68 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 90' ' ' ILE . . . . . . . . . . . . . 97.3 mt -66.41 -43.89 90.93 Favored 'Isoleucine or valine' 0 C--N 1.301 -1.521 0 O-C-N 121.579 -0.701 . . . . 0.0 109.425 -179.745 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 91' ' ' PHE . . . . . 0.41 ' O ' HG23 ' A' ' 95' ' ' THR . 81.9 t80 -61.55 -44.93 96.14 Favored 'General case' 0 N--CA 1.49 1.572 0 O-C-N 121.574 -0.704 . . . . 0.0 109.441 -179.588 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 92' ' ' GLU . . . . . . . . . . . . . 80.5 tt0 -62.13 -46.1 90.5 Favored 'General case' 0 N--CA 1.49 1.573 0 O-C-N 121.524 -0.735 . . . . 0.0 109.583 -179.627 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 93' ' ' LEU . . . . . . . . . . . . . 85.3 mt -63.67 -43.44 96.7 Favored 'General case' 0 N--CA 1.491 1.613 0 O-C-N 121.341 -0.849 . . . . 0.0 109.831 -179.537 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 94' ' ' LYS . . . . . . . . . . . . . 55.7 mtpt -65.05 -40.96 95.49 Favored 'General case' 0 C--N 1.302 -1.457 0 O-C-N 121.328 -0.857 . . . . 0.0 109.691 179.863 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 95' ' ' THR . . . . . 0.41 HG23 ' O ' ' A' ' 91' ' ' PHE . 20.6 p -65.27 -35.79 82.1 Favored 'General case' 0 N--CA 1.488 1.471 0 O-C-N 121.385 -0.822 . . . . 0.0 109.493 -179.743 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 96' ' ' ARG . . . . . . . . . . . . . 24.4 mmt180 -63.46 -42.37 98.61 Favored 'General case' 0 C--N 1.3 -1.562 0 O-C-N 121.436 -0.79 . . . . 0.0 109.4 179.638 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 97' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.3 -1.568 0 O-C-N 121.472 -0.767 . . . . 0.0 108.942 179.539 . . . . . . . . 0 0 . 1 . 018 nuclear build core ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 26.2 t0 . . . . . 0 N--CA 1.495 1.792 0 CA-C-O 121.713 0.768 . . . . 0.0 110.716 . . . . . . . . . 0 0 . 1 . 018 nuclear build core ' A' A ' 31' ' ' VAL . . . . . 0.441 HG12 ' N ' ' A' ' 32' ' ' ALA . 20.4 t -125.69 160.98 31.42 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.768 0 O-C-N 121.601 -0.687 . . . . 0.0 109.728 -179.97 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 32' ' ' ALA . . . . . 0.608 ' CB ' ' HZ2' ' A' ' 88' ' ' LYS . . . -128.64 148.61 50.82 Favored 'General case' 0 N--CA 1.495 1.822 0 O-C-N 121.567 -0.708 . . . . 0.0 110.088 -179.555 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 81.1 tt0 -104.24 135.57 45.47 Favored 'General case' 0 N--CA 1.491 1.589 0 O-C-N 121.62 -0.675 . . . . 0.0 109.404 -179.894 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 34' ' ' VAL . . . . . . . . . . . . . 56.0 t -124.98 130.7 73.18 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.816 0 O-C-N 121.617 -0.677 . . . . 0.0 109.188 179.765 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 72.4 m -133.28 121.7 22.81 Favored 'General case' 0 N--CA 1.491 1.588 0 N-CA-C 109.006 -0.739 . . . . 0.0 109.006 179.527 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 50.3 tp -122.03 137.65 54.73 Favored 'General case' 0 N--CA 1.496 1.833 0 CA-C-O 121.416 0.627 . . . . 0.0 109.36 -179.986 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 37' ' ' PHE . . . . . . . . . . . . . 97.0 m-85 -102.92 148.02 26.19 Favored 'General case' 0 N--CA 1.492 1.65 0 O-C-N 121.51 -0.744 . . . . 0.0 109.443 -179.863 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . -170.05 -172.14 36.25 Favored Glycine 0 N--CA 1.49 2.251 0 N-CA-C 109.923 -1.271 . . . . 0.0 109.923 -179.78 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 39' ' ' SER . . . . . 0.505 ' OG ' ' N ' ' A' ' 40' ' ' ASP . 91.9 p -106.55 -82.71 0.54 Allowed 'General case' 0 N--CA 1.497 1.885 0 O-C-N 121.331 -1.1 . . . . 0.0 109.942 -179.774 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 40' ' ' ASP . . . . . 0.505 ' N ' ' OG ' ' A' ' 39' ' ' SER . 30.6 t70 -83.9 161.18 20.93 Favored 'General case' 0 N--CA 1.492 1.639 0 O-C-N 121.248 -0.907 . . . . 0.0 110.773 -179.018 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 65.7 tttm -64.72 -37.05 86.27 Favored 'General case' 0 N--CA 1.492 1.63 0 O-C-N 121.512 -0.742 . . . . 0.0 109.969 179.59 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -56.36 -40.52 74.65 Favored 'General case' 0 N--CA 1.492 1.646 0 O-C-N 121.284 -0.885 . . . . 0.0 110.016 -179.202 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 43' ' ' HIS . . . . . . . . . . . . . 68.2 m80 -66.63 -41.36 88.42 Favored 'General case' 0 N--CA 1.49 1.56 0 O-C-N 121.208 -0.932 . . . . 0.0 109.686 -179.921 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 89.0 mt -63.95 -41.56 97.56 Favored 'General case' 0 N--CA 1.494 1.774 0 O-C-N 121.308 -0.87 . . . . 0.0 109.556 179.944 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 80.6 mm-40 -61.47 -42.06 98.2 Favored 'General case' 0 C--N 1.302 -1.492 0 O-C-N 121.347 -0.845 . . . . 0.0 109.432 -179.696 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . -63.05 -50.76 60.68 Favored Glycine 0 N--CA 1.492 2.414 0 N-CA-C 109.691 -1.363 . . . . 0.0 109.691 -179.655 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 64.7 mttp -65.64 -35.98 82.36 Favored 'General case' 0 N--CA 1.492 1.665 0 O-C-N 121.348 -1.09 . . . . 0.0 109.415 179.545 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 48' ' ' LEU . . . . . 0.501 HD13 ' CD2' ' A' ' 76' ' ' LEU . 53.8 tp -59.6 -38.68 81.88 Favored 'General case' 0 N--CA 1.493 1.714 0 O-C-N 121.538 -0.726 . . . . 0.0 109.498 -179.259 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 49' ' ' ALA . . . . . . . . . . . . . . . -53.15 -32.59 48.44 Favored 'General case' 0 N--CA 1.49 1.556 0 O-C-N 121.177 -0.952 . . . . 0.0 109.789 -179.434 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 73.6 mm-40 -65.31 -40.11 93.33 Favored 'General case' 0 N--CA 1.492 1.645 0 O-C-N 121.203 -0.936 . . . . 0.0 109.423 -179.882 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 51' ' ' TYR . . . . . 0.494 ' CE2' ' CG2' ' A' ' 95' ' ' THR . 31.6 m-85 -62.92 -41.68 99.54 Favored 'General case' 0 N--CA 1.49 1.573 0 O-C-N 121.326 -0.859 . . . . 0.0 109.931 -179.758 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 52' ' ' ILE . . . . . 0.473 HD12 ' CZ ' ' A' ' 64' ' ' TYR . 34.6 mm -63.98 -44.95 98.01 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.641 0 O-C-N 121.14 -0.975 . . . . 0.0 109.482 -179.35 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 76.1 p -65.81 -44.61 85.11 Favored 'General case' 0 N--CA 1.491 1.611 0 O-C-N 121.166 -0.959 . . . . 0.0 110.153 -179.706 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 54' ' ' LEU . . . . . . . . . . . . . 85.2 mt -65.43 -42.23 92.68 Favored 'General case' 0 N--CA 1.493 1.703 0 O-C-N 121.24 -0.913 . . . . 0.0 109.943 -179.636 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -61.16 -49.76 75.92 Favored 'General case' 0 N--CA 1.492 1.648 0 O-C-N 121.408 -0.808 . . . . 0.0 110.702 -178.893 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 56' ' ' LYS . . . . . . . . . . . . . 98.5 mttt -65.11 -43.87 90.58 Favored 'General case' 0 N--CA 1.492 1.627 0 O-C-N 121.188 -0.945 . . . . 0.0 110.056 -179.361 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 59.2 tt0 -65.94 -47.21 75.43 Favored 'General case' 0 N--CA 1.491 1.597 0 O-C-N 121.334 -0.854 . . . . 0.0 109.328 -179.9 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 58' ' ' VAL . . . . . . . . . . . . . 54.6 t -64.97 -45.42 94.73 Favored 'Isoleucine or valine' 0 C--N 1.302 -1.492 0 O-C-N 121.45 -0.781 . . . . 0.0 109.94 -179.926 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 59' ' ' TYR . . . . . . . . . . . . . 54.9 t80 -131.91 124.04 28.66 Favored 'General case' 0 N--CA 1.498 1.964 0 O-C-N 121.365 -0.834 . . . . 0.0 110.042 -179.204 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 60' ' ' ALA . . . . . 0.42 ' O ' ' OD1' ' A' ' 61' ' ' ASN . . . -66.43 148.38 51.96 Favored 'General case' 0 N--CA 1.491 1.59 0 O-C-N 121.688 -0.633 . . . . 0.0 110.902 -179.601 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 61' ' ' ASN . . . . . 0.42 ' OD1' ' O ' ' A' ' 60' ' ' ALA . 7.6 p-10 44.61 52.65 7.59 Favored 'General case' 0 N--CA 1.496 1.829 0 CA-C-O 121.717 0.77 . . . . 0.0 109.425 179.722 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 62' ' ' VAL . . . . . . . . . . . . . 15.0 p -79.09 140.22 17.18 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.499 0 O-C-N 121.635 -0.666 . . . . 0.0 109.911 -179.776 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 96.7 mt-10 -110.1 132.47 54.13 Favored 'General case' 0 N--CA 1.494 1.756 0 CA-C-O 121.58 0.705 . . . . 0.0 109.563 -179.57 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 64' ' ' TYR . . . . . 0.473 ' CZ ' HD12 ' A' ' 52' ' ' ILE . 53.0 p90 -147.99 164.53 33.49 Favored 'General case' 0 N--CA 1.489 1.476 0 O-C-N 121.378 -0.826 . . . . 0.0 109.52 -179.847 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 95.7 mt-10 -139.31 151.95 46.83 Favored 'General case' 0 N--CA 1.492 1.626 0 O-C-N 121.451 -0.781 . . . . 0.0 109.273 179.893 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 66' ' ' VAL . . . . . . . . . . . . . 3.1 p -123.91 130.55 73.84 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.768 0 CA-C-O 121.537 0.684 . . . . 0.0 109.657 -179.493 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 67' ' ' ALA . . . . . 0.609 ' HB1' ' HD2' ' A' ' 68' ' ' PRO . . . -76.7 172.35 9.87 Favored Pre-proline 0 C--N 1.303 -1.448 0 O-C-N 121.683 -0.636 . . . . 0.0 109.68 -179.85 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 68' ' ' PRO . . . . . 0.609 ' HD2' ' HB1' ' A' ' 67' ' ' ALA . 52.5 Cg_exo -54.8 139.07 77.85 Favored 'Trans proline' 0 N--CA 1.498 1.781 0 C-N-CA 122.57 2.18 . . . . 0.0 112.427 179.934 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 69' ' ' VAL . . . . . . . . . . . . . 60.1 t -128.96 132.32 67.46 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.924 0 O-C-N 121.593 -0.692 . . . . 0.0 109.572 179.702 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -87.02 163.49 17.02 Favored 'General case' 0 N--CA 1.489 1.503 0 O-C-N 121.413 -0.804 . . . . 0.0 109.881 -179.968 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 75.4 m-20 -63.25 -40.86 98.6 Favored 'General case' 0 N--CA 1.491 1.59 0 O-C-N 121.385 -0.822 . . . . 0.0 109.543 -179.917 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 72' ' ' ASN . . . . . . . . . . . . . 98.8 m-20 -99.31 19.35 15.62 Favored 'General case' 0 N--CA 1.493 1.71 0 O-C-N 121.423 -0.798 . . . . 0.0 109.372 -179.289 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -54.18 139.35 35.89 Favored 'General case' 0 N--CA 1.491 1.614 0 O-C-N 121.252 -0.905 . . . . 0.0 110.05 -179.279 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 74' ' ' THR . . . . . . . . . . . . . 81.6 p -107.78 -0.98 21.33 Favored 'General case' 0 N--CA 1.494 1.735 0 N-CA-C 108.879 -0.786 . . . . 0.0 108.879 179.6 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 17.3 pt-20 -141.99 160.04 41.02 Favored 'General case' 0 N--CA 1.495 1.813 0 O-C-N 121.208 -0.933 . . . . 0.0 109.34 179.327 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 76' ' ' LEU . . . . . 0.501 ' CD2' HD13 ' A' ' 48' ' ' LEU . 6.6 tp -130.02 130.43 44.96 Favored 'General case' 0 N--CA 1.492 1.657 0 N-CA-C 109.054 -0.721 . . . . 0.0 109.054 179.617 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 77' ' ' HIS . . . . . . . . . . . . . 59.0 t-80 -114.53 113.71 24.79 Favored 'General case' 0 N--CA 1.493 1.676 0 N-CA-C 109.043 -0.725 . . . . 0.0 109.043 179.912 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -135.95 159.37 41.88 Favored 'General case' 0 N--CA 1.493 1.698 0 O-C-N 121.427 -0.796 . . . . 0.0 109.328 -179.778 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 15.9 tpp180 -127.86 141.2 51.62 Favored 'General case' 0 N--CA 1.492 1.641 0 N-CA-C 109.243 -0.651 . . . . 0.0 109.243 -179.764 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 80' ' ' PHE . . . . . . . . . . . . . 52.8 m-85 -126.08 146.62 49.85 Favored 'General case' 0 N--CA 1.494 1.728 0 CA-C-O 121.448 0.642 . . . . 0.0 109.414 -179.883 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 3.3 ttmp? -109.35 127.58 54.44 Favored 'General case' 0 N--CA 1.49 1.53 0 O-C-N 121.753 -0.592 . . . . 0.0 109.551 -179.772 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 82' ' ' PHE . . . . . . . . . . . . . 70.5 m-85 -125.02 147.03 49.15 Favored 'General case' 0 N--CA 1.491 1.616 0 CA-C-O 121.531 0.681 . . . . 0.0 109.607 -179.75 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 83.9 tt0 -67.45 -37.14 82.51 Favored 'General case' 0 C--N 1.302 -1.498 0 O-C-N 121.525 -0.734 . . . . 0.0 109.738 -179.909 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 84' ' ' VAL . . . . . . . . . . . . . 30.1 m -137.02 162.5 34.12 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.876 0 O-C-N 121.258 -0.901 . . . . 0.0 110.467 -179.306 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 74.9 p -69.97 -16.05 63.13 Favored 'General case' 0 N--CA 1.49 1.555 0 O-C-N 121.783 -0.573 . . . . 0.0 110.036 179.747 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 86' ' ' ALA . . . . . . . . . . . . . . . -62.78 -40.85 98.57 Favored 'General case' 0 N--CA 1.495 1.825 0 O-C-N 121.108 -0.995 . . . . 0.0 109.735 -179.623 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 87' ' ' GLU . . . . . 0.53 ' N ' ' OE1' ' A' ' 87' ' ' GLU . 4.9 mp0 -70.2 -30.48 67.6 Favored 'General case' 0 N--CA 1.491 1.624 0 O-C-N 121.411 -0.806 . . . . 0.0 108.848 179.883 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 88' ' ' LYS . . . . . 0.608 ' HZ2' ' CB ' ' A' ' 32' ' ' ALA . 64.6 tttp -62.62 -47.49 83.53 Favored 'General case' 0 C--N 1.3 -1.567 0 O-C-N 121.221 -0.924 . . . . 0.0 109.314 -179.956 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 48.3 tp -64.71 -47.45 78.25 Favored 'General case' 0 N--CA 1.49 1.55 0 O-C-N 121.312 -0.867 . . . . 0.0 109.857 -179.38 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 90' ' ' ILE . . . . . . . . . . . . . 97.0 mt -66.58 -45.07 89.54 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.734 0 O-C-N 121.236 -0.915 . . . . 0.0 109.674 -179.533 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 91' ' ' PHE . . . . . . . . . . . . . 91.2 t80 -64.45 -45.35 87.83 Favored 'General case' 0 N--CA 1.491 1.588 0 O-C-N 121.581 -0.7 . . . . 0.0 110.021 -179.587 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 92' ' ' GLU . . . . . . . . . . . . . 47.1 tp10 -66.25 -37.37 85.34 Favored 'General case' 0 N--CA 1.49 1.544 0 O-C-N 121.334 -0.854 . . . . 0.0 109.63 -179.225 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 93' ' ' LEU . . . . . . . . . . . . . 6.2 tt -62.73 -44.26 96.66 Favored 'General case' 0 C--N 1.3 -1.561 0 O-C-N 121.219 -0.925 . . . . 0.0 109.819 -179.582 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 94' ' ' LYS . . . . . . . . . . . . . 68.0 mttm -65.29 -42.88 92.67 Favored 'General case' 0 N--CA 1.491 1.588 0 O-C-N 121.334 -0.853 . . . . 0.0 110.238 -179.633 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 95' ' ' THR . . . . . 0.494 ' CG2' ' CE2' ' A' ' 51' ' ' TYR . 19.7 p -65.2 -44.23 89.03 Favored 'General case' 0 N--CA 1.492 1.657 0 O-C-N 121.39 -0.819 . . . . 0.0 110.367 -179.048 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 96' ' ' ARG . . . . . . . . . . . . . 83.3 mtp180 -64.4 -39.53 94.03 Favored 'General case' 0 N--CA 1.491 1.597 0 O-C-N 121.176 -0.953 . . . . 0.0 109.659 -179.796 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 97' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 1.545 0 O-C-N 121.291 -0.88 . . . . 0.0 109.911 -179.687 . . . . . . . . 0 0 . 1 . 019 nuclear build core ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 88.4 m-20 . . . . . 0 N--CA 1.497 1.9 0 N-CA-C 109.03 -0.73 . . . . 0.0 109.03 . . . . . . . . . 0 0 . 1 . 019 nuclear build core ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 52.0 t -124.61 134.77 65.9 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.934 0 O-C-N 121.482 -0.761 . . . . 0.0 109.324 -179.946 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -110.14 154.93 22.62 Favored 'General case' 0 N--CA 1.495 1.805 0 CA-C-O 121.695 0.76 . . . . 0.0 109.515 -179.946 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 95.8 mt-10 -87.68 126.48 34.99 Favored 'General case' 0 N--CA 1.489 1.518 0 CA-C-O 121.585 0.707 . . . . 0.0 109.653 -179.621 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 34' ' ' VAL . . . . . . . . . . . . . 53.7 t -124.99 134.99 65.52 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.712 0 CA-C-O 121.748 0.785 . . . . 0.0 109.198 -179.626 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 6.0 p -134.81 140.49 45.91 Favored 'General case' 0 N--CA 1.491 1.58 0 N-CA-C 108.89 -0.781 . . . . 0.0 108.89 179.878 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 36' ' ' LEU . . . . . 0.64 HD13 ' N ' ' A' ' 37' ' ' PHE . 0.2 OUTLIER -121.0 124.04 43.89 Favored 'General case' 0 N--CA 1.494 1.761 0 CA-C-O 121.709 0.766 . . . . 0.0 109.131 -179.662 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 37' ' ' PHE . . . . . 0.64 ' N ' HD13 ' A' ' 36' ' ' LEU . 92.5 m-85 -99.79 146.02 27.05 Favored 'General case' 0 N--CA 1.492 1.656 0 O-C-N 121.506 -0.746 . . . . 0.0 109.777 179.872 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . -178.84 -169.31 39.3 Favored Glycine 0 N--CA 1.489 2.171 0 N-CA-C 109.837 -1.305 . . . . 0.0 109.837 -179.975 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 39' ' ' SER . . . . . 0.494 ' OG ' ' N ' ' A' ' 40' ' ' ASP . 3.0 t -82.23 -99.37 0.04 OUTLIER 'General case' 0 N--CA 1.491 1.606 0 O-C-N 121.634 -0.921 . . . . 0.0 109.91 -179.939 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 40' ' ' ASP . . . . . 0.494 ' N ' ' OG ' ' A' ' 39' ' ' SER . 97.4 m-20 -83.6 178.03 8.15 Favored 'General case' 0 N--CA 1.495 1.811 0 O-C-N 121.165 -0.959 . . . . 0.0 110.696 -179.464 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 87.9 tttt -63.62 -33.14 74.95 Favored 'General case' 0 N--CA 1.493 1.676 0 CA-C-O 121.404 0.621 . . . . 0.0 110.092 -179.795 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -60.53 -38.59 84.94 Favored 'General case' 0 N--CA 1.492 1.663 0 O-C-N 121.161 -0.962 . . . . 0.0 109.725 -179.533 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 43' ' ' HIS . . . . . . . . . . . . . 83.6 m-70 -68.43 -37.38 80.23 Favored 'General case' 0 N--CA 1.492 1.671 0 O-C-N 121.313 -0.867 . . . . 0.0 109.931 179.868 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 97.0 mt -63.61 -42.23 98.23 Favored 'General case' 0 N--CA 1.493 1.724 0 O-C-N 121.514 -0.741 . . . . 0.0 110.27 -178.953 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 98.0 mt-10 -69.69 -38.53 77.03 Favored 'General case' 0 C--N 1.299 -1.607 0 O-C-N 121.205 -0.934 . . . . 0.0 109.637 -179.852 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 46' ' ' GLY . . . . . 0.441 ' O ' ' OE1' ' A' ' 50' ' ' GLU . . . -62.78 -40.85 99.73 Favored Glycine 0 N--CA 1.493 2.435 0 N-CA-C 110.178 -1.169 . . . . 0.0 110.178 -179.644 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 56.7 mtpt -81.29 -21.75 39.1 Favored 'General case' 0 N--CA 1.489 1.485 0 O-C-N 121.365 -1.08 . . . . 0.0 109.316 179.905 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 57.6 tp -65.89 -38.15 88.0 Favored 'General case' 0 N--CA 1.492 1.668 0 O-C-N 121.542 -0.724 . . . . 0.0 109.787 179.838 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 49' ' ' ALA . . . . . . . . . . . . . . . -56.96 -34.74 68.35 Favored 'General case' 0 N--CA 1.493 1.725 0 O-C-N 121.359 -0.838 . . . . 0.0 109.861 -179.179 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 50' ' ' GLU . . . . . 0.564 ' OE1' ' N ' ' A' ' 50' ' ' GLU . 51.8 mp0 -67.28 -40.78 86.19 Favored 'General case' 0 C--N 1.299 -1.609 0 O-C-N 121.348 -0.845 . . . . 0.0 109.549 -179.909 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 51' ' ' TYR . . . . . 0.416 ' CZ ' ' CD2' ' A' ' 36' ' ' LEU . 3.9 m-85 -60.24 -42.83 96.12 Favored 'General case' 0 N--CA 1.492 1.665 0 O-C-N 121.407 -0.808 . . . . 0.0 109.821 -179.642 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 52' ' ' ILE . . . . . . . . . . . . . 95.7 mt -64.13 -42.67 96.3 Favored 'Isoleucine or valine' 0 C--N 1.298 -1.653 0 O-C-N 121.361 -0.837 . . . . 0.0 109.613 -179.676 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 48.4 m -52.92 -51.74 60.23 Favored 'General case' 0 N--CA 1.493 1.695 0 O-C-N 121.364 -0.835 . . . . 0.0 110.012 -178.951 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 54' ' ' LEU . . . . . 0.48 HD12 ' HD3' ' A' ' 94' ' ' LYS . 4.2 mm? -65.31 -40.74 94.14 Favored 'General case' 0 N--CA 1.493 1.713 0 O-C-N 121.255 -0.903 . . . . 0.0 110.076 179.807 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -64.73 -38.37 90.77 Favored 'General case' 0 C--N 1.3 -1.563 0 O-C-N 121.373 -0.83 . . . . 0.0 110.08 -179.336 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 56' ' ' LYS . . . . . . . . . . . . . 45.4 tttp -63.77 -42.74 97.72 Favored 'General case' 0 N--CA 1.489 1.521 0 O-C-N 121.283 -0.886 . . . . 0.0 109.68 -179.683 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 77.0 mt-30 -65.75 -43.71 88.13 Favored 'General case' 0 N--CA 1.494 1.745 0 O-C-N 121.37 -0.831 . . . . 0.0 109.687 -179.765 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 58' ' ' VAL . . . . . . . . . . . . . 79.7 t -65.33 -44.74 94.7 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.675 0 O-C-N 121.383 -0.823 . . . . 0.0 109.518 -179.948 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 59' ' ' TYR . . . . . 0.425 ' O ' ' O ' ' A' ' 60' ' ' ALA . 62.6 t80 -126.66 133.14 51.04 Favored 'General case' 0 N--CA 1.497 1.902 0 CA-C-O 121.866 0.841 . . . . 0.0 109.406 -179.793 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 60' ' ' ALA . . . . . 0.425 ' O ' ' O ' ' A' ' 59' ' ' TYR . . . -44.43 -100.01 0.0 OUTLIER 'General case' 0 N--CA 1.493 1.679 0 CA-C-O 121.645 0.736 . . . . 0.0 111.129 -179.229 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 61' ' ' ASN . . . . . . . . . . . . . 96.1 m-20 -87.11 90.29 8.3 Favored 'General case' 0 N--CA 1.491 1.59 0 O-C-N 121.334 -0.854 . . . . 0.0 109.351 -179.051 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 62' ' ' VAL . . . . . . . . . . . . . 11.0 p -80.15 136.68 22.93 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.552 0 O-C-N 121.571 -0.706 . . . . 0.0 109.768 -179.978 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 84.8 tt0 -113.64 138.39 50.26 Favored 'General case' 0 N--CA 1.495 1.784 0 CA-C-O 121.623 0.725 . . . . 0.0 109.178 -179.854 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 64' ' ' TYR . . . . . . . . . . . . . 50.7 p90 -148.36 162.64 39.14 Favored 'General case' 0 N--CA 1.491 1.614 0 O-C-N 121.413 -0.804 . . . . 0.0 109.962 -179.499 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 49.3 tp10 -139.69 145.73 38.75 Favored 'General case' 0 N--CA 1.493 1.686 0 N-CA-C 108.789 -0.819 . . . . 0.0 108.789 179.623 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 66' ' ' VAL . . . . . . . . . . . . . 27.2 m -115.52 128.03 72.88 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.764 0 CA-C-O 121.768 0.795 . . . . 0.0 110.018 -179.26 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 67' ' ' ALA . . . . . 0.652 ' HB1' ' HD2' ' A' ' 68' ' ' PRO . . . -80.15 171.82 11.41 Favored Pre-proline 0 N--CA 1.488 1.446 0 N-CA-C 109.569 -0.53 . . . . 0.0 109.569 -179.85 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 68' ' ' PRO . . . . . 0.652 ' HD2' ' HB1' ' A' ' 67' ' ' ALA . 51.0 Cg_exo -51.68 129.5 30.11 Favored 'Trans proline' 0 N--CA 1.494 1.54 0 C-N-CA 122.428 2.085 . . . . 0.0 112.309 179.624 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 69' ' ' VAL . . . . . 0.406 HG21 HD12 ' A' ' 76' ' ' LEU . 51.0 t -131.51 134.1 61.05 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.794 0 CA-C-O 121.803 0.811 . . . . 0.0 109.899 179.911 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -73.01 153.07 41.05 Favored 'General case' 0 N--CA 1.49 1.541 0 CA-C-O 121.735 0.779 . . . . 0.0 110.335 -179.992 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 64.6 t0 -63.6 -36.1 82.7 Favored 'General case' 0 N--CA 1.49 1.563 0 CA-C-O 121.591 0.71 . . . . 0.0 109.322 179.308 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 72' ' ' ASN . . . . . . . . . . . . . 56.5 p30 -95.43 19.1 11.39 Favored 'General case' 0 N--CA 1.493 1.709 0 O-C-N 121.266 -0.897 . . . . 0.0 108.722 179.849 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -64.26 143.86 57.57 Favored 'General case' 0 N--CA 1.49 1.538 0 O-C-N 121.435 -0.791 . . . . 0.0 110.358 -179.715 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 74' ' ' THR . . . . . . . . . . . . . 6.3 p -106.18 -0.62 24.45 Favored 'General case' 0 N--CA 1.492 1.673 0 N-CA-C 108.589 -0.893 . . . . 0.0 108.589 179.268 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 80.9 tt0 -141.74 154.42 45.26 Favored 'General case' 0 N--CA 1.494 1.746 0 O-C-N 121.222 -0.924 . . . . 0.0 109.379 179.884 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 76' ' ' LEU . . . . . 0.406 HD12 HG21 ' A' ' 69' ' ' VAL . 6.7 tp -117.03 131.89 56.83 Favored 'General case' 0 N--CA 1.493 1.699 0 O-C-N 121.569 -0.707 . . . . 0.0 109.512 -179.814 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 77' ' ' HIS . . . . . . . . . . . . . 1.0 OUTLIER -105.66 108.33 19.79 Favored 'General case' 0 N--CA 1.493 1.703 0 N-CA-C 109.062 -0.718 . . . . 0.0 109.062 179.846 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -147.01 159.35 43.68 Favored 'General case' 0 N--CA 1.492 1.653 0 O-C-N 121.353 -0.842 . . . . 0.0 109.596 -179.413 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 89.7 mtm-85 -131.8 148.95 52.59 Favored 'General case' 0 N--CA 1.496 1.846 0 O-C-N 121.639 -0.663 . . . . 0.0 109.356 -179.917 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 80' ' ' PHE . . . . . . . . . . . . . 28.3 m-85 -121.61 147.43 45.86 Favored 'General case' 0 N--CA 1.5 2.049 0 CA-C-O 121.669 0.747 . . . . 0.0 109.599 -179.802 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 64.2 tttp -109.26 114.02 27.35 Favored 'General case' 0 N--CA 1.491 1.618 0 CA-C-O 121.732 0.777 . . . . 0.0 109.37 179.903 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 82' ' ' PHE . . . . . . . . . . . . . 82.7 m-85 -100.98 -109.25 0.22 Allowed 'General case' 0 N--CA 1.494 1.725 0 CA-C-O 121.635 0.731 . . . . 0.0 109.561 -179.973 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 47.3 tp10 -168.78 -37.96 0.02 OUTLIER 'General case' 0 N--CA 1.489 1.493 0 N-CA-C 108.539 -0.912 . . . . 0.0 108.539 179.926 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 84' ' ' VAL . . . . . 0.426 HG23 ' H ' ' A' ' 87' ' ' GLU . 27.3 m -133.77 161.94 40.24 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.909 0 O-C-N 121.471 -0.768 . . . . 0.0 109.63 -179.998 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 15.5 m -72.9 -19.63 61.24 Favored 'General case' 0 N--CA 1.491 1.597 0 O-C-N 121.464 -0.773 . . . . 0.0 109.274 179.825 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 86' ' ' ALA . . . . . . . . . . . . . . . -63.43 -39.52 94.7 Favored 'General case' 0 N--CA 1.492 1.634 0 O-C-N 121.215 -0.928 . . . . 0.0 109.714 -179.98 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 87' ' ' GLU . . . . . 0.426 ' H ' HG23 ' A' ' 84' ' ' VAL . 97.0 mt-10 -71.01 -32.26 69.01 Favored 'General case' 0 N--CA 1.493 1.691 0 O-C-N 121.334 -0.854 . . . . 0.0 109.37 179.731 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 88' ' ' LYS . . . . . . . . . . . . . 14.4 tmtt? -62.18 -48.01 81.97 Favored 'General case' 0 C--N 1.302 -1.49 0 O-C-N 121.33 -0.856 . . . . 0.0 110.013 -179.803 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 94.0 mt -64.97 -42.94 94.12 Favored 'General case' 0 N--CA 1.492 1.659 0 O-C-N 121.338 -0.851 . . . . 0.0 109.372 -179.68 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 90' ' ' ILE . . . . . . . . . . . . . 95.1 mt -65.36 -45.45 93.19 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.645 0 CA-C-O 121.737 0.779 . . . . 0.0 109.512 -179.91 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 91' ' ' PHE . . . . . . . . . . . . . 80.9 t80 -66.0 -44.07 85.9 Favored 'General case' 0 N--CA 1.49 1.568 0 CA-C-O 121.724 0.773 . . . . 0.0 109.845 -179.909 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 92' ' ' GLU . . . . . . . . . . . . . 48.4 tp10 -59.97 -38.7 83.28 Favored 'General case' 0 N--CA 1.491 1.61 0 O-C-N 121.445 -0.785 . . . . 0.0 109.469 -179.163 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 93' ' ' LEU . . . . . . . . . . . . . 5.5 tt -63.53 -44.35 94.48 Favored 'General case' 0 C--N 1.297 -1.679 0 O-C-N 121.38 -0.825 . . . . 0.0 109.865 179.974 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 94' ' ' LYS . . . . . 0.48 ' HD3' HD12 ' A' ' 54' ' ' LEU . 62.5 mttp -65.7 -41.64 92.13 Favored 'General case' 0 N--CA 1.492 1.674 0 O-C-N 121.433 -0.792 . . . . 0.0 109.77 -179.878 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 23.4 p -66.59 -38.6 87.38 Favored 'General case' 0 N--CA 1.493 1.688 0 O-C-N 121.315 -0.866 . . . . 0.0 109.653 -179.782 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 96' ' ' ARG . . . . . . . . . . . . . 25.1 mmt180 -65.14 -40.97 95.13 Favored 'General case' 0 N--CA 1.492 1.663 0 O-C-N 121.227 -0.921 . . . . 0.0 109.935 179.739 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 97' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.3 -1.578 0 O-C-N 121.323 -0.861 . . . . 0.0 109.839 -179.688 . . . . . . . . 0 0 . 1 . 020 nuclear build core ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 51.1 p30 . . . . . 0 N--CA 1.488 1.466 0 N-CA-C 109.18 -0.674 . . . . 0.0 109.18 . . . . . . . . . 0 0 . 1 . 020 nuclear build core ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 52.6 t -122.7 135.83 61.48 Favored 'Isoleucine or valine' 0 N--CA 1.502 2.142 0 O-C-N 121.403 -0.811 . . . . 0.0 109.775 -179.609 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -113.83 151.73 31.67 Favored 'General case' 0 N--CA 1.496 1.856 0 CA-C-O 121.42 0.629 . . . . 0.0 109.601 -179.967 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 40.3 tt0 -109.04 145.62 35.29 Favored 'General case' 0 N--CA 1.496 1.867 0 CA-C-O 121.499 0.666 . . . . 0.0 110.266 -179.312 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 34' ' ' VAL . . . . . . . . . . . . . 55.5 t -124.46 131.95 72.03 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.887 0 CA-C-O 121.487 0.661 . . . . 0.0 109.435 179.96 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 56.8 m -108.33 121.83 45.72 Favored 'General case' 0 N--CA 1.496 1.836 0 N-CA-C 109.264 -0.643 . . . . 0.0 109.264 179.542 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 36' ' ' LEU . . . . . 0.445 HD13 ' CZ ' ' A' ' 51' ' ' TYR . 49.5 tp -121.98 135.77 54.88 Favored 'General case' 0 N--CA 1.495 1.793 0 CA-C-O 121.595 0.712 . . . . 0.0 109.656 179.856 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 37' ' ' PHE . . . . . . . . . . . . . 86.1 t80 -113.17 138.12 50.43 Favored 'General case' 0 N--CA 1.494 1.73 0 CA-C-O 121.578 0.704 . . . . 0.0 109.69 -179.851 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 38' ' ' GLY . . . . . 0.45 ' N ' HD21 ' A' ' 44' ' ' LEU . . . -169.11 -170.51 33.79 Favored Glycine 0 N--CA 1.489 2.189 0 N-CA-C 110.15 -1.18 . . . . 0.0 110.15 -179.849 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 32.8 p -82.36 -108.9 0.03 OUTLIER 'General case' 0 N--CA 1.491 1.585 0 O-C-N 121.677 -0.896 . . . . 0.0 110.104 -179.69 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 40' ' ' ASP . . . . . . . . . . . . . 99.4 m-20 -81.05 175.13 10.94 Favored 'General case' 0 N--CA 1.493 1.72 0 O-C-N 121.192 -0.943 . . . . 0.0 110.698 -179.352 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 88.6 tttt -62.71 -41.98 99.42 Favored 'General case' 0 N--CA 1.491 1.624 0 CA-C-O 121.527 0.679 . . . . 0.0 109.966 -179.892 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -54.01 -46.29 71.73 Favored 'General case' 0 N--CA 1.492 1.662 0 O-C-N 121.394 -0.816 . . . . 0.0 109.796 -179.451 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 43' ' ' HIS . . . . . 0.669 ' CE1' ' HZ3' ' A' ' 47' ' ' LYS . 82.9 t60 -66.67 -42.65 86.24 Favored 'General case' 0 N--CA 1.493 1.682 0 O-C-N 121.283 -0.885 . . . . 0.0 109.72 179.829 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 44' ' ' LEU . . . . . 0.45 HD21 ' N ' ' A' ' 38' ' ' GLY . 37.0 mt -63.29 -41.26 98.97 Favored 'General case' 0 N--CA 1.496 1.851 0 O-C-N 121.333 -0.855 . . . . 0.0 109.877 -179.94 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 66.0 mm-40 -62.46 -38.23 88.97 Favored 'General case' 0 N--CA 1.49 1.565 0 O-C-N 121.439 -0.788 . . . . 0.0 109.623 -179.775 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . -59.3 -53.91 42.27 Favored Glycine 0 N--CA 1.494 2.504 0 N-CA-C 109.519 -1.432 . . . . 0.0 109.519 -179.884 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 47' ' ' LYS . . . . . 0.669 ' HZ3' ' CE1' ' A' ' 43' ' ' HIS . 47.6 mttp -66.47 -37.63 85.54 Favored 'General case' 0 N--CA 1.493 1.683 0 O-C-N 121.456 -1.026 . . . . 0.0 109.605 179.02 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 49.0 tp -51.84 -34.07 38.85 Favored 'General case' 0 N--CA 1.494 1.746 0 CA-C-O 121.657 0.742 . . . . 0.0 109.681 -179.373 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 49' ' ' ALA . . . . . . . . . . . . . . . -56.37 -34.46 66.67 Favored 'General case' 0 N--CA 1.491 1.612 0 O-C-N 121.354 -0.841 . . . . 0.0 109.635 -179.698 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 80.5 mm-40 -66.46 -43.16 86.26 Favored 'General case' 0 N--CA 1.495 1.79 0 O-C-N 121.259 -0.9 . . . . 0.0 109.974 -179.923 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 51' ' ' TYR . . . . . 0.445 ' CZ ' HD13 ' A' ' 36' ' ' LEU . 64.0 m-85 -64.1 -44.53 92.02 Favored 'General case' 0 N--CA 1.495 1.816 0 O-C-N 121.325 -0.859 . . . . 0.0 109.872 -179.727 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 52' ' ' ILE . . . . . . . . . . . . . 96.4 mt -65.18 -43.75 95.45 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.732 0 O-C-N 121.287 -0.883 . . . . 0.0 109.677 -179.987 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 60.9 m -61.86 -41.14 97.48 Favored 'General case' 0 N--CA 1.493 1.697 0 O-C-N 121.293 -0.879 . . . . 0.0 109.729 -179.844 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 54' ' ' LEU . . . . . . . . . . . . . 46.6 tp -63.79 -40.98 97.97 Favored 'General case' 0 N--CA 1.491 1.605 0 O-C-N 121.248 -0.907 . . . . 0.0 109.643 -179.988 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -60.12 -40.65 90.46 Favored 'General case' 0 N--CA 1.491 1.604 0 O-C-N 121.378 -0.826 . . . . 0.0 109.392 -179.355 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 56' ' ' LYS . . . . . . . . . . . . . 98.4 mttt -65.19 -41.52 94.48 Favored 'General case' 0 N--CA 1.491 1.582 0 O-C-N 121.456 -0.777 . . . . 0.0 109.551 179.587 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 67.5 tp60 -65.21 -46.33 81.12 Favored 'General case' 0 N--CA 1.493 1.709 0 O-C-N 121.32 -0.862 . . . . 0.0 109.919 -179.399 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 58' ' ' VAL . . . . . . . . . . . . . 88.0 t -65.23 -43.87 95.25 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.572 0 O-C-N 121.199 -0.938 . . . . 0.0 109.118 -179.979 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 59' ' ' TYR . . . . . . . . . . . . . 45.1 t80 -138.54 117.99 12.9 Favored 'General case' 0 N--CA 1.496 1.865 0 O-C-N 121.433 -0.792 . . . . 0.0 109.545 -179.806 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -69.39 149.11 48.73 Favored 'General case' 0 N--CA 1.492 1.64 0 CA-C-O 121.714 0.768 . . . . 0.0 110.625 -179.615 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 61' ' ' ASN . . . . . . . . . . . . . 8.8 t-20 60.09 39.35 19.76 Favored 'General case' 0 N--CA 1.491 1.613 0 CA-C-O 121.779 0.8 . . . . 0.0 109.472 179.806 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 62' ' ' VAL . . . . . . . . . . . . . 14.1 p -76.67 139.15 19.3 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.762 0 O-C-N 121.438 -0.789 . . . . 0.0 110.523 -179.967 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 96.0 mt-10 -106.05 136.09 46.34 Favored 'General case' 0 N--CA 1.497 1.891 0 CA-C-O 121.756 0.789 . . . . 0.0 109.594 179.944 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 64' ' ' TYR . . . . . . . . . . . . . 50.4 p90 -151.03 162.98 39.82 Favored 'General case' 0 N--CA 1.49 1.54 0 O-C-N 121.458 -0.776 . . . . 0.0 109.681 -179.478 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 79.8 mm-40 -139.5 152.45 46.97 Favored 'General case' 0 N--CA 1.495 1.78 0 O-C-N 121.408 -0.808 . . . . 0.0 109.643 179.853 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 66' ' ' VAL . . . . . . . . . . . . . 53.8 t -113.44 129.87 68.45 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.75 0 CA-C-O 121.718 0.771 . . . . 0.0 109.218 -179.679 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 67' ' ' ALA . . . . . 0.454 ' HB1' ' HD2' ' A' ' 68' ' ' PRO . . . -77.06 168.88 24.37 Favored Pre-proline 0 C--N 1.302 -1.486 0 O-C-N 121.727 -0.608 . . . . 0.0 109.766 -179.55 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 68' ' ' PRO . . . . . 0.454 ' HD2' ' HB1' ' A' ' 67' ' ' ALA . 27.8 Cg_exo -59.04 143.25 99.88 Favored 'Trans proline' 0 N--CA 1.493 1.483 0 C-N-CA 122.371 2.047 . . . . 0.0 112.354 179.557 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 69' ' ' VAL . . . . . 0.51 ' C ' ' H ' ' A' ' 71' ' ' ASP . 47.2 t -120.99 132.58 70.12 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.74 0 CA-C-O 121.676 0.751 . . . . 0.0 109.589 -179.856 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 70' ' ' ALA . . . . . 0.62 ' O ' ' N ' ' A' ' 72' ' ' ASN . . . -74.42 30.49 0.08 Allowed 'General case' 0 N--CA 1.491 1.602 0 O-C-N 121.576 -0.703 . . . . 0.0 109.453 179.861 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 71' ' ' ASP . . . . . 0.51 ' H ' ' C ' ' A' ' 69' ' ' VAL . 25.0 t0 55.6 -71.74 0.01 OUTLIER 'General case' 0 N--CA 1.493 1.7 0 CA-C-O 121.625 0.726 . . . . 0.0 110.728 179.658 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 72' ' ' ASN . . . . . 0.62 ' N ' ' O ' ' A' ' 70' ' ' ALA . 64.3 t30 -75.51 -2.15 27.58 Favored 'General case' 0 C--N 1.299 -1.628 0 O-C-N 121.299 -0.876 . . . . 0.0 109.429 -179.723 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -43.95 146.84 0.55 Allowed 'General case' 0 N--CA 1.496 1.843 0 O-C-N 121.306 -0.871 . . . . 0.0 110.125 179.974 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 74' ' ' THR . . . . . . . . . . . . . 5.0 p -96.74 0.15 49.09 Favored 'General case' 0 N--CA 1.492 1.658 0 O-C-N 121.385 -0.822 . . . . 0.0 108.965 -179.922 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 21.6 pt-20 -144.78 156.63 44.15 Favored 'General case' 0 N--CA 1.495 1.782 0 O-C-N 121.133 -0.979 . . . . 0.0 109.862 179.855 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 6.8 tt -126.4 133.26 51.33 Favored 'General case' 0 N--CA 1.492 1.644 0 CA-C-O 121.62 0.724 . . . . 0.0 109.267 -180.0 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 77' ' ' HIS . . . . . . . . . . . . . 73.8 m80 -105.76 129.37 53.97 Favored 'General case' 0 N--CA 1.495 1.819 0 O-C-N 121.626 -0.671 . . . . 0.0 109.639 -179.664 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -140.75 155.87 46.32 Favored 'General case' 0 N--CA 1.494 1.775 0 O-C-N 121.359 -0.838 . . . . 0.0 109.787 -179.774 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 95.7 mtt180 -128.04 147.16 50.51 Favored 'General case' 0 N--CA 1.497 1.876 0 CA-C-O 121.402 0.62 . . . . 0.0 109.83 -179.716 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 80' ' ' PHE . . . . . . . . . . . . . 83.8 m-85 -127.96 148.04 50.5 Favored 'General case' 0 N--CA 1.496 1.871 0 CA-C-O 121.451 0.643 . . . . 0.0 109.568 -179.851 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 63.4 tttp -111.37 127.35 55.63 Favored 'General case' 0 N--CA 1.494 1.739 0 N-CA-C 109.207 -0.664 . . . . 0.0 109.207 179.94 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 82' ' ' PHE . . . . . . . . . . . . . 78.0 m-85 -122.54 145.04 48.69 Favored 'General case' 0 N--CA 1.494 1.746 0 CA-C-O 121.875 0.845 . . . . 0.0 109.649 -179.782 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 32.4 mm-40 -69.46 -32.76 71.89 Favored 'General case' 0 C--N 1.299 -1.608 0 O-C-N 121.751 -0.593 . . . . 0.0 109.638 -179.815 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 84' ' ' VAL . . . . . . . . . . . . . 3.2 m -130.61 157.28 42.98 Favored 'Isoleucine or valine' 0 N--CA 1.499 1.999 0 CA-C-O 121.915 0.864 . . . . 0.0 110.397 -179.427 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 85' ' ' SER . . . . . 0.497 ' O ' ' N ' ' A' ' 88' ' ' LYS . 38.9 t -67.63 -40.2 84.65 Favored 'General case' 0 N--CA 1.492 1.626 0 CA-C-O 121.535 0.683 . . . . 0.0 110.213 179.645 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 86' ' ' ALA . . . . . 0.423 ' C ' ' O ' ' A' ' 85' ' ' SER . . . -40.85 -44.24 2.22 Favored 'General case' 0 N--CA 1.496 1.845 0 O-C-N 121.397 -0.815 . . . . 0.0 110.356 -179.042 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 98.2 mt-10 -66.03 -30.14 70.63 Favored 'General case' 0 C--N 1.299 -1.62 0 O-C-N 121.279 -0.888 . . . . 0.0 110.08 179.895 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 88' ' ' LYS . . . . . 0.497 ' N ' ' O ' ' A' ' 85' ' ' SER . 65.0 tttp -63.38 -46.8 84.8 Favored 'General case' 0 N--CA 1.494 1.727 0 O-C-N 121.068 -1.02 . . . . 0.0 110.062 -179.904 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 89' ' ' LEU . . . . . 0.511 HD22 ' N ' ' A' ' 89' ' ' LEU . 3.6 mm? -63.37 -47.58 81.49 Favored 'General case' 0 N--CA 1.493 1.723 0 O-C-N 121.23 -0.919 . . . . 0.0 110.128 -179.2 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 90' ' ' ILE . . . . . 0.499 ' N ' HD12 ' A' ' 90' ' ' ILE . 1.3 mp -69.19 -43.69 81.3 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.636 0 O-C-N 121.271 -0.893 . . . . 0.0 109.521 179.634 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 91' ' ' PHE . . . . . . . . . . . . . 62.2 t80 -60.37 -46.41 90.04 Favored 'General case' 0 C--N 1.298 -1.651 0 O-C-N 121.456 -0.778 . . . . 0.0 109.869 -179.116 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 92' ' ' GLU . . . . . 0.495 ' OE2' ' NZ ' ' A' ' 88' ' ' LYS . 97.1 mt-10 -67.74 -37.95 82.85 Favored 'General case' 0 N--CA 1.49 1.561 0 O-C-N 121.395 -0.816 . . . . 0.0 109.998 179.903 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 93' ' ' LEU . . . . . . . . . . . . . 6.4 tt -64.05 -46.82 82.71 Favored 'General case' 0 N--CA 1.49 1.575 0 O-C-N 121.129 -0.982 . . . . 0.0 110.156 -179.708 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 94' ' ' LYS . . . . . . . . . . . . . 96.1 mttt -66.91 -45.45 77.89 Favored 'General case' 0 N--CA 1.495 1.794 0 O-C-N 121.383 -0.823 . . . . 0.0 110.2 179.996 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 21.5 p -67.44 -41.47 84.71 Favored 'General case' 0 N--CA 1.492 1.665 0 O-C-N 121.23 -0.919 . . . . 0.0 109.61 -179.698 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 96' ' ' ARG . . . . . 0.435 ' CG ' ' O ' ' A' ' 92' ' ' GLU . 8.0 mmp_? -64.38 -43.81 93.3 Favored 'General case' 0 N--CA 1.49 1.565 0 O-C-N 121.221 -0.924 . . . . 0.0 109.698 179.825 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 97' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.3 -1.55 0 CA-C-O 121.771 0.796 . . . . 0.0 109.204 179.767 . . . . . . . . 0 0 . 1 . 001 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 96.9 mtp . . . . . 0 N--CA 1.49 1.562 0 N-CA-C 108.731 -0.841 . . . . 0.0 108.731 . . . . . . . . . 0 0 . 1 . 001 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 48.2 t -63.72 143.46 57.82 Favored 'General case' 0 N--CA 1.492 1.669 0 CA-C-O 121.811 0.815 . . . . 0.0 110.326 -179.532 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 3' ' ' ASN . . . . . . . . . . . . . 61.1 m-20 -64.48 -40.51 95.8 Favored 'General case' 0 N--CA 1.491 1.576 0 N-CA-C 109.462 -0.57 . . . . 0.0 109.462 -179.732 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 15.1 pt20 -82.04 142.66 32.15 Favored 'General case' 0 N--CA 1.494 1.744 0 CA-C-O 121.687 0.756 . . . . 0.0 110.31 -179.253 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 62.6 p -78.08 165.61 23.79 Favored 'General case' 0 N--CA 1.489 1.518 0 CA-C-O 121.767 0.794 . . . . 0.0 110.544 -179.449 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 2.5 p -178.75 72.14 0.02 OUTLIER 'General case' 0 N--CA 1.492 1.639 0 CA-C-O 121.533 0.682 . . . . 0.0 109.257 179.613 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 7' ' ' VAL . . . . . 0.422 ' O ' HG23 ' A' ' 7' ' ' VAL . 24.5 m -88.68 128.97 40.53 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.866 0 CA-C-O 121.727 0.775 . . . . 0.0 109.719 179.94 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 81.2 tt0 -90.06 113.16 24.82 Favored 'General case' 0 N--CA 1.494 1.772 0 CA-C-O 121.761 0.791 . . . . 0.0 109.638 -179.617 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 59.6 t-20 -96.23 -67.4 0.85 Allowed 'General case' 0 N--CA 1.495 1.791 0 N-CA-C 109.278 -0.638 . . . . 0.0 109.278 179.857 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 97.7 mt-10 41.53 -120.9 0.49 Allowed 'General case' 0 N--CA 1.494 1.757 0 CA-C-O 121.515 0.674 . . . . 0.0 110.421 -179.695 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 35.3 m -79.87 140.83 16.16 Favored 'Isoleucine or valine' 0 C--N 1.304 -1.383 0 CA-C-O 121.876 0.846 . . . . 0.0 110.512 -179.061 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 12' ' ' CYS . . . . . 0.415 ' O ' ' O ' ' A' ' 13' ' ' GLU . 4.9 p -145.66 155.88 43.29 Favored 'General case' 0 N--CA 1.49 1.542 0 CA-C-O 121.803 0.811 . . . . 0.0 109.705 179.547 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 13' ' ' GLU . . . . . 0.415 ' O ' ' O ' ' A' ' 12' ' ' CYS . 97.7 mt-10 42.35 -167.89 0.01 OUTLIER 'General case' 0 N--CA 1.491 1.599 0 CA-C-O 121.807 0.813 . . . . 0.0 110.956 179.94 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 14' ' ' ALA . . . . . 0.507 ' O ' ' N ' ' A' ' 16' ' ' GLY . . . 62.24 133.26 0.01 OUTLIER 'General case' 0 N--CA 1.489 1.492 0 CA-C-O 121.586 0.707 . . . . 0.0 110.467 -179.906 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 34.9 m 45.32 16.64 0.02 OUTLIER 'General case' 0 N--CA 1.491 1.591 0 CA-C-O 121.432 0.634 . . . . 0.0 109.531 -179.963 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 16' ' ' GLY . . . . . 0.507 ' N ' ' O ' ' A' ' 14' ' ' ALA . . . -84.41 -3.7 88.39 Favored Glycine 0 N--CA 1.493 2.461 0 N-CA-C 109.343 -1.503 . . . . 0.0 109.343 -179.931 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 37.8 m 44.45 25.92 0.15 Allowed 'General case' 0 N--CA 1.493 1.722 0 O-C-N 121.9 -0.765 . . . . 0.0 109.674 -179.87 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -65.0 99.95 0.39 Allowed 'General case' 0 N--CA 1.49 1.538 0 CA-C-O 121.727 0.775 . . . . 0.0 109.947 -179.968 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 79.8 175.81 48.52 Favored Glycine 0 N--CA 1.49 2.249 0 N-CA-C 110.739 -0.944 . . . . 0.0 110.739 179.02 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 49.0 tp10 -155.79 -34.63 0.09 Allowed 'General case' 0 N--CA 1.49 1.533 0 N-CA-C 108.778 -0.823 . . . . 0.0 108.778 179.654 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 21' ' ' ILE . . . . . . . . . . . . . 38.1 pt -87.35 139.56 17.15 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.95 0 CA-C-O 121.93 0.871 . . . . 0.0 110.521 -179.491 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . -84.81 129.52 9.28 Favored Glycine 0 N--CA 1.489 2.182 0 N-CA-C 110.164 -1.174 . . . . 0.0 110.164 -179.379 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 23' ' ' PHE . . . . . . . . . . . . . 92.4 t80 -148.01 -33.36 0.25 Allowed 'General case' 0 N--CA 1.493 1.696 0 O-C-N 121.846 -0.796 . . . . 0.0 109.077 179.544 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 8.9 pt -80.27 164.03 3.25 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.81 0 CA-C-O 121.748 0.785 . . . . 0.0 110.774 -179.652 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 25' ' ' ILE . . . . . . . . . . . . . 96.2 mt -72.88 132.96 32.68 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.337 0 CA-C-O 121.733 0.778 . . . . 0.0 110.421 -179.248 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 71.4 ttp85 -55.19 132.22 47.12 Favored 'General case' 0 N--CA 1.49 1.534 0 CA-C-O 121.817 0.817 . . . . 0.0 110.272 -179.33 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 16.7 pt-20 -67.2 144.05 56.2 Favored 'General case' 0 N--CA 1.49 1.551 0 CA-C-O 121.762 0.791 . . . . 0.0 110.357 -179.478 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . -177.19 175.65 47.73 Favored Glycine 0 N--CA 1.489 2.2 0 N-CA-C 110.147 -1.181 . . . . 0.0 110.147 179.856 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 37.1 p-10 -68.15 -21.02 64.93 Favored 'General case' 0 N--CA 1.49 1.571 0 O-C-N 121.806 -0.82 . . . . 0.0 109.572 -179.748 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 83.3 m-20 -90.37 9.05 30.47 Favored 'General case' 0 N--CA 1.494 1.76 0 O-C-N 121.505 -0.747 . . . . 0.0 109.005 179.83 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 51.3 t -124.8 136.1 61.83 Favored 'Isoleucine or valine' 0 N--CA 1.499 2.016 0 CA-C-O 121.728 0.775 . . . . 0.0 109.712 179.886 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -123.9 148.1 47.12 Favored 'General case' 0 N--CA 1.496 1.861 0 CA-C-O 121.86 0.838 . . . . 0.0 109.913 -179.961 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 96.7 mt-10 -104.42 142.01 35.33 Favored 'General case' 0 N--CA 1.496 1.85 0 CA-C-O 121.737 0.78 . . . . 0.0 109.984 -179.702 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 34' ' ' VAL . . . . . . . . . . . . . 55.5 t -125.89 132.84 70.24 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.769 0 CA-C-O 121.638 0.732 . . . . 0.0 109.331 -179.967 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 45.5 t -126.24 110.73 13.76 Favored 'General case' 0 N--CA 1.494 1.761 0 CA-C-O 121.678 0.752 . . . . 0.0 109.61 179.778 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 36' ' ' LEU . . . . . 0.544 HD13 ' OH ' ' A' ' 51' ' ' TYR . 51.4 tp -121.98 146.64 46.96 Favored 'General case' 0 N--CA 1.497 1.886 0 CA-C-O 121.818 0.818 . . . . 0.0 109.512 179.827 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 37' ' ' PHE . . . . . . . . . . . . . 41.7 p90 -141.87 155.77 45.53 Favored 'General case' 0 N--CA 1.492 1.648 0 CA-C-O 121.781 0.801 . . . . 0.0 110.293 -179.714 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . -166.66 -155.41 8.94 Favored Glycine 0 N--CA 1.491 2.312 0 N-CA-C 110.482 -1.047 . . . . 0.0 110.482 -179.579 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 39' ' ' SER . . . . . 0.491 ' OG ' ' CG ' ' A' ' 43' ' ' HIS . 74.3 p -63.24 -41.88 99.13 Favored 'General case' 0 N--CA 1.496 1.862 0 O-C-N 122.027 -0.69 . . . . 0.0 110.129 -179.103 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 40' ' ' ASP . . . . . . . . . . . . . 53.3 p-10 -171.62 -168.18 0.58 Allowed 'General case' 0 N--CA 1.491 1.586 0 CA-C-O 121.788 0.804 . . . . 0.0 110.01 179.769 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 28.3 tptp -62.43 -45.55 92.59 Favored 'General case' 0 C--N 1.303 -1.452 0 O-C-N 121.727 -0.608 . . . . 0.0 110.09 -179.265 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -50.41 -51.57 45.23 Favored 'General case' 0 N--CA 1.494 1.773 0 O-C-N 121.68 -0.637 . . . . 0.0 110.533 -178.358 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 43' ' ' HIS . . . . . 0.491 ' CG ' ' OG ' ' A' ' 39' ' ' SER . 32.0 m80 -67.01 -37.35 84.01 Favored 'General case' 0 N--CA 1.495 1.782 0 O-C-N 121.441 -0.787 . . . . 0.0 110.115 -179.242 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 18.0 mt -63.58 -40.3 96.6 Favored 'General case' 0 N--CA 1.493 1.702 0 O-C-N 121.358 -0.839 . . . . 0.0 109.427 -179.467 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 96.0 mt-10 -61.56 -42.21 98.5 Favored 'General case' 0 N--CA 1.489 1.511 0 N-CA-C 109.036 -0.727 . . . . 0.0 109.036 -179.857 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . -64.55 -48.08 77.04 Favored Glycine 0 N--CA 1.494 2.542 0 N-CA-C 109.584 -1.406 . . . . 0.0 109.584 179.931 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 63.0 mttp -66.97 -33.9 76.59 Favored 'General case' 0 N--CA 1.493 1.698 0 O-C-N 121.712 -0.876 . . . . 0.0 108.995 179.641 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 58.7 tp -59.46 -40.23 86.21 Favored 'General case' 0 C--N 1.303 -1.423 0 N-CA-C 109.503 -0.555 . . . . 0.0 109.503 -178.965 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 49' ' ' ALA . . . . . . . . . . . . . . . -55.97 -39.97 72.56 Favored 'General case' 0 N--CA 1.491 1.618 0 O-C-N 121.563 -0.71 . . . . 0.0 109.23 -179.468 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 97.8 mt-10 -68.33 -39.75 81.83 Favored 'General case' 0 N--CA 1.492 1.659 0 O-C-N 121.62 -0.675 . . . . 0.0 109.419 179.791 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 51' ' ' TYR . . . . . 0.576 ' CE2' ' CG2' ' A' ' 95' ' ' THR . 4.3 m-85 -59.13 -40.69 86.24 Favored 'General case' 0 N--CA 1.494 1.763 0 O-C-N 121.536 -0.727 . . . . 0.0 109.145 -179.432 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 52' ' ' ILE . . . . . 0.565 ' CG2' ' HZ2' ' A' ' 56' ' ' LYS . 95.5 mt -63.98 -42.52 96.01 Favored 'Isoleucine or valine' 0 C--N 1.301 -1.518 0 N-CA-C 109.134 -0.691 . . . . 0.0 109.134 -179.844 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 49.4 m -53.23 -45.99 68.94 Favored 'General case' 0 N--CA 1.493 1.695 0 O-C-N 121.714 -0.616 . . . . 0.0 109.463 -179.0 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 54' ' ' LEU . . . . . 0.407 ' N ' ' CD2' ' A' ' 54' ' ' LEU . 4.0 mm? -64.73 -39.81 94.26 Favored 'General case' 0 C--N 1.3 -1.556 0 O-C-N 121.763 -0.586 . . . . 0.0 109.453 179.168 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -59.13 -49.48 77.73 Favored 'General case' 0 N--CA 1.49 1.573 0 CA-C-O 121.202 0.525 . . . . 0.0 109.769 -179.019 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 56' ' ' LYS . . . . . 0.565 ' HZ2' ' CG2' ' A' ' 52' ' ' ILE . 62.2 mttp -64.6 -39.66 94.11 Favored 'General case' 0 N--CA 1.49 1.564 0 O-C-N 121.6 -0.688 . . . . 0.0 109.359 179.715 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 51.5 tt0 -62.15 -49.19 76.85 Favored 'General case' 0 N--CA 1.489 1.494 0 O-C-N 121.73 -0.606 . . . . 0.0 109.375 -179.433 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 58' ' ' VAL . . . . . . . . . . . . . 72.8 t -66.49 -44.45 90.34 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.587 0 O-C-N 121.761 -0.587 . . . . 0.0 109.795 -179.731 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 59' ' ' TYR . . . . . . . . . . . . . 51.3 t80 -135.75 125.19 24.96 Favored 'General case' 0 N--CA 1.498 1.946 0 CA-C-O 121.918 0.866 . . . . 0.0 110.024 -179.421 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -71.45 144.77 49.61 Favored 'General case' 0 N--CA 1.492 1.629 0 CA-C-O 121.57 0.7 . . . . 0.0 110.73 -179.588 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 61' ' ' ASN . . . . . . . . . . . . . 88.7 m-20 57.29 37.44 28.18 Favored 'General case' 0 N--CA 1.493 1.702 0 CA-C-O 121.544 0.688 . . . . 0.0 109.156 179.603 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 62' ' ' VAL . . . . . . . . . . . . . 10.3 p -67.63 138.73 22.13 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.509 0 CA-C-O 121.709 0.766 . . . . 0.0 110.194 -179.643 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 97.3 mt-10 -108.91 142.74 39.09 Favored 'General case' 0 N--CA 1.495 1.813 0 CA-C-O 121.726 0.774 . . . . 0.0 109.671 -179.466 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 64' ' ' TYR . . . . . . . . . . . . . 49.9 p90 -151.22 161.91 41.86 Favored 'General case' 0 N--CA 1.492 1.639 0 CA-C-O 121.936 0.874 . . . . 0.0 110.486 -179.993 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 80.5 tt0 -144.24 145.55 32.12 Favored 'General case' 0 N--CA 1.493 1.721 0 CA-C-O 121.511 0.672 . . . . 0.0 109.426 179.959 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 66' ' ' VAL . . . . . . . . . . . . . 30.8 m -120.71 129.99 75.04 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.903 0 CA-C-O 121.999 0.904 . . . . 0.0 110.266 -179.646 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 67' ' ' ALA . . . . . 0.558 ' HB1' ' HD2' ' A' ' 68' ' ' PRO . . . -78.57 170.74 14.82 Favored Pre-proline 0 C--N 1.301 -1.501 0 CA-C-N 115.976 -0.556 . . . . 0.0 109.506 179.925 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 68' ' ' PRO . . . . . 0.558 ' HD2' ' HB1' ' A' ' 67' ' ' ALA . 46.7 Cg_exo -54.58 134.11 60.29 Favored 'Trans proline' 0 N--CA 1.496 1.621 0 C-N-CA 122.578 2.186 . . . . 0.0 113.276 179.752 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 69' ' ' VAL . . . . . . . . . . . . . 64.9 t -134.76 132.85 54.21 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.939 0 CA-C-O 121.661 0.743 . . . . 0.0 109.93 179.445 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -82.37 163.7 21.54 Favored 'General case' 0 N--CA 1.49 1.569 0 CA-C-O 121.619 0.723 . . . . 0.0 109.516 179.343 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 49.8 t0 -64.92 -40.69 95.44 Favored 'General case' 0 N--CA 1.489 1.486 0 O-C-N 121.721 -0.612 . . . . 0.0 109.645 -179.53 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 72' ' ' ASN . . . . . . . . . . . . . 95.0 m-20 -97.87 21.81 10.08 Favored 'General case' 0 N--CA 1.495 1.819 0 N-CA-C 108.97 -0.752 . . . . 0.0 108.97 -179.586 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 73' ' ' ALA . . . . . 0.462 ' C ' ' H ' ' A' ' 75' ' ' GLU . . . -62.36 -36.55 82.59 Favored 'General case' 0 N--CA 1.494 1.767 0 O-C-N 121.649 -0.657 . . . . 0.0 109.411 -179.826 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 74' ' ' THR . . . . . . . . . . . . . 2.0 m 67.78 -6.37 0.71 Allowed 'General case' 0 N--CA 1.491 1.606 0 N-CA-C 109.432 -0.581 . . . . 0.0 109.432 -179.965 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 75' ' ' GLU . . . . . 0.462 ' H ' ' C ' ' A' ' 73' ' ' ALA . 2.9 pp20? -137.85 145.98 42.88 Favored 'General case' 0 N--CA 1.495 1.82 0 CA-C-O 121.93 0.872 . . . . 0.0 110.336 -179.873 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 2.0 tp -121.06 128.92 53.08 Favored 'General case' 0 N--CA 1.49 1.56 0 CA-C-O 121.586 0.708 . . . . 0.0 109.451 -179.928 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 77' ' ' HIS . . . . . . . . . . . . . 76.3 m-70 -106.09 114.48 28.65 Favored 'General case' 0 N--CA 1.495 1.788 0 CA-C-O 121.672 0.749 . . . . 0.0 109.213 179.913 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -135.07 154.62 51.63 Favored 'General case' 0 N--CA 1.495 1.78 0 CA-C-O 121.899 0.857 . . . . 0.0 110.227 -179.675 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 94.6 mtt-85 -129.46 146.22 51.33 Favored 'General case' 0 N--CA 1.496 1.829 0 CA-C-O 121.536 0.684 . . . . 0.0 109.585 -179.956 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 80' ' ' PHE . . . . . . . . . . . . . 67.9 m-85 -126.34 144.49 50.79 Favored 'General case' 0 N--CA 1.498 1.942 0 CA-C-O 121.803 0.811 . . . . 0.0 109.965 -179.876 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 21.6 ttpp -115.17 121.46 43.06 Favored 'General case' 0 N--CA 1.494 1.746 0 CA-C-O 121.719 0.771 . . . . 0.0 109.565 -179.792 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 82' ' ' PHE . . . . . . . . . . . . . 83.5 m-85 -115.32 -129.42 0.3 Allowed 'General case' 0 N--CA 1.496 1.859 0 CA-C-O 121.532 0.682 . . . . 0.0 109.613 -179.876 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 78.8 tt0 -140.46 -33.29 0.56 Allowed 'General case' 0 N--CA 1.493 1.71 0 N-CA-C 108.841 -0.8 . . . . 0.0 108.841 -179.54 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 84' ' ' VAL . . . . . . . . . . . . . 27.5 m -135.79 159.8 39.49 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.894 0 CA-C-O 121.891 0.853 . . . . 0.0 109.852 179.953 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 38.0 m -63.37 -34.92 78.76 Favored 'General case' 0 N--CA 1.49 1.536 0 CA-C-O 121.319 0.58 . . . . 0.0 109.907 -179.567 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 86' ' ' ALA . . . . . . . . . . . . . . . -50.22 -45.94 54.28 Favored 'General case' 0 N--CA 1.491 1.577 0 O-C-N 121.526 -0.734 . . . . 0.0 109.676 -178.911 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 87' ' ' GLU . . . . . 0.56 ' OE1' ' N ' ' A' ' 87' ' ' GLU . 0.0 OUTLIER -52.12 -37.81 55.46 Favored 'General case' 0 N--CA 1.493 1.695 0 O-C-N 121.56 -0.712 . . . . 0.0 109.654 -179.103 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 88' ' ' LYS . . . . . . . . . . . . . 88.7 tttt -64.13 -46.1 85.61 Favored 'General case' 0 N--CA 1.49 1.527 0 O-C-N 121.675 -0.64 . . . . 0.0 109.526 -179.609 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 89' ' ' LEU . . . . . 0.531 HD22 ' N ' ' A' ' 89' ' ' LEU . 4.0 mm? -63.94 -45.31 89.74 Favored 'General case' 0 N--CA 1.492 1.664 0 O-C-N 121.651 -0.655 . . . . 0.0 110.427 -179.252 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 90' ' ' ILE . . . . . . . . . . . . . 37.1 mm -70.2 -45.28 76.38 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.665 0 O-C-N 121.773 -0.58 . . . . 0.0 109.684 -179.641 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 91' ' ' PHE . . . . . . . . . . . . . 83.9 t80 -64.51 -45.33 87.69 Favored 'General case' 0 N--CA 1.492 1.66 0 O-C-N 121.648 -0.658 . . . . 0.0 109.896 179.84 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 92' ' ' GLU . . . . . . . . . . . . . 46.5 tp10 -66.48 -38.0 86.33 Favored 'General case' 0 N--CA 1.491 1.595 0 O-C-N 121.726 -0.609 . . . . 0.0 109.533 -178.949 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 93' ' ' LEU . . . . . . . . . . . . . 5.5 tt -62.68 -49.17 76.17 Favored 'General case' 0 C--N 1.303 -1.44 0 O-C-N 121.572 -0.705 . . . . 0.0 109.952 -179.301 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 94' ' ' LYS . . . . . . . . . . . . . 49.6 mtmt -69.67 -40.96 76.11 Favored 'General case' 0 N--CA 1.49 1.551 0 O-C-N 121.647 -0.658 . . . . 0.0 109.746 -179.87 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 95' ' ' THR . . . . . 0.576 ' CG2' ' CE2' ' A' ' 51' ' ' TYR . 98.9 m -61.61 -46.9 87.85 Favored 'General case' 0 N--CA 1.491 1.621 0 O-C-N 121.657 -0.652 . . . . 0.0 109.594 -178.917 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 96' ' ' ARG . . . . . . . . . . . . . 78.8 mtp85 -65.8 -40.36 91.83 Favored 'General case' 0 N--CA 1.492 1.669 0 O-C-N 121.687 -0.633 . . . . 0.0 109.338 179.67 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 97' ' ' ALA . . . . . 0.479 ' O ' ' N ' ' A' ' 101' ' ' LEU . . . -64.66 -36.27 83.72 Favored 'General case' 0 N--CA 1.489 1.484 0 N-CA-C 109.023 -0.732 . . . . 0.0 109.023 -179.813 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 98' ' ' LEU . . . . . 0.617 ' O ' HD23 ' A' ' 98' ' ' LEU . 3.6 tt -62.13 -47.83 82.82 Favored 'General case' 0 N--CA 1.488 1.427 0 CA-C-O 121.489 0.661 . . . . 0.0 109.238 -179.342 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 99' ' ' ALA . . . . . . . . . . . . . . . -74.89 -40.92 60.65 Favored 'General case' 0 N--CA 1.491 1.618 0 O-C-N 121.562 -0.711 . . . . 0.0 109.856 -179.749 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 100' ' ' ARG . . . . . 0.409 ' O ' ' C ' ' A' ' 101' ' ' LEU . 83.4 mmt-85 -80.52 -10.15 59.75 Favored 'General case' 0 N--CA 1.491 1.583 0 N-CA-C 109.273 -0.64 . . . . 0.0 109.273 -179.158 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 101' ' ' LEU . . . . . 0.479 ' N ' ' O ' ' A' ' 97' ' ' ALA . 90.5 mt 40.35 59.71 1.99 Allowed 'General case' 0 N--CA 1.493 1.717 0 CA-C-O 121.438 0.637 . . . . 0.0 109.879 -179.914 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 102' ' ' GLU . . . . . . . . . . . . . 18.0 pt-20 -90.16 -5.34 56.57 Favored 'General case' 0 N--CA 1.492 1.674 0 N-CA-C 108.966 -0.754 . . . . 0.0 108.966 179.975 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 103' ' ' HIS . . . . . . . . . . . . . 78.2 t60 -77.29 136.4 38.49 Favored 'General case' 0 N--CA 1.493 1.697 0 CA-C-O 121.735 0.779 . . . . 0.0 110.125 -179.479 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 104' ' ' HIS . . . . . 0.598 ' NE2' ' CD2' ' A' ' 105' ' ' HIS . 71.6 t60 59.73 168.91 0.07 Allowed 'General case' 0 N--CA 1.49 1.532 0 CA-C-O 121.633 0.73 . . . . 0.0 110.308 179.664 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 105' ' ' HIS . . . . . 0.598 ' CD2' ' NE2' ' A' ' 104' ' ' HIS . 34.3 p80 -84.75 -147.86 0.1 Allowed 'General case' 0 N--CA 1.489 1.511 0 CA-C-O 121.473 0.654 . . . . 0.0 109.932 -179.452 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 106' ' ' HIS . . . . . 0.579 ' N ' ' ND1' ' A' ' 105' ' ' HIS . 28.6 t-80 -63.71 158.5 21.43 Favored 'General case' 0 N--CA 1.49 1.558 0 CA-C-O 121.889 0.852 . . . . 0.0 111.049 -178.668 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 107' ' ' HIS . . . . . 0.409 ' N ' ' CG ' ' A' ' 106' ' ' HIS . 73.2 m80 -61.47 -45.7 93.17 Favored 'General case' 0 N--CA 1.487 1.407 0 N-CA-C 109.243 -0.651 . . . . 0.0 109.243 -179.778 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 108' ' ' HIS . . . . . . . . . . . . . 74.1 m80 . . . . . 0 N--CA 1.496 1.868 0 CA-C-O 118.253 -0.88 . . . . 0.0 109.52 -179.787 . . . . . . . . 0 0 . 1 . 002 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 4.0 mpp? . . . . . 0 N--CA 1.488 1.432 0 N-CA-C 108.607 -0.886 . . . . 0.0 108.607 . . . . . . . . . 0 0 . 1 . 002 nuclear build full ' A' A ' 2' ' ' SER . . . . . 0.413 ' O ' ' OD1' ' A' ' 3' ' ' ASN . 46.3 t -140.93 150.34 43.01 Favored 'General case' 0 N--CA 1.495 1.822 0 O-C-N 121.326 -0.859 . . . . 0.0 109.809 -179.96 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 3' ' ' ASN . . . . . 0.413 ' OD1' ' O ' ' A' ' 2' ' ' SER . 7.1 p-10 44.08 46.41 7.14 Favored 'General case' 0 N--CA 1.495 1.784 0 CA-C-O 121.659 0.742 . . . . 0.0 109.693 -179.905 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 14.0 pt20 -71.35 138.85 49.55 Favored 'General case' 0 N--CA 1.492 1.642 0 CA-C-O 121.847 0.832 . . . . 0.0 110.265 -179.865 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 5' ' ' THR . . . . . 0.513 ' O ' ' SG ' ' A' ' 6' ' ' CYS . 2.8 p -84.67 -169.23 2.53 Favored 'General case' 0 N--CA 1.49 1.547 0 CA-C-O 121.639 0.733 . . . . 0.0 110.345 -179.414 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 6' ' ' CYS . . . . . 0.513 ' SG ' ' O ' ' A' ' 5' ' ' THR . 20.7 p 38.83 93.86 0.01 OUTLIER 'General case' 0 N--CA 1.495 1.79 0 CA-C-O 121.88 0.848 . . . . 0.0 110.365 179.975 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 7' ' ' VAL . . . . . 0.593 HG22 ' H ' ' A' ' 9' ' ' ASN . 7.3 p -80.16 128.79 38.38 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.451 0 CA-C-O 121.853 0.835 . . . . 0.0 109.99 -179.526 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 97.1 mt-10 -88.55 -8.18 55.21 Favored 'General case' 0 N--CA 1.495 1.781 0 O-C-N 121.408 -0.807 . . . . 0.0 109.404 179.987 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 9' ' ' ASN . . . . . 0.593 ' H ' HG22 ' A' ' 7' ' ' VAL . 49.5 t30 -150.69 107.23 3.5 Favored 'General case' 0 N--CA 1.496 1.846 0 O-C-N 120.966 -1.084 . . . . 0.0 109.484 -179.977 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 17.3 pt-20 -57.2 -157.6 0.0 OUTLIER 'General case' 0 N--CA 1.495 1.797 0 CA-C-O 121.829 0.823 . . . . 0.0 111.116 -179.219 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 7.7 p -64.67 136.26 26.86 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.626 0 CA-C-O 121.934 0.873 . . . . 0.0 110.75 -179.204 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 12' ' ' CYS . . . . . 0.564 ' O ' ' N ' ' A' ' 14' ' ' ALA . 0.7 OUTLIER -60.86 -50.65 72.57 Favored 'General case' 0 N--CA 1.492 1.65 0 O-C-N 121.655 -0.653 . . . . 0.0 110.148 -179.802 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 13' ' ' GLU . . . . . 0.421 ' C ' ' O ' ' A' ' 12' ' ' CYS . 84.6 tt0 36.44 -89.01 0.01 OUTLIER 'General case' 0 N--CA 1.499 2.013 0 CA-C-O 121.726 0.774 . . . . 0.0 110.845 -179.418 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 14' ' ' ALA . . . . . 0.564 ' N ' ' O ' ' A' ' 12' ' ' CYS . . . -72.23 -178.58 2.53 Favored 'General case' 0 C--N 1.302 -1.477 0 CA-C-O 121.972 0.891 . . . . 0.0 110.793 -179.242 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 86.9 m -62.34 -38.1 88.19 Favored 'General case' 0 N--CA 1.489 1.513 0 CA-C-O 121.561 0.696 . . . . 0.0 109.284 179.835 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 78.19 0.01 75.55 Favored Glycine 0 N--CA 1.491 2.345 0 N-CA-C 109.404 -1.478 . . . . 0.0 109.404 -179.845 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 21.8 p -156.23 155.74 32.91 Favored 'General case' 0 N--CA 1.491 1.584 0 O-C-N 121.178 -1.189 . . . . 0.0 109.968 -179.94 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . 40.8 -161.48 0.01 OUTLIER 'General case' 0 N--CA 1.496 1.836 0 CA-C-O 121.812 0.815 . . . . 0.0 111.176 179.554 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 154.02 -69.28 0.3 Allowed Glycine 0 N--CA 1.492 2.396 0 N-CA-C 109.144 -1.582 . . . . 0.0 109.144 -179.298 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 68.3 tt0 44.25 -122.31 0.85 Allowed 'General case' 0 N--CA 1.495 1.808 0 O-C-N 121.565 -0.962 . . . . 0.0 109.851 179.901 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 21' ' ' ILE . . . . . . . . . . . . . 93.2 mt -107.43 -29.31 2.64 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.531 0 N-CA-C 108.711 -0.848 . . . . 0.0 108.711 179.893 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 157.57 -156.81 27.61 Favored Glycine 0 N--CA 1.493 2.434 0 C-N-CA 119.453 -1.356 . . . . 0.0 110.515 179.838 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 23' ' ' PHE . . . . . . . . . . . . . 61.2 m-85 -79.32 136.38 37.0 Favored 'General case' 0 N--CA 1.491 1.612 0 O-C-N 121.447 -1.031 . . . . 0.0 110.373 -179.289 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 24' ' ' ILE . . . . . 0.693 HG23 HG12 ' A' ' 25' ' ' ILE . 12.3 tt -87.49 170.24 1.29 Allowed 'Isoleucine or valine' 0 N--CA 1.492 1.647 0 O-C-N 121.529 -0.732 . . . . 0.0 109.645 179.899 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 25' ' ' ILE . . . . . 0.693 HG12 HG23 ' A' ' 24' ' ' ILE . 20.4 pt 33.5 69.03 0.06 OUTLIER 'Isoleucine or valine' 0 N--CA 1.501 2.086 0 CA-C-O 122.243 1.02 . . . . 0.0 110.276 -179.839 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 26' ' ' ARG . . . . . 0.443 ' O ' ' O ' ' A' ' 25' ' ' ILE . 17.5 ptm180 -48.61 179.25 0.0 OUTLIER 'General case' 0 C--N 1.301 -1.519 0 CA-C-O 122.008 0.909 . . . . 0.0 110.776 -179.09 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 27' ' ' GLU . . . . . 0.501 ' OE1' ' N ' ' A' ' 27' ' ' GLU . 58.5 mp0 -73.57 60.73 0.68 Allowed 'General case' 0 N--CA 1.488 1.444 0 CA-C-O 121.818 0.818 . . . . 0.0 109.502 -179.578 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . -80.49 172.01 54.33 Favored Glycine 0 N--CA 1.488 2.158 0 N-CA-C 110.498 -1.041 . . . . 0.0 110.498 -179.895 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 98.9 m-20 -70.84 -10.95 60.6 Favored 'General case' 0 N--CA 1.492 1.64 0 O-C-N 121.592 -0.946 . . . . 0.0 109.574 179.632 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 30' ' ' ASP . . . . . 0.445 ' OD1' ' N ' ' A' ' 30' ' ' ASP . 29.3 p-10 -92.04 9.82 31.7 Favored 'General case' 0 N--CA 1.493 1.701 0 O-C-N 121.087 -1.008 . . . . 0.0 108.945 179.782 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 31' ' ' VAL . . . . . 0.444 HG12 ' N ' ' A' ' 32' ' ' ALA . 17.2 t -117.21 161.24 16.14 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.97 0 O-C-N 121.551 -0.718 . . . . 0.0 109.658 -179.78 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 32' ' ' ALA . . . . . 0.444 ' N ' HG12 ' A' ' 31' ' ' VAL . . . -135.92 151.61 50.15 Favored 'General case' 0 N--CA 1.492 1.63 0 O-C-N 121.514 -0.741 . . . . 0.0 109.436 -179.652 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 33' ' ' GLU . . . . . 0.496 ' OE1' ' NE2' ' A' ' 77' ' ' HIS . 80.4 mm-40 -100.2 142.7 31.32 Favored 'General case' 0 N--CA 1.493 1.71 0 CA-C-O 121.877 0.846 . . . . 0.0 110.035 -179.597 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 34' ' ' VAL . . . . . . . . . . . . . 52.3 t -128.87 135.48 62.11 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.802 0 CA-C-O 121.629 0.728 . . . . 0.0 109.146 -179.915 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 79.8 p -142.4 120.87 12.43 Favored 'General case' 0 N--CA 1.492 1.638 0 O-C-N 121.258 -0.901 . . . . 0.0 109.05 179.779 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 51.0 tp -122.38 136.27 54.86 Favored 'General case' 0 N--CA 1.497 1.887 0 CA-C-O 121.449 0.642 . . . . 0.0 109.587 -179.9 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 37' ' ' PHE . . . . . . . . . . . . . 91.0 t80 -108.48 131.01 55.23 Favored 'General case' 0 N--CA 1.495 1.787 0 CA-C-O 121.61 0.719 . . . . 0.0 109.468 -179.997 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . -172.09 -159.18 17.9 Favored Glycine 0 N--CA 1.488 2.16 0 N-CA-C 109.951 -1.26 . . . . 0.0 109.951 -179.639 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 39' ' ' SER . . . . . 0.449 ' OG ' ' N ' ' A' ' 40' ' ' ASP . 39.7 t -75.78 -146.94 0.03 OUTLIER 'General case' 0 N--CA 1.494 1.771 0 O-C-N 121.645 -0.914 . . . . 0.0 111.042 -179.061 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 40' ' ' ASP . . . . . 0.449 ' N ' ' OG ' ' A' ' 39' ' ' SER . 97.9 m-20 -52.07 175.98 0.02 OUTLIER 'General case' 0 N--CA 1.493 1.706 0 CA-C-O 122.162 0.982 . . . . 0.0 111.24 -178.696 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 38.0 ttmt -62.29 -42.82 99.68 Favored 'General case' 0 N--CA 1.491 1.577 0 O-C-N 121.633 -0.667 . . . . 0.0 109.575 179.608 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -53.46 -44.7 69.13 Favored 'General case' 0 N--CA 1.492 1.63 0 O-C-N 121.337 -0.852 . . . . 0.0 109.569 -179.558 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 43' ' ' HIS . . . . . . . . . . . . . 86.6 t60 -63.17 -43.36 98.49 Favored 'General case' 0 N--CA 1.493 1.694 0 O-C-N 121.277 -0.89 . . . . 0.0 109.62 179.892 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 97.5 mt -64.43 -39.88 94.68 Favored 'General case' 0 N--CA 1.493 1.723 0 O-C-N 121.413 -0.804 . . . . 0.0 109.713 -179.871 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 96.1 mt-10 -60.73 -38.55 85.5 Favored 'General case' 0 N--CA 1.491 1.603 0 O-C-N 121.203 -0.936 . . . . 0.0 109.833 -179.719 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . -62.34 -52.06 52.03 Favored Glycine 0 N--CA 1.494 2.507 0 N-CA-C 109.698 -1.361 . . . . 0.0 109.698 179.951 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 97.3 mttt -67.59 -37.21 82.25 Favored 'General case' 0 N--CA 1.492 1.644 0 O-C-N 121.32 -1.106 . . . . 0.0 109.739 179.157 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 48' ' ' LEU . . . . . 0.5 ' O ' ' N ' ' A' ' 51' ' ' TYR . 20.7 tp -61.62 -40.13 93.74 Favored 'General case' 0 C--N 1.299 -1.595 0 O-C-N 121.532 -0.73 . . . . 0.0 109.427 -179.177 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 49' ' ' ALA . . . . . 0.426 ' C ' ' O ' ' A' ' 48' ' ' LEU . . . -40.44 -33.24 0.24 Allowed 'General case' 0 N--CA 1.497 1.91 0 CA-C-O 121.617 0.723 . . . . 0.0 109.955 -179.588 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 72.8 mm-40 -68.69 -38.53 80.38 Favored 'General case' 0 N--CA 1.491 1.608 0 O-C-N 121.32 -0.862 . . . . 0.0 109.658 179.513 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 51' ' ' TYR . . . . . 0.5 ' N ' ' O ' ' A' ' 48' ' ' LEU . 21.3 m-85 -62.04 -45.31 94.11 Favored 'General case' 0 N--CA 1.494 1.74 0 O-C-N 121.224 -0.923 . . . . 0.0 109.79 -179.761 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 52' ' ' ILE . . . . . . . . . . . . . 97.2 mt -65.24 -44.16 95.17 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.658 0 O-C-N 121.347 -0.845 . . . . 0.0 109.857 -179.658 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 68.9 m -62.52 -45.02 94.9 Favored 'General case' 0 N--CA 1.494 1.729 0 O-C-N 121.163 -0.96 . . . . 0.0 109.713 -179.642 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 54' ' ' LEU . . . . . 0.442 HD12 HG22 ' A' ' 95' ' ' THR . 88.2 mt -65.87 -39.38 90.66 Favored 'General case' 0 N--CA 1.492 1.646 0 O-C-N 121.371 -0.831 . . . . 0.0 109.784 179.883 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -61.37 -38.82 88.37 Favored 'General case' 0 N--CA 1.49 1.565 0 O-C-N 121.352 -0.842 . . . . 0.0 109.666 -179.522 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 56' ' ' LYS . . . . . . . . . . . . . 56.6 mtpt -64.43 -42.53 95.96 Favored 'General case' 0 N--CA 1.491 1.599 0 O-C-N 121.246 -0.909 . . . . 0.0 109.565 179.68 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 19.3 mm100 -68.54 -41.8 79.32 Favored 'General case' 0 N--CA 1.49 1.532 0 O-C-N 121.286 -0.884 . . . . 0.0 109.521 -179.897 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 58' ' ' VAL . . . . . . . . . . . . . 75.0 t -64.76 -45.57 94.74 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.638 0 O-C-N 121.285 -0.884 . . . . 0.0 109.755 179.809 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 59' ' ' TYR . . . . . . . . . . . . . 51.2 t80 -135.09 121.69 20.7 Favored 'General case' 0 N--CA 1.497 1.909 0 O-C-N 121.339 -0.85 . . . . 0.0 109.77 -179.588 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -68.04 144.51 55.08 Favored 'General case' 0 N--CA 1.492 1.673 0 CA-C-O 121.645 0.736 . . . . 0.0 110.764 -179.585 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 61' ' ' ASN . . . . . . . . . . . . . 55.9 t-20 57.75 41.33 25.3 Favored 'General case' 0 N--CA 1.489 1.508 0 CA-C-O 121.906 0.86 . . . . 0.0 108.98 179.659 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 62' ' ' VAL . . . . . . . . . . . . . 7.4 p -70.76 138.66 21.4 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.516 0 CA-C-O 121.772 0.796 . . . . 0.0 110.321 -179.67 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 97.1 mt-10 -111.19 136.74 49.82 Favored 'General case' 0 N--CA 1.494 1.749 0 CA-C-O 121.611 0.719 . . . . 0.0 109.466 -179.849 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 64' ' ' TYR . . . . . . . . . . . . . 52.4 p90 -147.6 161.3 41.41 Favored 'General case' 0 N--CA 1.489 1.485 0 O-C-N 121.432 -0.792 . . . . 0.0 109.767 -179.549 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 83.1 tt0 -144.56 150.16 37.04 Favored 'General case' 0 N--CA 1.49 1.57 0 N-CA-C 108.935 -0.765 . . . . 0.0 108.935 -179.992 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 66' ' ' VAL . . . . . . . . . . . . . 57.3 t -111.48 129.67 66.4 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.89 0 CA-C-O 121.752 0.787 . . . . 0.0 109.83 -179.705 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 67' ' ' ALA . . . . . 0.514 ' HB1' ' HD2' ' A' ' 68' ' ' PRO . . . -79.45 170.54 15.59 Favored Pre-proline 0 N--CA 1.486 1.369 0 O-C-N 121.698 -0.626 . . . . 0.0 109.589 -179.487 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 68' ' ' PRO . . . . . 0.514 ' HD2' ' HB1' ' A' ' 67' ' ' ALA . 51.3 Cg_exo -54.72 119.11 5.91 Favored 'Trans proline' 0 N--CA 1.496 1.651 0 C-N-CA 122.412 2.075 . . . . 0.0 112.448 179.64 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 69' ' ' VAL . . . . . . . . . . . . . 74.7 t -131.98 133.28 61.01 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.946 0 O-C-N 121.469 -0.769 . . . . 0.0 109.653 179.634 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -78.61 158.07 28.55 Favored 'General case' 0 N--CA 1.493 1.684 0 CA-C-O 121.757 0.789 . . . . 0.0 110.253 179.869 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 56.6 m-20 -64.09 -37.04 85.99 Favored 'General case' 0 N--CA 1.493 1.684 0 O-C-N 121.58 -0.7 . . . . 0.0 109.39 -179.807 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 72' ' ' ASN . . . . . . . . . . . . . 61.7 t30 -103.91 28.9 6.26 Favored 'General case' 0 N--CA 1.495 1.79 0 O-C-N 121.333 -0.855 . . . . 0.0 108.925 -179.703 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 73' ' ' ALA . . . . . 0.5 ' O ' ' N ' ' A' ' 75' ' ' GLU . . . -72.96 -10.07 59.4 Favored 'General case' 0 N--CA 1.493 1.677 0 O-C-N 121.292 -0.88 . . . . 0.0 108.729 179.622 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 74' ' ' THR . . . . . . . . . . . . . 68.4 p 49.69 10.59 0.04 OUTLIER 'General case' 0 N--CA 1.493 1.722 0 O-C-N 121.424 -0.797 . . . . 0.0 109.489 -179.726 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 75' ' ' GLU . . . . . 0.5 ' N ' ' O ' ' A' ' 73' ' ' ALA . 80.8 tt0 -153.82 153.04 31.4 Favored 'General case' 0 C--N 1.302 -1.487 0 O-C-N 121.2 -0.937 . . . . 0.0 109.165 179.618 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 5.7 tt -132.38 134.99 45.82 Favored 'General case' 0 N--CA 1.49 1.546 0 O-C-N 121.608 -0.683 . . . . 0.0 109.324 179.971 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 77' ' ' HIS . . . . . 0.496 ' NE2' ' OE1' ' A' ' 33' ' ' GLU . 74.5 t60 -118.75 126.22 51.4 Favored 'General case' 0 N--CA 1.494 1.758 0 CA-C-O 121.74 0.781 . . . . 0.0 109.46 -179.853 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -144.13 163.87 32.32 Favored 'General case' 0 N--CA 1.492 1.661 0 O-C-N 121.389 -0.82 . . . . 0.0 109.408 -179.719 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 84.5 mtt85 -126.01 144.95 50.51 Favored 'General case' 0 N--CA 1.495 1.792 0 N-CA-C 109.226 -0.657 . . . . 0.0 109.226 -179.877 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 80' ' ' PHE . . . . . . . . . . . . . 64.9 m-85 -128.93 152.0 49.04 Favored 'General case' 0 N--CA 1.495 1.798 0 CA-C-O 121.616 0.722 . . . . 0.0 109.374 -179.717 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 65.0 tttm -106.07 137.72 43.5 Favored 'General case' 0 N--CA 1.492 1.655 0 CA-C-O 121.603 0.716 . . . . 0.0 110.007 -179.507 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 82' ' ' PHE . . . . . . . . . . . . . 80.7 m-85 -133.13 -123.46 0.18 Allowed 'General case' 0 N--CA 1.494 1.768 0 N-CA-C 109.201 -0.666 . . . . 0.0 109.201 179.846 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 49.5 tp10 -153.65 -36.89 0.1 Allowed 'General case' 0 N--CA 1.488 1.442 0 O-C-N 121.225 -0.922 . . . . 0.0 108.704 179.959 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 84' ' ' VAL . . . . . . . . . . . . . 27.8 m -135.89 162.49 36.55 Favored 'Isoleucine or valine' 0 N--CA 1.499 1.991 0 O-C-N 121.329 -0.857 . . . . 0.0 110.155 -179.745 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 77.8 p -69.66 -19.95 63.59 Favored 'General case' 0 N--CA 1.492 1.635 0 O-C-N 121.496 -0.753 . . . . 0.0 109.482 179.618 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 86' ' ' ALA . . . . . . . . . . . . . . . -62.72 -37.6 87.15 Favored 'General case' 0 N--CA 1.492 1.63 0 O-C-N 121.253 -0.905 . . . . 0.0 109.521 179.983 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 80.4 mm-40 -71.8 -27.13 62.73 Favored 'General case' 0 N--CA 1.491 1.596 0 O-C-N 121.348 -0.845 . . . . 0.0 109.109 179.572 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 88' ' ' LYS . . . . . . . . . . . . . 36.8 ttmt -63.41 -50.61 69.14 Favored 'General case' 0 N--CA 1.49 1.544 0 O-C-N 121.258 -0.901 . . . . 0.0 109.726 -179.592 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 89' ' ' LEU . . . . . 0.5 HD22 ' N ' ' A' ' 89' ' ' LEU . 4.0 mm? -65.41 -44.22 88.09 Favored 'General case' 0 N--CA 1.493 1.72 0 O-C-N 121.349 -0.845 . . . . 0.0 109.893 -179.72 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 90' ' ' ILE . . . . . 0.4 ' O ' ' CB ' ' A' ' 94' ' ' LYS . 96.0 mt -66.63 -43.62 90.3 Favored 'Isoleucine or valine' 0 C--N 1.299 -1.616 0 O-C-N 121.296 -0.877 . . . . 0.0 109.625 -179.94 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 91' ' ' PHE . . . . . 0.582 ' O ' HG23 ' A' ' 95' ' ' THR . 82.5 t80 -61.67 -46.74 88.45 Favored 'General case' 0 N--CA 1.49 1.57 0 O-C-N 121.257 -0.902 . . . . 0.0 109.9 -179.619 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 92' ' ' GLU . . . . . . . . . . . . . 8.8 tm-20 -68.19 -51.77 41.87 Favored 'General case' 0 N--CA 1.491 1.611 0 O-C-N 121.345 -0.847 . . . . 0.0 109.996 -179.463 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 93' ' ' LEU . . . . . 0.631 ' O ' HD23 ' A' ' 93' ' ' LEU . 3.1 tt -63.64 -46.67 84.6 Favored 'General case' 0 C--N 1.3 -1.586 0 O-C-N 121.173 -0.954 . . . . 0.0 109.659 -179.101 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 94' ' ' LYS . . . . . 0.4 ' CB ' ' O ' ' A' ' 90' ' ' ILE . 55.1 tttp -63.32 -47.27 82.92 Favored 'General case' 0 N--CA 1.491 1.61 0 O-C-N 121.205 -0.935 . . . . 0.0 110.09 -179.072 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 95' ' ' THR . . . . . 0.582 HG23 ' O ' ' A' ' 91' ' ' PHE . 60.0 p -67.68 -42.09 82.65 Favored 'General case' 0 C--N 1.299 -1.595 0 O-C-N 121.258 -0.901 . . . . 0.0 109.465 -179.854 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 96' ' ' ARG . . . . . . . . . . . . . 12.1 tpt180 -65.47 -41.54 93.23 Favored 'General case' 0 C--N 1.3 -1.553 0 O-C-N 121.313 -0.867 . . . . 0.0 109.322 -179.853 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 97' ' ' ALA . . . . . . . . . . . . . . . -57.92 -40.19 79.81 Favored 'General case' 0 N--CA 1.489 1.517 0 O-C-N 121.366 -0.834 . . . . 0.0 109.245 -179.762 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 98' ' ' LEU . . . . . 0.622 ' O ' HD23 ' A' ' 98' ' ' LEU . 2.2 tt -64.04 -42.75 96.96 Favored 'General case' 0 N--CA 1.493 1.678 0 CA-C-O 121.945 0.878 . . . . 0.0 109.454 -179.695 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 99' ' ' ALA . . . . . . . . . . . . . . . -58.11 -48.92 78.72 Favored 'General case' 0 N--CA 1.493 1.694 0 O-C-N 121.144 -0.972 . . . . 0.0 110.313 -179.056 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 100' ' ' ARG . . . . . . . . . . . . . 18.5 ptp180 -80.55 -19.39 45.78 Favored 'General case' 0 C--N 1.299 -1.604 0 O-C-N 121.313 -0.867 . . . . 0.0 109.537 -179.775 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 101' ' ' LEU . . . . . . . . . . . . . 50.5 tp -96.0 126.54 41.31 Favored 'General case' 0 N--CA 1.494 1.731 0 O-C-N 121.251 -0.906 . . . . 0.0 110.028 -179.452 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 102' ' ' GLU . . . . . . . . . . . . . 78.9 mm-40 -61.31 153.63 26.04 Favored 'General case' 0 N--CA 1.489 1.475 0 CA-C-O 122.021 0.915 . . . . 0.0 110.621 -179.7 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 103' ' ' HIS . . . . . . . . . . . . . 86.3 t60 -58.99 -42.25 89.59 Favored 'General case' 0 N--CA 1.489 1.522 0 O-C-N 121.637 -0.664 . . . . 0.0 110.051 -179.768 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 104' ' ' HIS . . . . . 0.405 ' O ' ' CG ' ' A' ' 104' ' ' HIS . 56.6 p-80 -86.13 121.05 28.19 Favored 'General case' 0 N--CA 1.492 1.673 0 O-C-N 121.118 -0.989 . . . . 0.0 110.355 -179.137 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 105' ' ' HIS . . . . . . . . . . . . . 56.7 t-80 -151.38 -75.93 0.14 Allowed 'General case' 0 N--CA 1.493 1.695 0 O-C-N 121.554 -0.716 . . . . 0.0 109.178 179.867 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 106' ' ' HIS . . . . . 0.429 ' CG ' ' N ' ' A' ' 107' ' ' HIS . 54.1 t-80 -153.16 164.36 38.19 Favored 'General case' 0 N--CA 1.494 1.77 0 O-C-N 121.167 -0.958 . . . . 0.0 109.997 179.904 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 107' ' ' HIS . . . . . 0.44 ' O ' ' O ' ' A' ' 108' ' ' HIS . 78.7 m80 -62.36 -41.29 98.5 Favored 'General case' 0 N--CA 1.495 1.788 0 O-C-N 121.512 -0.743 . . . . 0.0 110.008 -179.995 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 108' ' ' HIS . . . . . 0.44 ' O ' ' O ' ' A' ' 107' ' ' HIS . 86.4 t60 . . . . . 0 N--CA 1.494 1.729 0 CA-C-O 118.006 -0.997 . . . . 0.0 110.04 -179.463 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 96.8 mmm . . . . . 0 N--CA 1.49 1.565 0 CA-C-O 121.48 0.657 . . . . 0.0 109.801 . . . . . . . . . 0 0 . 1 . 003 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 80.7 p -69.15 -16.48 63.65 Favored 'General case' 0 N--CA 1.489 1.488 0 O-C-N 121.492 -0.755 . . . . 0.0 109.556 -179.935 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 3' ' ' ASN . . . . . . . . . . . . . 98.9 m-20 -63.11 -40.88 98.92 Favored 'General case' 0 N--CA 1.49 1.566 0 O-C-N 121.365 -0.835 . . . . 0.0 109.551 -179.985 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 3.9 tm0? -155.27 101.85 2.24 Favored 'General case' 0 N--CA 1.492 1.641 0 O-C-N 121.219 -0.926 . . . . 0.0 109.012 179.673 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 35.2 m -66.71 133.85 51.03 Favored 'General case' 0 N--CA 1.489 1.481 0 O-C-N 121.479 -0.763 . . . . 0.0 110.453 -179.45 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 6' ' ' CYS . . . . . 0.456 ' O ' ' SG ' ' A' ' 6' ' ' CYS . 29.3 p -137.86 118.38 13.88 Favored 'General case' 0 N--CA 1.494 1.768 0 N-CA-C 108.793 -0.817 . . . . 0.0 108.793 179.495 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 7' ' ' VAL . . . . . . . . . . . . . 16.5 m -110.18 131.51 61.01 Favored 'Isoleucine or valine' 0 N--CA 1.499 2.01 0 O-C-N 121.504 -0.748 . . . . 0.0 109.808 -179.397 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 60.2 mp0 -62.0 136.1 57.82 Favored 'General case' 0 N--CA 1.489 1.475 0 O-C-N 121.626 -0.671 . . . . 0.0 109.712 -179.557 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 94.0 m-20 -82.86 150.74 26.36 Favored 'General case' 0 N--CA 1.489 1.517 0 O-C-N 121.441 -0.787 . . . . 0.0 110.091 -179.46 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 10' ' ' GLU . . . . . 0.474 ' N ' ' CD ' ' A' ' 10' ' ' GLU . 0.9 OUTLIER -145.06 96.59 2.87 Favored 'General case' 0 N--CA 1.49 1.569 0 O-C-N 121.306 -0.871 . . . . 0.0 108.768 179.658 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 35.0 m -100.46 130.41 49.76 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.916 0 O-C-N 121.412 -0.805 . . . . 0.0 109.719 -179.663 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 17.1 p -148.31 32.32 0.81 Allowed 'General case' 0 N--CA 1.492 1.664 0 N-CA-C 108.381 -0.97 . . . . 0.0 108.381 179.908 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 79.5 mm-40 -68.83 148.17 50.67 Favored 'General case' 0 N--CA 1.49 1.561 0 O-C-N 121.559 -0.713 . . . . 0.0 110.302 -179.227 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -65.27 147.7 52.98 Favored 'General case' 0 N--CA 1.491 1.596 0 O-C-N 121.577 -0.702 . . . . 0.0 110.598 -179.546 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 7.5 t -60.58 -39.05 86.62 Favored 'General case' 0 N--CA 1.491 1.617 0 O-C-N 121.409 -0.807 . . . . 0.0 109.805 179.774 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 75.11 20.98 78.92 Favored Glycine 0 N--CA 1.49 2.285 0 N-CA-C 109.828 -1.309 . . . . 0.0 109.828 -179.941 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 41.0 m 52.48 52.7 13.62 Favored 'General case' 0 N--CA 1.492 1.626 0 O-C-N 121.235 -1.156 . . . . 0.0 109.675 -179.811 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . 40.97 -102.02 0.03 OUTLIER 'General case' 0 N--CA 1.493 1.704 0 CA-C-O 121.431 0.634 . . . . 0.0 110.78 179.423 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -70.23 148.44 45.81 Favored Glycine 0 N--CA 1.489 2.169 0 N-CA-C 110.626 -0.99 . . . . 0.0 110.626 -178.915 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 20' ' ' GLU . . . . . 0.542 ' O ' ' N ' ' A' ' 22' ' ' GLY . 53.6 tp10 -169.59 99.46 0.33 Allowed 'General case' 0 N--CA 1.488 1.429 0 O-C-N 121.57 -0.959 . . . . 0.0 108.886 179.011 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 21' ' ' ILE . . . . . . . . . . . . . 92.4 mt 48.77 -88.28 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.493 1.691 0 O-C-N 121.5 -0.75 . . . . 0.0 110.027 -179.946 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 22' ' ' GLY . . . . . 0.542 ' N ' ' O ' ' A' ' 20' ' ' GLU . . . 53.12 94.25 0.01 OUTLIER Glycine 0 N--CA 1.492 2.42 0 N-CA-C 110.006 -1.238 . . . . 0.0 110.006 -179.956 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 23' ' ' PHE . . . . . 0.529 ' O ' ' N ' ' A' ' 25' ' ' ILE . 82.5 m-85 -75.97 144.84 40.75 Favored 'General case' 0 N--CA 1.489 1.485 0 O-C-N 121.283 -1.128 . . . . 0.0 110.347 -179.788 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 97.5 mt 48.91 -87.6 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.49 1.536 0 O-C-N 121.891 -0.506 . . . . 0.0 110.076 179.853 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 25' ' ' ILE . . . . . 0.764 HD11 ' CD ' ' A' ' 65' ' ' GLU . 1.9 pt -77.51 141.08 16.05 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.347 0 C-N-CA 118.745 -1.182 . . . . 0.0 109.892 -178.547 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 17.9 ptp180 -91.74 157.1 17.11 Favored 'General case' 0 N--CA 1.496 1.851 0 CA-C-O 121.906 0.86 . . . . 0.0 110.981 179.001 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 96.7 mt-10 -63.81 153.88 35.24 Favored 'General case' 0 N--CA 1.495 1.806 0 CA-C-O 121.612 0.72 . . . . 0.0 110.841 -179.586 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 28' ' ' GLY . . . . . 0.407 ' O ' HG23 ' A' ' 31' ' ' VAL . . . 92.36 175.66 41.91 Favored Glycine 0 N--CA 1.492 2.377 0 N-CA-C 110.296 -1.122 . . . . 0.0 110.296 179.436 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 18.8 t0 72.45 64.62 0.12 Allowed 'General case' 0 N--CA 1.495 1.783 0 O-C-N 121.959 -0.73 . . . . 0.0 110.157 179.928 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 96.3 m-20 54.6 70.63 0.6 Allowed 'General case' 0 N--CA 1.493 1.702 0 O-C-N 121.674 -0.641 . . . . 0.0 109.688 179.438 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 31' ' ' VAL . . . . . 0.407 HG23 ' O ' ' A' ' 28' ' ' GLY . 49.9 t -120.24 135.63 59.88 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.773 0 N-CA-C 109.112 -0.699 . . . . 0.0 109.112 -179.829 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -118.48 147.91 43.13 Favored 'General case' 0 N--CA 1.492 1.63 0 N-CA-C 109.267 -0.642 . . . . 0.0 109.267 -179.79 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 97.3 mt-10 -105.49 133.92 49.46 Favored 'General case' 0 N--CA 1.492 1.67 0 O-C-N 121.593 -0.692 . . . . 0.0 109.519 -179.74 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 34' ' ' VAL . . . . . . . . . . . . . 48.6 t -123.06 133.44 69.06 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.734 0 N-CA-C 108.771 -0.826 . . . . 0.0 108.771 179.929 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 77.9 p -128.52 122.96 32.33 Favored 'General case' 0 N--CA 1.491 1.588 0 N-CA-C 108.719 -0.845 . . . . 0.0 108.719 -179.944 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 44.9 tp -117.81 132.58 56.43 Favored 'General case' 0 N--CA 1.496 1.858 0 N-CA-C 108.905 -0.776 . . . . 0.0 108.905 179.808 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 37' ' ' PHE . . . . . . . . . . . . . 91.2 t80 -112.98 132.33 55.4 Favored 'General case' 0 N--CA 1.493 1.688 0 O-C-N 121.676 -0.64 . . . . 0.0 109.287 -179.638 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 38' ' ' GLY . . . . . 0.405 ' N ' HD21 ' A' ' 44' ' ' LEU . . . -168.45 -162.79 21.24 Favored Glycine 0 N--CA 1.487 2.074 0 C-N-CA 119.693 -1.241 . . . . 0.0 110.164 -179.667 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 39' ' ' SER . . . . . 0.515 ' OG ' ' N ' ' A' ' 40' ' ' ASP . 30.0 t -62.65 -128.33 0.0 OUTLIER 'General case' 0 N--CA 1.49 1.55 0 O-C-N 121.667 -0.902 . . . . 0.0 110.766 -179.264 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 40' ' ' ASP . . . . . 0.515 ' N ' ' OG ' ' A' ' 39' ' ' SER . 98.5 m-20 -73.52 175.77 6.74 Favored 'General case' 0 N--CA 1.488 1.467 0 O-C-N 121.398 -0.814 . . . . 0.0 110.134 -179.197 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 88.5 tttt -63.18 -39.97 96.19 Favored 'General case' 0 C--N 1.305 -1.361 0 N-CA-C 109.05 -0.722 . . . . 0.0 109.05 179.512 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -54.81 -46.02 74.47 Favored 'General case' 0 N--CA 1.488 1.468 0 O-C-N 121.352 -0.843 . . . . 0.0 109.416 -179.944 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 43' ' ' HIS . . . . . . . . . . . . . 15.3 t-80 -61.24 -41.56 97.09 Favored 'General case' 0 C--N 1.303 -1.426 0 O-C-N 121.29 -0.881 . . . . 0.0 109.263 179.653 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 44' ' ' LEU . . . . . 0.405 HD21 ' N ' ' A' ' 38' ' ' GLY . 96.5 mt -64.41 -39.59 94.13 Favored 'General case' 0 N--CA 1.49 1.526 0 O-C-N 121.459 -0.776 . . . . 0.0 109.656 -179.929 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 97.2 mt-10 -59.39 -41.15 88.71 Favored 'General case' 0 N--CA 1.488 1.462 0 O-C-N 121.178 -0.951 . . . . 0.0 109.847 -179.69 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . -62.81 -46.72 93.04 Favored Glycine 0 N--CA 1.49 2.285 0 N-CA-C 109.162 -1.575 . . . . 0.0 109.162 179.75 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 25.6 mtpp -67.29 -33.12 74.63 Favored 'General case' 0 N--CA 1.488 1.46 0 O-C-N 121.505 -0.997 . . . . 0.0 109.356 179.224 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 44.0 tp -57.55 -38.33 74.57 Favored 'General case' 0 N--CA 1.488 1.467 0 O-C-N 121.518 -0.739 . . . . 0.0 109.399 -179.056 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 49' ' ' ALA . . . . . . . . . . . . . . . -52.15 -40.48 61.47 Favored 'General case' 0 C--N 1.302 -1.46 0 O-C-N 121.26 -0.9 . . . . 0.0 109.998 -179.682 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 75.9 mt-10 -68.01 -40.96 82.88 Favored 'General case' 0 N--CA 1.491 1.586 0 O-C-N 121.138 -0.977 . . . . 0.0 109.629 179.955 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 51' ' ' TYR . . . . . 0.471 ' OH ' ' N ' ' A' ' 99' ' ' ALA . 8.1 m-85 -61.98 -44.9 95.78 Favored 'General case' 0 N--CA 1.49 1.525 0 O-C-N 121.441 -0.787 . . . . 0.0 109.232 179.934 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 52' ' ' ILE . . . . . . . . . . . . . 96.0 mt -63.97 -43.19 97.6 Favored 'Isoleucine or valine' 0 C--N 1.303 -1.422 0 O-C-N 121.513 -0.742 . . . . 0.0 109.771 -179.816 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 79.9 p -59.49 -39.89 85.24 Favored 'General case' 0 N--CA 1.49 1.562 0 O-C-N 121.147 -0.971 . . . . 0.0 110.028 -179.193 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 54' ' ' LEU . . . . . . . . . . . . . 95.0 mt -63.26 -41.84 99.09 Favored 'General case' 0 N--CA 1.489 1.478 0 O-C-N 121.154 -0.967 . . . . 0.0 109.122 179.8 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 55' ' ' ALA . . . . . 0.417 ' HB2' ' CE1' ' A' ' 91' ' ' PHE . . . -64.11 -41.5 97.23 Favored 'General case' 0 N--CA 1.488 1.437 0 O-C-N 121.42 -0.8 . . . . 0.0 109.502 179.911 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 56' ' ' LYS . . . . . . . . . . . . . 56.5 mtpt -65.37 -43.7 89.95 Favored 'General case' 0 N--CA 1.489 1.514 0 O-C-N 121.377 -0.827 . . . . 0.0 109.461 179.728 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 60.7 tt0 -67.34 -43.76 80.73 Favored 'General case' 0 N--CA 1.488 1.456 0 O-C-N 121.408 -0.807 . . . . 0.0 109.377 -179.762 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 58' ' ' VAL . . . . . 0.475 ' CG1' ' OE1' ' A' ' 87' ' ' GLU . 53.6 t -64.63 -45.61 94.88 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.405 0 O-C-N 121.461 -0.774 . . . . 0.0 109.523 179.999 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 59' ' ' TYR . . . . . . . . . . . . . 56.6 t80 -131.98 123.27 27.01 Favored 'General case' 0 N--CA 1.497 1.902 0 O-C-N 121.479 -0.763 . . . . 0.0 109.619 -179.536 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -70.51 144.44 51.36 Favored 'General case' 0 N--CA 1.491 1.612 0 O-C-N 121.544 -0.722 . . . . 0.0 110.898 -179.436 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 61' ' ' ASN . . . . . . . . . . . . . 11.2 t-20 57.94 40.96 25.21 Favored 'General case' 0 N--CA 1.491 1.591 0 O-C-N 121.525 -0.734 . . . . 0.0 109.115 179.594 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 62' ' ' VAL . . . . . . . . . . . . . 11.5 p -75.98 132.32 33.32 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.501 0 O-C-N 121.595 -0.691 . . . . 0.0 110.046 -179.718 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 97.4 mt-10 -90.91 150.74 21.39 Favored 'General case' 0 N--CA 1.492 1.652 0 O-C-N 121.437 -0.789 . . . . 0.0 109.638 -179.89 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 64' ' ' TYR . . . . . 0.45 ' C ' ' OE1' ' A' ' 65' ' ' GLU . 53.9 p90 -156.4 164.07 38.72 Favored 'General case' 0 N--CA 1.49 1.544 0 O-C-N 121.175 -0.953 . . . . 0.0 110.207 -179.729 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 65' ' ' GLU . . . . . 0.764 ' CD ' HD11 ' A' ' 25' ' ' ILE . 1.8 pm0 -152.61 156.64 39.67 Favored 'General case' 0 N--CA 1.49 1.529 0 N-CA-C 108.634 -0.876 . . . . 0.0 108.634 -179.465 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 66' ' ' VAL . . . . . . . . . . . . . 2.6 p -123.19 129.57 74.85 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.86 0 CA-C-O 121.533 0.683 . . . . 0.0 109.465 -179.82 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 67' ' ' ALA . . . . . 0.467 ' HB1' ' HD2' ' A' ' 68' ' ' PRO . . . -75.96 160.68 77.99 Favored Pre-proline 0 N--CA 1.488 1.469 0 O-C-N 121.607 -0.683 . . . . 0.0 109.333 -179.78 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 68' ' ' PRO . . . . . 0.467 ' HD2' ' HB1' ' A' ' 67' ' ' ALA . 21.4 Cg_endo -59.76 111.83 1.08 Allowed 'Trans proline' 0 N--CA 1.495 1.61 0 C-N-CA 122.831 2.354 . . . . 0.0 111.738 179.905 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 69' ' ' VAL . . . . . . . . . . . . . 56.0 t -124.66 134.61 66.35 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.917 0 N-CA-C 109.136 -0.69 . . . . 0.0 109.136 179.987 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -67.02 149.83 50.08 Favored 'General case' 0 C--N 1.304 -1.41 0 O-C-N 121.527 -0.733 . . . . 0.0 110.27 -179.625 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 71' ' ' ASP . . . . . 0.547 ' OD1' ' N ' ' A' ' 72' ' ' ASN . 48.2 p-10 -64.75 -29.51 70.49 Favored 'General case' 0 N--CA 1.488 1.456 0 O-C-N 121.565 -0.709 . . . . 0.0 109.566 179.797 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 72' ' ' ASN . . . . . 0.547 ' N ' ' OD1' ' A' ' 71' ' ' ASP . 89.2 m-20 -90.27 8.28 34.04 Favored 'General case' 0 N--CA 1.49 1.548 0 O-C-N 121.299 -0.876 . . . . 0.0 108.959 -179.942 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -68.76 148.75 49.88 Favored 'General case' 0 N--CA 1.49 1.564 0 O-C-N 121.506 -0.746 . . . . 0.0 110.464 -179.613 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 74' ' ' THR . . . . . . . . . . . . . 12.7 p -100.27 3.71 43.68 Favored 'General case' 0 N--CA 1.494 1.764 0 O-C-N 121.451 -0.78 . . . . 0.0 109.471 179.821 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 22.2 pt-20 -142.28 160.96 39.22 Favored 'General case' 0 N--CA 1.495 1.819 0 O-C-N 121.137 -0.977 . . . . 0.0 109.55 179.796 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 9.9 tp -127.55 135.03 49.76 Favored 'General case' 0 N--CA 1.493 1.717 0 O-C-N 121.636 -0.665 . . . . 0.0 109.285 -179.88 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 77' ' ' HIS . . . . . . . . . . . . . 75.1 m80 -108.4 128.63 54.94 Favored 'General case' 0 N--CA 1.494 1.768 0 N-CA-C 109.16 -0.681 . . . . 0.0 109.16 179.699 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -151.79 154.57 36.49 Favored 'General case' 0 N--CA 1.489 1.506 0 O-C-N 121.258 -0.901 . . . . 0.0 109.369 179.992 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 79' ' ' ARG . . . . . 0.455 ' O ' ' OE2' ' A' ' 65' ' ' GLU . 84.5 mtt85 -128.74 150.43 50.28 Favored 'General case' 0 N--CA 1.493 1.724 0 N-CA-C 109.311 -0.626 . . . . 0.0 109.311 -179.834 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 80' ' ' PHE . . . . . . . . . . . . . 83.1 m-85 -130.58 147.75 52.3 Favored 'General case' 0 N--CA 1.494 1.774 0 O-C-N 121.609 -0.682 . . . . 0.0 109.22 -179.742 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 49.5 mttm -113.67 139.05 49.38 Favored 'General case' 0 N--CA 1.495 1.819 0 N-CA-C 109.173 -0.676 . . . . 0.0 109.173 179.833 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 82' ' ' PHE . . . . . . . . . . . . . 79.2 m-85 -133.19 158.8 41.95 Favored 'General case' 0 N--CA 1.495 1.786 0 CA-C-O 121.496 0.665 . . . . 0.0 109.872 -179.582 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 81.7 tt0 -65.52 -37.66 87.42 Favored 'General case' 0 C--N 1.303 -1.423 0 O-C-N 121.543 -0.723 . . . . 0.0 109.559 179.953 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 84' ' ' VAL . . . . . . . . . . . . . 35.7 m -136.08 159.56 38.89 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.961 0 O-C-N 121.378 -0.826 . . . . 0.0 110.282 -179.549 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 85' ' ' SER . . . . . 0.509 ' O ' ' N ' ' A' ' 88' ' ' LYS . 38.6 t -64.77 -38.95 92.71 Favored 'General case' 0 N--CA 1.49 1.556 0 O-C-N 121.791 -0.568 . . . . 0.0 110.191 -179.946 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 86' ' ' ALA . . . . . . . . . . . . . . . -40.8 -39.46 1.12 Allowed 'General case' 0 N--CA 1.494 1.767 0 O-C-N 121.607 -0.683 . . . . 0.0 110.24 -179.353 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 87' ' ' GLU . . . . . 0.475 ' OE1' ' CG1' ' A' ' 58' ' ' VAL . 79.5 mm-40 -66.02 -34.03 77.16 Favored 'General case' 0 N--CA 1.488 1.432 0 O-C-N 121.508 -0.745 . . . . 0.0 109.477 179.751 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 88' ' ' LYS . . . . . 0.509 ' N ' ' O ' ' A' ' 85' ' ' SER . 88.5 tttt -62.15 -44.9 95.61 Favored 'General case' 0 N--CA 1.489 1.509 0 O-C-N 121.297 -0.877 . . . . 0.0 109.936 -179.988 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 50.7 tp -62.56 -50.35 71.68 Favored 'General case' 0 N--CA 1.489 1.483 0 O-C-N 121.271 -0.893 . . . . 0.0 110.234 -178.905 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 90' ' ' ILE . . . . . 0.543 ' N ' HD12 ' A' ' 90' ' ' ILE . 1.4 mp -69.27 -45.42 79.27 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.567 0 O-C-N 121.302 -0.874 . . . . 0.0 109.853 -179.684 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 91' ' ' PHE . . . . . 0.417 ' CE1' ' HB2' ' A' ' 55' ' ' ALA . 69.7 t80 -62.59 -44.66 95.76 Favored 'General case' 0 N--CA 1.489 1.51 0 O-C-N 121.388 -0.82 . . . . 0.0 110.168 -179.551 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 92' ' ' GLU . . . . . 0.515 ' OE2' ' NH2' ' A' ' 96' ' ' ARG . 83.0 tt0 -62.36 -38.74 90.71 Favored 'General case' 0 C--N 1.305 -1.369 0 O-C-N 121.358 -0.839 . . . . 0.0 109.95 -179.36 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 93' ' ' LEU . . . . . . . . . . . . . 39.3 mt -63.2 -44.4 95.43 Favored 'General case' 0 N--CA 1.49 1.55 0 O-C-N 121.209 -0.932 . . . . 0.0 109.97 -179.574 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 94' ' ' LYS . . . . . . . . . . . . . 60.9 mttp -66.32 -44.15 84.19 Favored 'General case' 0 N--CA 1.488 1.467 0 O-C-N 121.183 -0.948 . . . . 0.0 110.128 -179.993 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 34.3 p -68.31 -35.82 78.39 Favored 'General case' 0 N--CA 1.487 1.423 0 O-C-N 121.338 -0.851 . . . . 0.0 109.714 -179.654 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 96' ' ' ARG . . . . . 0.515 ' NH2' ' OE2' ' A' ' 92' ' ' GLU . 19.3 tpp180 -68.08 -39.53 82.91 Favored 'General case' 0 N--CA 1.488 1.467 0 O-C-N 121.197 -0.94 . . . . 0.0 108.773 179.608 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 97' ' ' ALA . . . . . . . . . . . . . . . -56.59 -48.04 78.27 Favored 'General case' 0 N--CA 1.486 1.372 0 O-C-N 121.337 -0.852 . . . . 0.0 109.097 179.935 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 98' ' ' LEU . . . . . . . . . . . . . 91.7 mt -63.94 -41.43 97.61 Favored 'General case' 0 N--CA 1.486 1.366 0 O-C-N 121.487 -0.758 . . . . 0.0 109.436 179.559 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 99' ' ' ALA . . . . . 0.471 ' N ' ' OH ' ' A' ' 51' ' ' TYR . . . -64.49 -32.42 74.04 Favored 'General case' 0 N--CA 1.489 1.479 0 O-C-N 121.471 -0.768 . . . . 0.0 109.875 -179.837 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 100' ' ' ARG . . . . . . . . . . . . . 5.9 mmp_? -88.96 1.51 55.35 Favored 'General case' 0 N--CA 1.491 1.6 0 O-C-N 121.243 -0.911 . . . . 0.0 109.089 -179.978 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 101' ' ' LEU . . . . . . . . . . . . . 57.2 tp -63.28 -42.72 99.14 Favored 'General case' 0 C--N 1.304 -1.404 0 O-C-N 121.51 -0.744 . . . . 0.0 109.662 -179.912 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 102' ' ' GLU . . . . . . . . . . . . . 99.0 mt-10 -96.35 120.7 37.14 Favored 'General case' 0 N--CA 1.495 1.778 0 O-C-N 121.216 -0.928 . . . . 0.0 109.787 -179.484 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 103' ' ' HIS . . . . . . . . . . . . . 82.6 t60 -99.41 68.89 1.64 Allowed 'General case' 0 N--CA 1.494 1.761 0 O-C-N 121.468 -0.77 . . . . 0.0 109.73 -179.752 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 104' ' ' HIS . . . . . 0.439 ' O ' ' O ' ' A' ' 105' ' ' HIS . 73.6 m-70 -88.3 -13.69 40.18 Favored 'General case' 0 N--CA 1.49 1.552 0 N-CA-C 108.837 -0.801 . . . . 0.0 108.837 179.413 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 105' ' ' HIS . . . . . 0.439 ' O ' ' O ' ' A' ' 104' ' ' HIS . 46.1 t-80 56.59 154.97 0.01 OUTLIER 'General case' 0 N--CA 1.493 1.722 0 CA-C-O 121.597 0.713 . . . . 0.0 110.705 179.285 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 106' ' ' HIS . . . . . . . . . . . . . 76.1 m80 -78.22 132.36 37.52 Favored 'General case' 0 N--CA 1.491 1.601 0 O-C-N 121.504 -0.747 . . . . 0.0 110.445 -179.28 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 107' ' ' HIS . . . . . . . . . . . . . 58.9 t-80 -66.6 -42.57 86.7 Favored 'General case' 0 N--CA 1.489 1.495 0 O-C-N 121.525 -0.734 . . . . 0.0 109.168 179.485 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 108' ' ' HIS . . . . . 0.479 ' CG ' ' O ' ' A' ' 108' ' ' HIS . 81.9 t60 . . . . . 0 N--CA 1.489 1.49 0 CA-C-O 118.016 -0.992 . . . . 0.0 109.86 -179.975 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 97.4 mmm . . . . . 0 N--CA 1.489 1.505 0 N-CA-C 109.073 -0.714 . . . . 0.0 109.073 . . . . . . . . . 0 0 . 1 . 004 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 28.0 t -65.19 141.55 58.63 Favored 'General case' 0 N--CA 1.489 1.483 0 O-C-N 121.452 -0.78 . . . . 0.0 110.191 -179.425 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 3' ' ' ASN . . . . . 0.416 ' OD1' ' N ' ' A' ' 4' ' ' GLN . 48.4 p30 -70.01 -14.1 62.53 Favored 'General case' 0 N--CA 1.49 1.553 0 O-C-N 121.451 -0.781 . . . . 0.0 109.52 179.816 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 4' ' ' GLN . . . . . 0.416 ' N ' ' OD1' ' A' ' 3' ' ' ASN . 65.6 tp60 -160.55 90.74 0.88 Allowed 'General case' 0 N--CA 1.49 1.571 0 O-C-N 121.054 -1.029 . . . . 0.0 108.989 179.65 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 27.6 m -64.55 135.17 55.72 Favored 'General case' 0 N--CA 1.491 1.597 0 O-C-N 121.344 -0.847 . . . . 0.0 110.007 -179.383 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 37.2 m -93.9 133.85 36.89 Favored 'General case' 0 N--CA 1.495 1.789 0 O-C-N 121.227 -0.921 . . . . 0.0 110.116 -179.581 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 7' ' ' VAL . . . . . . . . . . . . . 7.1 p -147.89 -28.8 0.1 Allowed 'Isoleucine or valine' 0 N--CA 1.494 1.767 0 N-CA-C 108.493 -0.929 . . . . 0.0 108.493 179.406 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 83.2 tt0 -163.18 121.65 2.03 Favored 'General case' 0 N--CA 1.489 1.516 0 O-C-N 121.466 -0.771 . . . . 0.0 109.736 179.675 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 99.0 m-20 -64.3 -39.1 93.24 Favored 'General case' 0 N--CA 1.49 1.528 0 O-C-N 121.456 -0.777 . . . . 0.0 109.653 179.661 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 31.1 tp10 -51.76 150.53 3.94 Favored 'General case' 0 N--CA 1.493 1.705 0 O-C-N 121.387 -0.821 . . . . 0.0 110.488 -178.894 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 4.3 t 61.98 86.23 0.05 OUTLIER 'Isoleucine or valine' 0 N--CA 1.496 1.831 0 O-C-N 121.702 -0.624 . . . . 0.0 109.784 -179.963 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 8.8 t -102.47 -173.64 2.38 Favored 'General case' 0 N--CA 1.496 1.844 0 O-C-N 121.483 -0.761 . . . . 0.0 109.867 -179.863 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 97.8 mt-10 -80.09 3.85 19.09 Favored 'General case' 0 N--CA 1.489 1.487 0 O-C-N 121.434 -0.791 . . . . 0.0 109.225 179.634 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -74.84 -6.32 48.4 Favored 'General case' 0 N--CA 1.489 1.523 0 O-C-N 121.516 -0.74 . . . . 0.0 109.398 179.917 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 92.8 m -63.5 -36.57 84.22 Favored 'General case' 0 C--N 1.305 -1.359 0 O-C-N 121.337 -0.852 . . . . 0.0 108.923 179.631 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 108.46 -142.28 15.99 Favored Glycine 0 N--CA 1.5 2.901 0 N-CA-C 109.082 -1.607 . . . . 0.0 109.082 179.941 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 18.6 t -72.64 129.84 39.19 Favored 'General case' 0 C--N 1.301 -1.508 0 N-CA-C 106.58 -1.637 . . . . 0.0 106.58 178.743 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -73.87 135.52 43.36 Favored 'General case' 0 N--CA 1.496 1.825 0 C-N-CA 118.645 -1.222 . . . . 0.0 111.058 -176.976 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -90.65 108.43 3.56 Favored Glycine 0 N--CA 1.491 2.357 0 N-CA-C 109.691 -1.364 . . . . 0.0 109.691 179.546 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 22.3 pt-20 -85.93 17.38 3.51 Favored 'General case' 0 N--CA 1.49 1.57 0 O-C-N 121.351 -1.087 . . . . 0.0 109.089 179.538 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 21' ' ' ILE . . . . . 0.473 ' O ' ' N ' ' A' ' 23' ' ' PHE . 38.3 pt -80.95 14.43 0.44 Allowed 'Isoleucine or valine' 0 N--CA 1.489 1.519 0 O-C-N 121.469 -0.769 . . . . 0.0 109.332 179.921 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . -42.18 94.51 0.01 OUTLIER Glycine 0 N--CA 1.493 2.482 0 N-CA-C 110.491 -1.043 . . . . 0.0 110.491 -179.406 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 23' ' ' PHE . . . . . 0.473 ' N ' ' O ' ' A' ' 21' ' ' ILE . 0.1 OUTLIER -153.35 -141.16 0.1 Allowed 'General case' 0 N--CA 1.495 1.78 0 O-C-N 121.029 -1.277 . . . . 0.0 109.829 179.756 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 96.6 mt -59.81 139.84 18.8 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.444 0 O-C-N 121.433 -0.792 . . . . 0.0 110.224 -179.184 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 25' ' ' ILE . . . . . . . . . . . . . 97.1 mt -64.32 137.27 25.16 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.521 0 O-C-N 121.561 -0.712 . . . . 0.0 110.367 -179.086 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 63.3 ttm-85 -59.29 143.26 49.86 Favored 'General case' 0 N--CA 1.494 1.757 0 CA-C-O 121.61 0.719 . . . . 0.0 110.466 -179.253 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 96.7 mt-10 -58.56 131.14 49.91 Favored 'General case' 0 N--CA 1.491 1.621 0 O-C-N 121.603 -0.685 . . . . 0.0 110.408 -179.673 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 28' ' ' GLY . . . . . 0.424 ' O ' ' O ' ' A' ' 29' ' ' ASP . . . 177.64 173.2 42.91 Favored Glycine 0 N--CA 1.492 2.387 0 N-CA-C 109.511 -1.435 . . . . 0.0 109.511 179.683 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 29' ' ' ASP . . . . . 0.424 ' O ' ' O ' ' A' ' 28' ' ' GLY . 98.9 m-20 45.02 -172.38 0.01 OUTLIER 'General case' 0 N--CA 1.496 1.852 0 O-C-N 121.46 -1.024 . . . . 0.0 111.0 179.452 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 99.6 m-20 -82.74 88.43 6.74 Favored 'General case' 0 N--CA 1.49 1.543 0 O-C-N 121.602 -0.686 . . . . 0.0 109.44 -179.468 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 31' ' ' VAL . . . . . 0.443 HG22 ' N ' ' A' ' 32' ' ' ALA . 9.2 p -86.16 161.34 2.98 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.635 0 O-C-N 121.34 -0.85 . . . . 0.0 109.608 -179.67 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 32' ' ' ALA . . . . . 0.443 ' N ' HG22 ' A' ' 31' ' ' VAL . . . -143.61 139.42 29.63 Favored 'General case' 0 N--CA 1.493 1.721 0 O-C-N 121.294 -0.879 . . . . 0.0 109.016 179.835 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 83.7 tt0 -101.38 142.75 32.33 Favored 'General case' 0 N--CA 1.494 1.755 0 O-C-N 121.403 -0.81 . . . . 0.0 109.132 179.989 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 34' ' ' VAL . . . . . . . . . . . . . 52.4 t -122.54 131.56 72.97 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.905 0 N-CA-C 108.905 -0.776 . . . . 0.0 108.905 179.812 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 35.3 m -111.17 123.41 50.15 Favored 'General case' 0 N--CA 1.494 1.735 0 N-CA-C 108.658 -0.867 . . . . 0.0 108.658 179.904 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 26.3 mt -119.23 149.41 41.81 Favored 'General case' 0 N--CA 1.497 1.887 0 O-C-N 121.501 -0.75 . . . . 0.0 109.649 -179.436 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 37' ' ' PHE . . . . . . . . . . . . . 97.0 m-85 -128.74 147.36 50.76 Favored 'General case' 0 N--CA 1.493 1.717 0 N-CA-C 109.083 -0.71 . . . . 0.0 109.083 -179.405 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . -177.79 -177.65 46.75 Favored Glycine 0 N--CA 1.487 2.091 0 N-CA-C 109.474 -1.45 . . . . 0.0 109.474 -179.865 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 8.7 p -87.48 -81.64 0.23 Allowed 'General case' 0 N--CA 1.489 1.498 0 O-C-N 121.387 -1.066 . . . . 0.0 109.824 -179.911 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 40' ' ' ASP . . . . . . . . . . . . . 52.4 p30 -87.78 168.51 12.89 Favored 'General case' 0 N--CA 1.493 1.724 0 O-C-N 121.464 -0.772 . . . . 0.0 110.399 -179.445 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 88.6 tttt -65.93 -36.63 83.9 Favored 'General case' 0 N--CA 1.49 1.555 0 O-C-N 121.674 -0.641 . . . . 0.0 110.188 179.883 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -57.64 -41.62 81.76 Favored 'General case' 0 N--CA 1.492 1.629 0 O-C-N 121.272 -0.893 . . . . 0.0 110.155 -179.106 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 43' ' ' HIS . . . . . . . . . . . . . 80.0 t60 -63.39 -42.13 98.79 Favored 'General case' 0 N--CA 1.489 1.516 0 O-C-N 121.169 -0.957 . . . . 0.0 109.42 -179.788 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 95.3 mt -63.47 -40.54 97.39 Favored 'General case' 0 N--CA 1.489 1.514 0 O-C-N 121.399 -0.813 . . . . 0.0 109.827 -179.671 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 74.5 mt-10 -62.75 -39.68 94.9 Favored 'General case' 0 N--CA 1.488 1.437 0 O-C-N 121.239 -0.913 . . . . 0.0 109.759 -179.639 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . -65.01 -45.17 93.1 Favored Glycine 0 N--CA 1.49 2.287 0 N-CA-C 109.671 -1.372 . . . . 0.0 109.671 -179.844 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 16.9 tptm -64.95 -36.03 83.07 Favored 'General case' 0 N--CA 1.489 1.509 0 O-C-N 121.27 -1.135 . . . . 0.0 109.236 179.882 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 60.8 tp -61.73 -39.5 91.74 Favored 'General case' 0 N--CA 1.488 1.451 0 O-C-N 121.339 -0.851 . . . . 0.0 109.345 -179.707 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 49' ' ' ALA . . . . . . . . . . . . . . . -54.03 -34.01 58.81 Favored 'General case' 0 N--CA 1.488 1.468 0 O-C-N 121.336 -0.852 . . . . 0.0 109.823 -179.627 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 79.3 mm-40 -65.31 -41.04 94.46 Favored 'General case' 0 N--CA 1.491 1.599 0 O-C-N 121.226 -0.921 . . . . 0.0 109.713 -179.981 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 10.8 m-85 -60.78 -39.67 89.72 Favored 'General case' 0 N--CA 1.491 1.581 0 O-C-N 121.487 -0.758 . . . . 0.0 109.552 -179.631 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 52' ' ' ILE . . . . . 0.522 HD12 ' CE1' ' A' ' 64' ' ' TYR . 34.1 mm -63.59 -43.51 98.25 Favored 'Isoleucine or valine' 0 C--N 1.301 -1.536 0 O-C-N 121.39 -0.819 . . . . 0.0 109.491 -179.484 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 53' ' ' SER . . . . . 0.481 ' O ' ' NE2' ' A' ' 57' ' ' GLN . 71.1 m -60.32 -51.7 68.4 Favored 'General case' 0 N--CA 1.492 1.674 0 O-C-N 121.081 -1.012 . . . . 0.0 110.136 -179.488 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 54' ' ' LEU . . . . . 0.444 ' N ' HD12 ' A' ' 54' ' ' LEU . 10.4 mp -65.07 -41.68 94.86 Favored 'General case' 0 N--CA 1.491 1.587 0 O-C-N 121.166 -0.958 . . . . 0.0 109.418 179.785 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -64.67 -39.38 93.57 Favored 'General case' 0 N--CA 1.488 1.428 0 O-C-N 121.282 -0.886 . . . . 0.0 109.731 -179.692 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 56' ' ' LYS . . . . . . . . . . . . . 50.9 tttp -64.08 -45.17 89.91 Favored 'General case' 0 C--N 1.305 -1.36 0 O-C-N 121.237 -0.915 . . . . 0.0 109.393 -179.94 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 57' ' ' GLN . . . . . 0.534 ' OE1' ' N ' ' A' ' 57' ' ' GLN . 0.8 OUTLIER -65.73 -43.78 87.99 Favored 'General case' 0 N--CA 1.488 1.439 0 O-C-N 121.418 -0.801 . . . . 0.0 109.508 -179.853 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 58' ' ' VAL . . . . . . . . . . . . . 56.0 t -63.35 -45.81 97.14 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.39 0 O-C-N 121.25 -0.906 . . . . 0.0 109.453 -179.801 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 59' ' ' TYR . . . . . . . . . . . . . 71.4 t80 -137.79 119.11 14.65 Favored 'General case' 0 N--CA 1.494 1.752 0 O-C-N 121.334 -0.854 . . . . 0.0 109.578 -179.502 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -69.75 153.53 43.24 Favored 'General case' 0 N--CA 1.493 1.682 0 O-C-N 121.563 -0.71 . . . . 0.0 110.538 -179.486 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 61' ' ' ASN . . . . . . . . . . . . . 98.2 m-20 57.73 36.44 26.57 Favored 'General case' 0 N--CA 1.494 1.746 0 O-C-N 121.752 -0.592 . . . . 0.0 109.671 179.897 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 62' ' ' VAL . . . . . . . . . . . . . 12.3 p -72.65 138.45 21.44 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.583 0 O-C-N 121.436 -0.79 . . . . 0.0 109.858 179.933 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 83.1 tt0 -115.61 142.19 47.07 Favored 'General case' 0 N--CA 1.497 1.921 0 O-C-N 121.571 -0.705 . . . . 0.0 109.313 -179.878 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 64' ' ' TYR . . . . . 0.522 ' CE1' HD12 ' A' ' 52' ' ' ILE . 51.4 p90 -148.29 161.27 41.86 Favored 'General case' 0 N--CA 1.493 1.709 0 O-C-N 121.365 -0.834 . . . . 0.0 109.539 -179.866 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 51.1 tp10 -141.0 147.76 39.21 Favored 'General case' 0 N--CA 1.495 1.799 0 N-CA-C 108.687 -0.857 . . . . 0.0 108.687 179.911 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 66' ' ' VAL . . . . . . . . . . . . . 28.8 m -117.82 129.08 74.77 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.805 0 CA-C-O 121.688 0.756 . . . . 0.0 109.953 -179.472 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 67' ' ' ALA . . . . . 0.625 ' HB1' ' HD2' ' A' ' 68' ' ' PRO . . . -70.65 171.81 7.44 Favored Pre-proline 0 N--CA 1.49 1.558 0 O-C-N 121.657 -0.652 . . . . 0.0 109.61 -179.417 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 68' ' ' PRO . . . . . 0.625 ' HD2' ' HB1' ' A' ' 67' ' ' ALA . 73.2 Cg_exo -50.86 129.89 29.2 Favored 'Trans proline' 0 N--CA 1.497 1.7 0 C-N-CA 122.355 2.037 . . . . 0.0 112.399 179.891 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 69' ' ' VAL . . . . . . . . . . . . . 54.4 t -131.04 134.42 61.53 Favored 'Isoleucine or valine' 0 N--CA 1.499 2.016 0 O-C-N 121.455 -0.778 . . . . 0.0 109.247 179.814 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -83.36 159.73 21.78 Favored 'General case' 0 N--CA 1.491 1.577 0 O-C-N 121.434 -0.792 . . . . 0.0 109.897 -179.913 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 53.3 t0 -64.12 -36.08 82.85 Favored 'General case' 0 N--CA 1.491 1.604 0 O-C-N 121.5 -0.75 . . . . 0.0 109.662 179.562 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 72' ' ' ASN . . . . . . . . . . . . . 55.7 p30 -96.67 17.33 16.69 Favored 'General case' 0 N--CA 1.495 1.778 0 O-C-N 121.235 -0.916 . . . . 0.0 109.237 -179.726 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -61.88 144.23 55.23 Favored 'General case' 0 N--CA 1.492 1.64 0 O-C-N 121.414 -0.804 . . . . 0.0 110.167 -179.641 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 74' ' ' THR . . . . . . . . . . . . . 71.8 p -101.79 -3.07 28.69 Favored 'General case' 0 N--CA 1.496 1.826 0 O-C-N 121.48 -0.763 . . . . 0.0 109.467 179.703 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 17.0 pt-20 -148.62 158.69 44.31 Favored 'General case' 0 N--CA 1.494 1.744 0 O-C-N 121.145 -0.972 . . . . 0.0 109.361 179.624 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 5.7 tt -131.7 134.52 46.0 Favored 'General case' 0 N--CA 1.496 1.829 0 O-C-N 121.521 -0.737 . . . . 0.0 109.237 -179.981 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 77' ' ' HIS . . . . . . . . . . . . . 98.2 m-70 -103.28 130.59 50.58 Favored 'General case' 0 N--CA 1.494 1.738 0 N-CA-C 109.255 -0.646 . . . . 0.0 109.255 -179.642 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -142.53 155.01 44.98 Favored 'General case' 0 N--CA 1.494 1.725 0 O-C-N 121.286 -0.884 . . . . 0.0 109.517 -179.726 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 83.9 mtp180 -127.95 148.11 50.5 Favored 'General case' 0 N--CA 1.494 1.745 0 N-CA-C 108.957 -0.757 . . . . 0.0 108.957 -179.86 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 80' ' ' PHE . . . . . . . . . . . . . 62.4 m-85 -129.33 147.83 51.2 Favored 'General case' 0 N--CA 1.496 1.862 0 O-C-N 121.555 -0.716 . . . . 0.0 109.285 -179.572 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 70.9 mmtt -112.6 104.1 12.18 Favored 'General case' 0 N--CA 1.496 1.827 0 N-CA-C 108.79 -0.818 . . . . 0.0 108.79 -179.996 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 82' ' ' PHE . . . . . . . . . . . . . 68.1 m-85 -98.91 148.92 23.47 Favored 'General case' 0 N--CA 1.492 1.636 0 O-C-N 121.591 -0.693 . . . . 0.0 109.871 -179.263 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 82.9 tt0 -65.4 -36.82 85.13 Favored 'General case' 0 N--CA 1.488 1.431 0 O-C-N 121.48 -0.762 . . . . 0.0 109.904 -179.648 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 84' ' ' VAL . . . . . . . . . . . . . 27.4 m -133.49 156.86 42.13 Favored 'Isoleucine or valine' 0 N--CA 1.499 2.021 0 O-C-N 121.333 -0.854 . . . . 0.0 110.073 -179.582 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 27.1 t -70.15 -17.43 63.18 Favored 'General case' 0 N--CA 1.488 1.443 0 O-C-N 121.573 -0.704 . . . . 0.0 109.529 179.899 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 86' ' ' ALA . . . . . . . . . . . . . . . -62.43 -41.17 98.52 Favored 'General case' 0 N--CA 1.49 1.528 0 O-C-N 121.256 -0.902 . . . . 0.0 109.537 -179.722 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 98.9 mt-10 -65.59 -33.51 76.07 Favored 'General case' 0 C--N 1.302 -1.475 0 O-C-N 121.458 -0.776 . . . . 0.0 109.024 179.642 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 88' ' ' LYS . . . . . . . . . . . . . 88.2 tttt -62.98 -43.96 97.36 Favored 'General case' 0 C--N 1.303 -1.433 0 O-C-N 121.449 -0.782 . . . . 0.0 109.979 179.836 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 96.3 mt -62.42 -48.11 81.13 Favored 'General case' 0 N--CA 1.488 1.427 0 O-C-N 121.193 -0.942 . . . . 0.0 109.884 -179.04 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 90' ' ' ILE . . . . . 0.53 ' N ' HD12 ' A' ' 90' ' ' ILE . 1.4 mp -70.58 -44.44 76.8 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.599 0 O-C-N 121.3 -0.875 . . . . 0.0 109.312 179.639 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 91' ' ' PHE . . . . . 0.456 ' O ' HG23 ' A' ' 95' ' ' THR . 70.6 t80 -59.13 -44.56 92.03 Favored 'General case' 0 C--N 1.299 -1.606 0 O-C-N 121.461 -0.774 . . . . 0.0 109.883 -179.196 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 92' ' ' GLU . . . . . . . . . . . . . 42.8 tp10 -63.18 -59.09 5.22 Favored 'General case' 0 N--CA 1.49 1.527 0 O-C-N 121.26 -0.9 . . . . 0.0 110.3 -179.322 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 93' ' ' LEU . . . . . 0.445 ' N ' HD12 ' A' ' 93' ' ' LEU . 8.8 mp -63.1 -42.67 99.63 Favored 'General case' 0 N--CA 1.492 1.65 0 O-C-N 121.315 -0.866 . . . . 0.0 109.954 -179.347 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 94' ' ' LYS . . . . . . . . . . . . . 64.2 tttp -62.86 -45.29 93.27 Favored 'General case' 0 C--N 1.301 -1.505 0 O-C-N 121.298 -0.876 . . . . 0.0 109.834 -179.682 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 95' ' ' THR . . . . . 0.456 HG23 ' O ' ' A' ' 91' ' ' PHE . 22.0 p -65.97 -43.03 89.08 Favored 'General case' 0 N--CA 1.488 1.452 0 O-C-N 121.117 -0.989 . . . . 0.0 109.354 179.709 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 96' ' ' ARG . . . . . . . . . . . . . 93.0 mtt-85 -64.35 -38.51 91.29 Favored 'General case' 0 N--CA 1.487 1.381 0 O-C-N 121.278 -0.889 . . . . 0.0 109.02 179.36 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 97' ' ' ALA . . . . . . . . . . . . . . . -63.01 -39.89 96.11 Favored 'General case' 0 C--N 1.304 -1.388 0 O-C-N 121.537 -0.727 . . . . 0.0 109.182 179.756 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 98' ' ' LEU . . . . . . . . . . . . . 6.3 tt -63.46 -45.84 88.97 Favored 'General case' 0 N--CA 1.487 1.382 0 O-C-N 121.395 -0.815 . . . . 0.0 109.201 179.702 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 99' ' ' ALA . . . . . . . . . . . . . . . -68.63 -37.69 79.93 Favored 'General case' 0 C--N 1.302 -1.48 0 O-C-N 121.522 -0.736 . . . . 0.0 109.251 179.568 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 100' ' ' ARG . . . . . 0.421 ' O ' ' O ' ' A' ' 101' ' ' LEU . 8.2 tpt180 -73.69 -16.27 61.21 Favored 'General case' 0 C--N 1.304 -1.395 0 O-C-N 121.539 -0.726 . . . . 0.0 109.308 -179.816 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 101' ' ' LEU . . . . . 0.498 ' O ' ' N ' ' A' ' 103' ' ' HIS . 47.0 tp 58.78 146.61 0.01 OUTLIER 'General case' 0 N--CA 1.488 1.425 0 CA-C-O 121.663 0.744 . . . . 0.0 110.455 -179.983 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 102' ' ' GLU . . . . . . . . . . . . . 47.1 tp10 -53.08 87.33 0.0 OUTLIER 'General case' 0 N--CA 1.489 1.521 0 CA-C-O 121.451 0.643 . . . . 0.0 109.764 -179.684 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 103' ' ' HIS . . . . . 0.498 ' N ' ' O ' ' A' ' 101' ' ' LEU . 86.4 t60 -66.54 -40.05 88.88 Favored 'General case' 0 C--N 1.301 -1.529 0 CA-C-O 121.52 0.676 . . . . 0.0 109.512 179.406 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 104' ' ' HIS . . . . . 0.449 ' O ' ' O ' ' A' ' 105' ' ' HIS . 75.4 m80 -51.1 126.78 17.35 Favored 'General case' 0 N--CA 1.489 1.498 0 O-C-N 121.317 -0.864 . . . . 0.0 110.348 -179.083 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 105' ' ' HIS . . . . . 0.449 ' O ' ' O ' ' A' ' 104' ' ' HIS . 79.0 m80 43.86 -171.17 0.01 OUTLIER 'General case' 0 N--CA 1.493 1.715 0 CA-C-O 121.788 0.804 . . . . 0.0 110.606 179.431 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 106' ' ' HIS . . . . . 0.414 ' CG ' ' O ' ' A' ' 105' ' ' HIS . 98.5 m-70 -155.04 37.3 0.4 Allowed 'General case' 0 N--CA 1.488 1.475 0 N-CA-C 108.277 -1.008 . . . . 0.0 108.277 -179.947 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 107' ' ' HIS . . . . . . . . . . . . . 1.7 p80 -67.81 141.23 56.57 Favored 'General case' 0 N--CA 1.489 1.523 0 O-C-N 121.413 -0.804 . . . . 0.0 110.171 -179.103 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 108' ' ' HIS . . . . . . . . . . . . . 58.8 t-80 . . . . . 0 N--CA 1.492 1.628 0 CA-C-O 118.014 -0.993 . . . . 0.0 109.839 -179.987 . . . . . . . . 0 0 . 1 . 005 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 41.5 tpp . . . . . 0 N--CA 1.49 1.537 0 CA-C-O 121.541 0.686 . . . . 0.0 109.3 . . . . . . . . . 0 0 . 1 . 005 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 40.1 t -67.95 146.0 54.0 Favored 'General case' 0 N--CA 1.491 1.598 0 CA-C-O 121.495 0.664 . . . . 0.0 110.188 -179.727 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 3' ' ' ASN . . . . . . . . . . . . . 93.2 m-20 -63.91 -39.61 94.57 Favored 'General case' 0 N--CA 1.489 1.524 0 N-CA-C 109.217 -0.66 . . . . 0.0 109.217 -179.667 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 4' ' ' GLN . . . . . 0.468 ' O ' ' NE2' ' A' ' 4' ' ' GLN . 5.1 pp0? -95.25 139.25 31.84 Favored 'General case' 0 N--CA 1.494 1.733 0 CA-C-O 121.707 0.765 . . . . 0.0 109.793 -179.769 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 5' ' ' THR . . . . . 0.446 ' O ' ' SG ' ' A' ' 6' ' ' CYS . 11.7 m -101.67 -46.46 4.94 Favored 'General case' 0 N--CA 1.492 1.636 0 N-CA-C 109.13 -0.693 . . . . 0.0 109.13 -179.822 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 6' ' ' CYS . . . . . 0.446 ' SG ' ' O ' ' A' ' 5' ' ' THR . 25.2 m -153.22 168.03 27.33 Favored 'General case' 0 N--CA 1.494 1.746 0 CA-C-O 121.675 0.75 . . . . 0.0 109.899 179.994 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 7' ' ' VAL . . . . . 0.422 HG12 ' H ' ' A' ' 9' ' ' ASN . 14.6 t -76.8 130.53 36.16 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.576 0 CA-C-O 121.706 0.765 . . . . 0.0 110.317 -179.035 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 8' ' ' GLU . . . . . 0.508 ' N ' ' OE1' ' A' ' 8' ' ' GLU . 57.3 mp0 -80.27 20.93 0.63 Allowed 'General case' 0 N--CA 1.49 1.533 0 N-CA-C 109.441 -0.577 . . . . 0.0 109.441 -179.848 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 9' ' ' ASN . . . . . 0.437 ' O ' ' O ' ' A' ' 10' ' ' GLU . 91.0 m-20 56.44 34.89 25.04 Favored 'General case' 0 N--CA 1.493 1.712 0 CA-C-O 121.322 0.582 . . . . 0.0 109.495 179.616 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 10' ' ' GLU . . . . . 0.482 ' OE1' ' N ' ' A' ' 10' ' ' GLU . 56.9 mp0 47.73 177.94 0.01 OUTLIER 'General case' 0 N--CA 1.49 1.55 0 CA-C-O 121.658 0.742 . . . . 0.0 111.129 179.512 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 32.9 m -84.17 135.58 24.54 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.516 0 CA-C-O 121.644 0.735 . . . . 0.0 110.234 -179.083 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 52.6 m 50.4 100.83 0.01 OUTLIER 'General case' 0 N--CA 1.491 1.582 0 CA-C-O 121.735 0.779 . . . . 0.0 110.003 179.984 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 13' ' ' GLU . . . . . 0.406 ' OE1' ' N ' ' A' ' 13' ' ' GLU . 59.1 mp0 -69.88 126.92 31.14 Favored 'General case' 0 N--CA 1.488 1.433 0 CA-C-O 121.765 0.793 . . . . 0.0 110.405 -179.643 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -174.26 -68.16 0.01 OUTLIER 'General case' 0 C--N 1.303 -1.445 0 N-CA-C 109.272 -0.64 . . . . 0.0 109.272 179.517 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 10.5 t -82.77 135.24 35.04 Favored 'General case' 0 N--CA 1.494 1.745 0 CA-C-O 121.704 0.764 . . . . 0.0 110.232 -179.215 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . -157.07 114.57 0.62 Allowed Glycine 0 N--CA 1.489 2.209 0 N-CA-C 110.206 -1.157 . . . . 0.0 110.206 -179.946 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 52.3 t -85.24 84.29 7.72 Favored 'General case' 0 N--CA 1.493 1.721 0 O-C-N 121.776 -0.838 . . . . 0.0 109.682 179.74 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -68.74 140.72 55.36 Favored 'General case' 0 N--CA 1.492 1.655 0 CA-C-O 121.732 0.777 . . . . 0.0 110.415 -179.728 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -70.3 120.38 9.29 Favored Glycine 0 N--CA 1.489 2.232 0 N-CA-C 110.44 -1.064 . . . . 0.0 110.44 -179.448 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 82.5 tt0 -172.03 -23.65 0.01 OUTLIER 'General case' 0 N--CA 1.488 1.465 0 O-C-N 121.974 -0.721 . . . . 0.0 109.215 179.397 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 21' ' ' ILE . . . . . . . . . . . . . 35.4 pt -81.27 141.95 14.46 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.858 0 CA-C-O 121.713 0.768 . . . . 0.0 110.326 -179.853 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . -88.64 123.11 6.63 Favored Glycine 0 N--CA 1.492 2.383 0 N-CA-C 110.542 -1.023 . . . . 0.0 110.542 -179.153 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 23' ' ' PHE . . . . . 0.422 ' O ' ' CD1' ' A' ' 23' ' ' PHE . 53.2 p90 -111.93 132.0 55.03 Favored 'General case' 0 N--CA 1.495 1.806 0 CA-C-O 121.894 0.855 . . . . 0.0 109.741 179.347 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 24' ' ' ILE . . . . . 0.527 ' O ' ' N ' ' A' ' 26' ' ' ARG . 96.4 mt -85.16 -85.64 0.08 OUTLIER 'Isoleucine or valine' 0 N--CA 1.49 1.55 0 CA-C-N 116.032 -0.531 . . . . 0.0 109.576 -179.513 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 25' ' ' ILE . . . . . 0.687 HG22 ' O ' ' A' ' 25' ' ' ILE . 96.2 mt 47.2 10.54 0.03 OUTLIER 'Isoleucine or valine' 0 N--CA 1.495 1.782 0 CA-C-O 121.409 0.623 . . . . 0.0 109.596 -179.554 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 26' ' ' ARG . . . . . 0.527 ' N ' ' O ' ' A' ' 24' ' ' ILE . 41.2 ttm180 -107.05 127.2 53.25 Favored 'General case' 0 N--CA 1.491 1.625 0 O-C-N 121.269 -0.895 . . . . 0.0 110.139 179.839 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 26.0 tt0 57.07 40.44 28.46 Favored 'General case' 0 N--CA 1.491 1.623 0 CA-C-O 121.627 0.727 . . . . 0.0 109.586 179.237 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . -83.24 9.88 59.93 Favored Glycine 0 N--CA 1.494 2.541 0 N-CA-C 109.61 -1.396 . . . . 0.0 109.61 -179.999 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 98.7 m-20 57.09 24.95 10.23 Favored 'General case' 0 N--CA 1.494 1.769 0 CA-C-O 121.439 0.638 . . . . 0.0 109.428 -179.887 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 44.2 p30 -162.82 26.34 0.1 Allowed 'General case' 0 N--CA 1.493 1.7 0 N-CA-C 109.007 -0.738 . . . . 0.0 109.007 178.647 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 31' ' ' VAL . . . . . 0.434 ' CG1' HH21 ' A' ' 79' ' ' ARG . 93.3 t -118.71 134.56 61.93 Favored 'Isoleucine or valine' 0 N--CA 1.499 2.016 0 CA-C-O 121.712 0.768 . . . . 0.0 109.452 -179.822 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -98.88 157.2 16.47 Favored 'General case' 0 N--CA 1.494 1.745 0 CA-C-O 121.787 0.803 . . . . 0.0 110.409 -179.019 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 33' ' ' GLU . . . . . 0.424 ' OE1' ' CD ' ' A' ' 79' ' ' ARG . 48.9 tp10 -108.03 126.0 52.22 Favored 'General case' 0 N--CA 1.493 1.7 0 CA-C-O 121.716 0.769 . . . . 0.0 110.13 -179.186 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 34' ' ' VAL . . . . . . . . . . . . . 54.0 t -124.24 133.62 68.85 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.875 0 CA-C-O 121.629 0.728 . . . . 0.0 109.626 179.635 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 74.0 p -137.03 126.91 25.72 Favored 'General case' 0 N--CA 1.494 1.752 0 CA-C-O 121.854 0.835 . . . . 0.0 110.042 179.276 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 40.0 tp -117.41 132.41 56.58 Favored 'General case' 0 N--CA 1.49 1.527 0 CA-C-O 121.665 0.745 . . . . 0.0 109.788 179.74 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 37' ' ' PHE . . . . . . . . . . . . . 90.7 t80 -109.04 131.1 55.4 Favored 'General case' 0 N--CA 1.493 1.707 0 CA-C-O 121.868 0.842 . . . . 0.0 109.582 179.99 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . -173.14 -164.23 28.15 Favored Glycine 0 N--CA 1.487 2.061 0 N-CA-C 109.867 -1.293 . . . . 0.0 109.867 -179.689 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 22.9 t -62.55 -147.56 0.0 OUTLIER 'General case' 0 N--CA 1.49 1.534 0 O-C-N 121.891 -0.77 . . . . 0.0 110.726 -179.237 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 40' ' ' ASP . . . . . . . . . . . . . 44.6 p-10 -55.94 174.77 0.11 Allowed 'General case' 0 N--CA 1.488 1.444 0 CA-C-O 121.771 0.795 . . . . 0.0 110.807 -178.812 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 88.7 tttt -62.53 -41.16 98.69 Favored 'General case' 0 N--CA 1.49 1.554 0 CA-C-O 121.225 0.536 . . . . 0.0 109.868 -179.075 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -53.67 -46.83 70.76 Favored 'General case' 0 N--CA 1.492 1.647 0 O-C-N 121.897 -0.502 . . . . 0.0 109.978 -178.965 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 43' ' ' HIS . . . . . . . . . . . . . 59.1 t-80 -62.96 -40.8 98.78 Favored 'General case' 0 C--N 1.302 -1.476 0 O-C-N 121.749 -0.595 . . . . 0.0 109.462 -179.619 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 95.1 mt -63.33 -39.99 96.08 Favored 'General case' 0 N--CA 1.491 1.592 0 O-C-N 121.805 -0.559 . . . . 0.0 109.546 -179.702 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 95.1 mt-10 -61.28 -41.02 96.24 Favored 'General case' 0 N--CA 1.49 1.555 0 N-CA-C 109.262 -0.644 . . . . 0.0 109.262 -179.756 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . -61.17 -42.5 99.8 Favored Glycine 0 N--CA 1.492 2.376 0 N-CA-C 109.65 -1.38 . . . . 0.0 109.65 -179.725 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 71.2 mmtt -81.53 -21.14 38.76 Favored 'General case' 0 N--CA 1.492 1.647 0 O-C-N 121.702 -0.881 . . . . 0.0 108.953 -179.801 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 44.9 tp -63.41 -40.15 96.42 Favored 'General case' 0 N--CA 1.489 1.504 0 CA-C-O 121.308 0.575 . . . . 0.0 109.48 -179.694 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 49' ' ' ALA . . . . . . . . . . . . . . . -49.89 -38.16 34.52 Favored 'General case' 0 N--CA 1.492 1.628 0 O-C-N 121.846 -0.534 . . . . 0.0 109.933 -178.635 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 50' ' ' GLU . . . . . 0.458 ' OE1' ' N ' ' A' ' 50' ' ' GLU . 56.5 mp0 -68.01 -43.14 79.5 Favored 'General case' 0 N--CA 1.491 1.581 0 O-C-N 121.635 -0.666 . . . . 0.0 109.777 -179.929 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 10.0 m-85 -63.07 -45.48 91.97 Favored 'General case' 0 N--CA 1.492 1.635 0 N-CA-C 109.58 -0.526 . . . . 0.0 109.58 -179.337 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 52' ' ' ILE . . . . . . . . . . . . . 92.0 mt -64.97 -42.75 95.57 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.531 0 N-CA-C 109.331 -0.618 . . . . 0.0 109.331 -179.746 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 49.6 m -57.43 -41.31 80.21 Favored 'General case' 0 N--CA 1.495 1.776 0 O-C-N 121.815 -0.553 . . . . 0.0 109.608 -179.151 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 54' ' ' LEU . . . . . 0.635 HD22 ' NZ ' ' A' ' 94' ' ' LYS . 82.6 mt -63.35 -40.21 96.64 Favored 'General case' 0 N--CA 1.491 1.584 0 N-CA-C 109.336 -0.616 . . . . 0.0 109.336 179.964 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 55' ' ' ALA . . . . . 0.477 ' HB2' ' CE1' ' A' ' 91' ' ' PHE . . . -59.26 -42.77 91.96 Favored 'General case' 0 N--CA 1.489 1.484 0 N-CA-C 109.194 -0.669 . . . . 0.0 109.194 -179.417 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 56' ' ' LYS . . . . . . . . . . . . . 64.1 tttp -65.46 -41.02 93.85 Favored 'General case' 0 N--CA 1.486 1.339 0 CA-C-O 121.265 0.555 . . . . 0.0 109.624 179.984 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 16.5 tt0 -64.07 -43.75 94.5 Favored 'General case' 0 N--CA 1.491 1.58 0 O-C-N 121.76 -0.587 . . . . 0.0 109.587 -179.274 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 58' ' ' VAL . . . . . . . . . . . . . 72.1 t -65.38 -44.89 94.45 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.563 0 N-CA-C 109.561 -0.533 . . . . 0.0 109.561 -179.708 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 59' ' ' TYR . . . . . 0.417 ' O ' ' O ' ' A' ' 60' ' ' ALA . 58.4 t80 -127.12 132.33 50.61 Favored 'General case' 0 N--CA 1.498 1.945 0 CA-C-O 121.812 0.815 . . . . 0.0 109.611 -179.595 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 60' ' ' ALA . . . . . 0.417 ' O ' ' O ' ' A' ' 59' ' ' TYR . . . -42.34 -97.0 0.0 OUTLIER 'General case' 0 N--CA 1.491 1.593 0 CA-C-O 121.378 0.608 . . . . 0.0 110.739 -179.281 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 61' ' ' ASN . . . . . . . . . . . . . 20.2 t-20 -85.05 92.62 8.4 Favored 'General case' 0 N--CA 1.491 1.581 0 CA-C-O 121.713 0.768 . . . . 0.0 109.856 -178.74 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 62' ' ' VAL . . . . . . . . . . . . . 10.9 p -99.45 133.71 41.27 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.717 0 CA-C-O 121.801 0.81 . . . . 0.0 110.037 179.995 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 81.0 tt0 -105.13 143.7 32.95 Favored 'General case' 0 N--CA 1.49 1.546 0 CA-C-O 121.702 0.763 . . . . 0.0 109.283 179.979 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 64' ' ' TYR . . . . . . . . . . . . . 51.0 p90 -151.96 161.15 43.1 Favored 'General case' 0 C--N 1.303 -1.443 0 CA-C-O 121.962 0.887 . . . . 0.0 110.493 -179.594 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 47.7 tp10 -147.18 146.95 30.04 Favored 'General case' 0 N--CA 1.49 1.57 0 CA-C-O 121.729 0.776 . . . . 0.0 109.32 179.83 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 66' ' ' VAL . . . . . . . . . . . . . 88.4 t -102.57 125.13 56.91 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.707 0 CA-C-O 121.866 0.841 . . . . 0.0 109.935 -179.926 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 67' ' ' ALA . . . . . 0.598 ' HB1' ' HD2' ' A' ' 68' ' ' PRO . . . -76.97 171.08 13.36 Favored Pre-proline 0 C--N 1.304 -1.41 0 CA-C-O 121.227 0.536 . . . . 0.0 109.935 -179.72 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 68' ' ' PRO . . . . . 0.598 ' HD2' ' HB1' ' A' ' 67' ' ' ALA . 51.1 Cg_exo -54.48 137.32 72.38 Favored 'Trans proline' 0 N--CA 1.496 1.62 0 C-N-CA 122.965 2.443 . . . . 0.0 113.057 -179.923 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 69' ' ' VAL . . . . . 0.453 ' C ' ' H ' ' A' ' 71' ' ' ASP . 73.2 t -128.39 131.91 68.57 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.928 0 CA-C-O 121.848 0.832 . . . . 0.0 110.087 179.963 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 70' ' ' ALA . . . . . 0.646 ' O ' ' N ' ' A' ' 72' ' ' ASN . . . -74.8 34.25 0.1 Allowed 'General case' 0 N--CA 1.491 1.6 0 CA-C-N 116.154 -0.475 . . . . 0.0 109.963 179.811 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 71' ' ' ASP . . . . . 0.453 ' H ' ' C ' ' A' ' 69' ' ' VAL . 66.4 t0 54.78 -72.52 0.01 OUTLIER 'General case' 0 N--CA 1.493 1.708 0 CA-C-O 121.448 0.642 . . . . 0.0 109.969 179.693 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 72' ' ' ASN . . . . . 0.783 ' O ' HG23 ' A' ' 74' ' ' THR . 63.8 t30 -84.67 12.54 6.99 Favored 'General case' 0 C--N 1.301 -1.533 0 N-CA-C 108.626 -0.879 . . . . 0.0 108.626 179.941 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 73' ' ' ALA . . . . . 0.512 ' HB2' ' HB3' ' A' ' 70' ' ' ALA . . . -52.16 -6.53 0.05 OUTLIER 'General case' 0 N--CA 1.497 1.902 0 N-CA-C 109.503 -0.554 . . . . 0.0 109.503 179.95 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 74' ' ' THR . . . . . 0.783 HG23 ' O ' ' A' ' 72' ' ' ASN . 70.4 p 51.03 11.59 0.1 Allowed 'General case' 0 C--N 1.304 -1.411 0 CA-C-O 121.469 0.652 . . . . 0.0 109.296 -179.771 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 75' ' ' GLU . . . . . 0.49 ' H ' ' C ' ' A' ' 73' ' ' ALA . 81.9 tt0 -149.63 151.98 34.66 Favored 'General case' 0 C--N 1.302 -1.457 0 CA-C-O 121.666 0.746 . . . . 0.0 109.446 179.582 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 7.2 tt -128.31 131.08 48.67 Favored 'General case' 0 N--CA 1.489 1.493 0 CA-C-O 121.796 0.807 . . . . 0.0 109.798 179.848 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 77' ' ' HIS . . . . . . . . . . . . . 98.3 m-70 -101.91 128.87 48.11 Favored 'General case' 0 N--CA 1.495 1.781 0 CA-C-O 121.906 0.86 . . . . 0.0 109.92 -180.0 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -136.0 152.2 50.69 Favored 'General case' 0 N--CA 1.491 1.595 0 CA-C-O 121.674 0.749 . . . . 0.0 109.88 179.991 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 79' ' ' ARG . . . . . 0.434 HH21 ' CG1' ' A' ' 31' ' ' VAL . 50.1 mmm-85 -127.7 144.53 51.07 Favored 'General case' 0 N--CA 1.494 1.74 0 CA-C-O 121.755 0.788 . . . . 0.0 109.544 -179.25 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 80' ' ' PHE . . . . . . . . . . . . . 82.1 m-85 -130.6 150.78 51.64 Favored 'General case' 0 N--CA 1.494 1.741 0 CA-C-O 121.571 0.7 . . . . 0.0 109.819 -179.385 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 63.1 tttm -114.96 127.9 55.96 Favored 'General case' 0 N--CA 1.495 1.793 0 CA-C-O 121.722 0.772 . . . . 0.0 110.041 -179.514 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 82' ' ' PHE . . . . . . . . . . . . . 81.1 m-85 -129.37 143.9 51.03 Favored 'General case' 0 N--CA 1.496 1.852 0 CA-C-O 121.732 0.777 . . . . 0.0 109.904 179.579 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 6.8 pt-20 -69.39 -34.27 74.27 Favored 'General case' 0 N--CA 1.489 1.491 0 N-CA-C 109.487 -0.56 . . . . 0.0 109.487 -179.672 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 84' ' ' VAL . . . . . . . . . . . . . 26.8 m -131.37 161.03 41.86 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.924 0 CA-C-O 121.885 0.85 . . . . 0.0 110.29 -179.629 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 33.6 m -76.54 -17.48 59.22 Favored 'General case' 0 N--CA 1.492 1.653 0 CA-C-N 116.055 -0.521 . . . . 0.0 109.91 -179.209 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 86' ' ' ALA . . . . . . . . . . . . . . . -62.71 -40.83 98.38 Favored 'General case' 0 N--CA 1.491 1.61 0 N-CA-C 109.129 -0.693 . . . . 0.0 109.129 -179.435 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 97.4 mt-10 -71.69 -32.16 67.54 Favored 'General case' 0 N--CA 1.49 1.541 0 N-CA-C 109.112 -0.699 . . . . 0.0 109.112 179.889 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 88' ' ' LYS . . . . . . . . . . . . . 88.0 tttt -62.84 -47.58 82.76 Favored 'General case' 0 N--CA 1.489 1.506 0 O-C-N 121.789 -0.569 . . . . 0.0 109.51 -179.711 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 96.9 mt -63.76 -45.54 89.33 Favored 'General case' 0 N--CA 1.491 1.587 0 O-C-N 121.745 -0.597 . . . . 0.0 110.151 -179.1 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 90' ' ' ILE . . . . . . . . . . . . . 96.9 mt -68.32 -43.96 84.07 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.636 0 CA-C-O 121.399 0.619 . . . . 0.0 109.41 -179.717 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 91' ' ' PHE . . . . . 0.477 ' CE1' ' HB2' ' A' ' 55' ' ' ALA . 40.3 t80 -61.78 -46.95 87.37 Favored 'General case' 0 N--CA 1.489 1.486 0 N-CA-C 109.28 -0.637 . . . . 0.0 109.28 -179.512 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 92' ' ' GLU . . . . . . . . . . . . . 95.4 mt-10 -67.32 -33.76 75.94 Favored 'General case' 0 N--CA 1.489 1.477 0 N-CA-C 109.142 -0.688 . . . . 0.0 109.142 179.751 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 93' ' ' LEU . . . . . . . . . . . . . 49.4 tp -63.75 -45.68 88.74 Favored 'General case' 0 N--CA 1.487 1.379 0 CA-C-O 121.373 0.606 . . . . 0.0 109.42 -179.559 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 94' ' ' LYS . . . . . 0.635 ' NZ ' HD22 ' A' ' 54' ' ' LEU . 7.9 mtpm? -66.98 -44.02 81.51 Favored 'General case' 0 N--CA 1.489 1.515 0 O-C-N 121.749 -0.595 . . . . 0.0 109.812 -179.446 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 67.0 p -67.53 -33.8 75.81 Favored 'General case' 0 N--CA 1.491 1.622 0 O-C-N 121.783 -0.573 . . . . 0.0 109.773 -179.262 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 96' ' ' ARG . . . . . . . . . . . . . 61.3 ttm-85 -62.62 -43.47 98.73 Favored 'General case' 0 N--CA 1.492 1.656 0 O-C-N 121.676 -0.64 . . . . 0.0 109.508 -179.563 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 97' ' ' ALA . . . . . . . . . . . . . . . -66.79 -34.32 77.56 Favored 'General case' 0 N--CA 1.492 1.647 0 N-CA-C 109.522 -0.547 . . . . 0.0 109.522 -179.661 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 98' ' ' LEU . . . . . 0.553 HD13 ' O ' ' A' ' 98' ' ' LEU . 0.2 OUTLIER -61.86 -45.07 95.36 Favored 'General case' 0 N--CA 1.486 1.33 0 O-C-N 121.542 -0.724 . . . . 0.0 109.131 -178.955 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 99' ' ' ALA . . . . . . . . . . . . . . . -65.88 -36.2 82.77 Favored 'General case' 0 N--CA 1.492 1.626 0 CA-C-O 121.263 0.554 . . . . 0.0 109.63 -179.35 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 100' ' ' ARG . . . . . . . . . . . . . 78.1 ttt180 -68.36 -16.48 63.95 Favored 'General case' 0 N--CA 1.489 1.494 0 N-CA-C 108.692 -0.855 . . . . 0.0 108.692 -179.783 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 101' ' ' LEU . . . . . . . . . . . . . 79.5 mt 53.31 68.19 0.88 Allowed 'General case' 0 N--CA 1.488 1.431 0 CA-C-O 121.558 0.694 . . . . 0.0 109.788 179.678 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 102' ' ' GLU . . . . . . . . . . . . . 97.6 mt-10 -68.66 146.12 53.29 Favored 'General case' 0 N--CA 1.488 1.446 0 CA-C-O 121.657 0.741 . . . . 0.0 110.206 -179.985 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 103' ' ' HIS . . . . . . . . . . . . . 73.9 m80 -74.31 142.29 45.2 Favored 'General case' 0 N--CA 1.488 1.43 0 CA-C-O 121.534 0.683 . . . . 0.0 110.031 -179.547 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 104' ' ' HIS . . . . . . . . . . . . . 78.5 m80 -118.13 154.55 31.93 Favored 'General case' 0 N--CA 1.495 1.792 0 CA-C-O 121.876 0.846 . . . . 0.0 110.284 -179.751 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 105' ' ' HIS . . . . . . . . . . . . . 60.8 m170 -69.8 139.98 53.27 Favored 'General case' 0 N--CA 1.49 1.559 0 CA-C-O 121.588 0.709 . . . . 0.0 109.932 -179.398 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 106' ' ' HIS . . . . . . . . . . . . . 77.1 m80 -61.74 -41.71 98.01 Favored 'General case' 0 C--N 1.302 -1.469 0 N-CA-C 109.648 -0.501 . . . . 0.0 109.648 -179.372 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 107' ' ' HIS . . . . . . . . . . . . . 98.2 m-70 -77.87 137.83 38.59 Favored 'General case' 0 N--CA 1.492 1.665 0 CA-C-O 121.613 0.721 . . . . 0.0 110.035 -179.8 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 108' ' ' HIS . . . . . . . . . . . . . 85.9 t60 . . . . . 0 N--CA 1.491 1.618 0 CA-C-O 117.842 -1.075 . . . . 0.0 109.715 179.85 . . . . . . . . 0 0 . 1 . 006 nuclear build full ' A' A ' 1' ' ' MET . . . . . 0.579 ' SD ' ' N ' ' A' ' 1' ' ' MET . 0.0 OUTLIER . . . . . 0 N--CA 1.489 1.475 0 CA-C-O 121.567 0.699 . . . . 0.0 110.006 . . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 2.0 m 50.28 27.61 2.76 Favored 'General case' 0 N--CA 1.496 1.872 0 CA-C-O 121.454 0.645 . . . . 0.0 109.915 -179.624 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 3' ' ' ASN . . . . . 0.436 ' O ' ' O ' ' A' ' 4' ' ' GLN . 64.1 t30 61.75 123.95 0.01 OUTLIER 'General case' 0 N--CA 1.493 1.683 0 CA-C-O 121.573 0.701 . . . . 0.0 110.038 179.087 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 4' ' ' GLN . . . . . 0.557 ' O ' ' N ' ' A' ' 6' ' ' CYS . 88.1 mt-30 -50.88 -102.11 0.0 OUTLIER 'General case' 0 N--CA 1.49 1.535 0 CA-C-O 121.378 0.609 . . . . 0.0 109.596 -179.398 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 5' ' ' THR . . . . . 0.418 HG22 ' N ' ' A' ' 6' ' ' CYS . 75.1 m 41.39 -90.17 0.01 OUTLIER 'General case' 0 N--CA 1.487 1.425 0 CA-C-O 121.376 0.608 . . . . 0.0 110.032 -179.482 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 6' ' ' CYS . . . . . 0.557 ' N ' ' O ' ' A' ' 4' ' ' GLN . 1.6 p -88.31 102.24 14.66 Favored 'General case' 0 N--CA 1.492 1.637 0 CA-C-O 121.893 0.854 . . . . 0.0 109.623 -179.69 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 7' ' ' VAL . . . . . . . . . . . . . 15.5 t -97.23 108.93 22.33 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.651 0 CA-C-O 121.766 0.793 . . . . 0.0 109.866 179.892 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 79.8 tt0 39.73 65.51 0.7 Allowed 'General case' 0 N--CA 1.496 1.835 0 CA-C-O 121.774 0.797 . . . . 0.0 109.915 179.568 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 9' ' ' ASN . . . . . 0.409 ' ND2' ' CB ' ' A' ' 6' ' ' CYS . 93.5 m-20 -80.86 -79.08 0.16 Allowed 'General case' 0 N--CA 1.494 1.747 0 O-C-N 121.547 -0.721 . . . . 0.0 109.385 -179.878 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 97.9 mt-10 44.59 -165.95 0.01 OUTLIER 'General case' 0 N--CA 1.492 1.663 0 CA-C-O 121.688 0.756 . . . . 0.0 110.609 -179.836 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 73.7 t -83.5 132.46 31.39 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.568 0 CA-C-O 121.841 0.829 . . . . 0.0 109.918 -179.315 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 2.9 p -75.01 144.96 42.84 Favored 'General case' 0 N--CA 1.489 1.499 0 CA-C-O 121.832 0.825 . . . . 0.0 110.387 -179.524 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 22.4 tp10 66.09 28.5 10.29 Favored 'General case' 0 N--CA 1.489 1.521 0 CA-C-O 121.545 0.688 . . . . 0.0 109.371 179.457 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -88.5 -6.32 57.68 Favored 'General case' 0 N--CA 1.493 1.682 0 O-C-N 121.455 -0.778 . . . . 0.0 109.055 179.749 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 28.2 p -156.95 164.18 38.31 Favored 'General case' 0 N--CA 1.491 1.615 0 CA-C-O 121.858 0.837 . . . . 0.0 110.118 179.779 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . -64.79 160.64 41.24 Favored Glycine 0 N--CA 1.491 2.311 0 N-CA-C 110.688 -0.965 . . . . 0.0 110.688 -179.179 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 93.8 m -86.76 144.19 27.19 Favored 'General case' 0 N--CA 1.493 1.68 0 O-C-N 121.86 -0.788 . . . . 0.0 110.138 -179.623 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -79.88 -7.08 58.52 Favored 'General case' 0 N--CA 1.492 1.647 0 N-CA-C 109.131 -0.692 . . . . 0.0 109.131 -179.575 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -79.0 -3.53 88.23 Favored Glycine 0 N--CA 1.493 2.452 0 N-CA-C 108.992 -1.643 . . . . 0.0 108.992 -179.936 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 79.8 mm-40 -73.86 132.67 42.77 Favored 'General case' 0 N--CA 1.493 1.712 0 O-C-N 121.642 -0.916 . . . . 0.0 110.064 -179.577 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 21' ' ' ILE . . . . . . . . . . . . . 20.0 tt -89.19 131.73 35.76 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.7 0 CA-C-O 121.959 0.885 . . . . 0.0 109.964 -179.788 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . -167.7 -109.11 0.21 Allowed Glycine 0 N--CA 1.487 2.053 0 N-CA-C 109.579 -1.409 . . . . 0.0 109.579 179.942 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 23' ' ' PHE . . . . . 0.428 ' O ' ' O ' ' A' ' 24' ' ' ILE . 76.1 m-85 -109.54 -107.17 0.35 Allowed 'General case' 0 N--CA 1.497 1.924 0 O-C-N 121.63 -0.923 . . . . 0.0 109.509 -179.232 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 24' ' ' ILE . . . . . 0.428 ' O ' ' O ' ' A' ' 23' ' ' PHE . 96.7 mt 49.42 100.43 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.49 1.543 0 CA-C-O 121.637 0.732 . . . . 0.0 109.677 -179.753 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 25' ' ' ILE . . . . . 0.617 HG22 ' H ' ' A' ' 27' ' ' GLU . 92.0 mt -79.29 129.12 38.04 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.733 0 CA-C-O 121.937 0.875 . . . . 0.0 110.237 -179.637 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 80.5 mtp85 -99.42 9.61 42.96 Favored 'General case' 0 N--CA 1.498 1.953 0 CA-C-N 115.908 -0.587 . . . . 0.0 109.69 -179.331 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 27' ' ' GLU . . . . . 0.617 ' H ' HG22 ' A' ' 25' ' ' ILE . 93.5 mt-10 -74.58 51.05 0.45 Allowed 'General case' 0 N--CA 1.492 1.667 0 N-CA-C 108.644 -0.873 . . . . 0.0 108.644 179.565 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 28' ' ' GLY . . . . . 0.474 ' C ' ' H ' ' A' ' 30' ' ' ASP . . . -45.89 156.2 0.48 Allowed Glycine 0 N--CA 1.491 2.322 0 N-CA-C 109.954 -1.258 . . . . 0.0 109.954 -179.878 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 1.3 m-20 70.29 -44.05 0.56 Allowed 'General case' 0 N--CA 1.488 1.449 0 N-CA-C 108.874 -0.787 . . . . 0.0 108.874 -179.744 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 30' ' ' ASP . . . . . 0.474 ' H ' ' C ' ' A' ' 28' ' ' GLY . 96.0 m-20 -96.83 9.7 41.07 Favored 'General case' 0 N--CA 1.494 1.77 0 N-CA-C 109.13 -0.693 . . . . 0.0 109.13 179.974 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 3.8 p -129.22 154.04 39.52 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.861 0 CA-C-O 121.641 0.734 . . . . 0.0 109.799 -179.69 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -122.51 142.02 51.03 Favored 'General case' 0 N--CA 1.496 1.853 0 CA-C-O 121.937 0.875 . . . . 0.0 109.819 -179.896 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 33' ' ' GLU . . . . . 0.4 ' H ' ' HG2' ' A' ' 33' ' ' GLU . 21.9 pt-20 -94.36 138.01 32.83 Favored 'General case' 0 N--CA 1.492 1.669 0 CA-C-O 121.782 0.801 . . . . 0.0 110.444 -179.154 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 34' ' ' VAL . . . . . 0.41 HG13 ' CE2' ' A' ' 51' ' ' TYR . 55.0 t -127.01 130.83 71.32 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.834 0 CA-C-O 121.844 0.83 . . . . 0.0 109.263 179.371 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 51.1 m -133.53 128.73 35.91 Favored 'General case' 0 N--CA 1.495 1.809 0 CA-C-O 121.522 0.677 . . . . 0.0 109.315 179.355 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 74.1 mt -119.43 151.37 38.64 Favored 'General case' 0 N--CA 1.499 1.996 0 CA-C-O 121.863 0.84 . . . . 0.0 110.223 -179.39 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 37' ' ' PHE . . . . . . . . . . . . . 96.1 m-85 -124.56 137.92 54.36 Favored 'General case' 0 N--CA 1.497 1.881 0 CA-C-O 121.866 0.841 . . . . 0.0 109.702 -179.669 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 38' ' ' GLY . . . . . 0.528 ' N ' HD21 ' A' ' 44' ' ' LEU . . . 177.2 179.89 47.73 Favored Glycine 0 N--CA 1.491 2.339 0 N-CA-C 110.296 -1.122 . . . . 0.0 110.296 -179.984 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 36.0 p -88.48 -76.69 0.39 Allowed 'General case' 0 N--CA 1.491 1.605 0 O-C-N 121.718 -0.871 . . . . 0.0 109.877 -179.705 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 40' ' ' ASP . . . . . . . . . . . . . 32.9 t70 -80.36 155.46 27.17 Favored 'General case' 0 N--CA 1.497 1.884 0 O-C-N 121.318 -0.864 . . . . 0.0 110.666 -179.2 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 88.8 tttt -63.37 -39.84 95.63 Favored 'General case' 0 N--CA 1.489 1.48 0 CA-C-O 121.107 0.479 . . . . 0.0 110.117 -179.645 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -54.93 -38.9 68.25 Favored 'General case' 0 N--CA 1.492 1.668 0 O-C-N 121.551 -0.718 . . . . 0.0 109.45 -178.951 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 43' ' ' HIS . . . . . 0.736 ' CE1' ' NZ ' ' A' ' 47' ' ' LYS . 28.1 t60 -67.54 -42.27 82.97 Favored 'General case' 0 N--CA 1.495 1.778 0 O-C-N 121.751 -0.593 . . . . 0.0 109.409 -179.999 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 44' ' ' LEU . . . . . 0.528 HD21 ' N ' ' A' ' 38' ' ' GLY . 96.0 mt -63.02 -40.54 98.07 Favored 'General case' 0 N--CA 1.487 1.385 0 N-CA-C 106.527 -1.657 . . . . 0.0 106.527 178.72 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 77.0 mm-40 -64.36 -32.04 73.49 Favored 'General case' 0 N--CA 1.487 1.409 0 CA-C-N 115.726 -0.67 . . . . 0.0 109.446 179.241 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . -61.33 -50.0 71.5 Favored Glycine 0 N--CA 1.495 2.589 0 N-CA-C 109.507 -1.437 . . . . 0.0 109.507 -179.756 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 47' ' ' LYS . . . . . 0.736 ' NZ ' ' CE1' ' A' ' 43' ' ' HIS . 62.2 mttp -65.99 -38.62 88.98 Favored 'General case' 0 N--CA 1.49 1.536 0 O-C-N 121.678 -0.895 . . . . 0.0 109.039 179.561 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 61.8 tp -56.07 -34.19 65.73 Favored 'General case' 0 C--N 1.302 -1.471 0 N-CA-C 109.348 -0.612 . . . . 0.0 109.348 -179.167 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 49' ' ' ALA . . . . . . . . . . . . . . . -60.05 -38.07 81.72 Favored 'General case' 0 N--CA 1.492 1.655 0 O-C-N 121.614 -0.679 . . . . 0.0 109.183 -179.601 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 97.0 mt-10 -67.8 -38.51 83.42 Favored 'General case' 0 N--CA 1.491 1.617 0 O-C-N 121.638 -0.664 . . . . 0.0 109.308 179.786 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 51' ' ' TYR . . . . . 0.41 ' CE2' HG13 ' A' ' 34' ' ' VAL . 8.3 m-85 -60.97 -45.5 94.5 Favored 'General case' 0 N--CA 1.493 1.676 0 N-CA-C 108.808 -0.812 . . . . 0.0 108.808 179.889 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 52' ' ' ILE . . . . . . . . . . . . . 92.0 mt -65.11 -44.63 95.55 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.557 0 N-CA-C 109.596 -0.52 . . . . 0.0 109.596 -179.828 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 66.9 m -62.9 -46.58 87.14 Favored 'General case' 0 N--CA 1.494 1.738 0 O-C-N 121.415 -0.803 . . . . 0.0 109.862 -179.459 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 54' ' ' LEU . . . . . . . . . . . . . 93.2 mt -65.94 -42.62 89.78 Favored 'General case' 0 N--CA 1.494 1.737 0 O-C-N 121.648 -0.657 . . . . 0.0 109.858 179.999 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -65.57 -38.82 90.64 Favored 'General case' 0 N--CA 1.491 1.589 0 O-C-N 121.81 -0.556 . . . . 0.0 110.015 -178.913 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 56' ' ' LYS . . . . . . . . . . . . . 66.1 tttm -64.82 -45.47 86.06 Favored 'General case' 0 N--CA 1.487 1.414 0 O-C-N 121.42 -0.8 . . . . 0.0 109.729 -179.426 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 98.3 mt-30 -66.38 -44.23 83.7 Favored 'General case' 0 N--CA 1.493 1.69 0 O-C-N 121.594 -0.692 . . . . 0.0 109.675 -179.606 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 58' ' ' VAL . . . . . . . . . . . . . 74.8 t -65.05 -44.65 95.79 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.536 0 N-CA-C 109.116 -0.698 . . . . 0.0 109.116 -179.637 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 59' ' ' TYR . . . . . . . . . . . . . 9.2 t80 -106.97 -143.5 0.38 Allowed 'General case' 0 N--CA 1.496 1.866 0 CA-C-O 121.498 0.666 . . . . 0.0 109.585 -179.676 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -164.79 125.01 1.96 Allowed 'General case' 0 N--CA 1.491 1.622 0 CA-C-O 121.851 0.834 . . . . 0.0 110.255 179.998 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 61' ' ' ASN . . . . . . . . . . . . . 30.8 t-20 57.92 36.24 26.06 Favored 'General case' 0 N--CA 1.493 1.682 0 CA-C-O 121.816 0.817 . . . . 0.0 109.127 179.738 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 62' ' ' VAL . . . . . . . . . . . . . 5.4 p -67.77 139.28 21.1 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.606 0 CA-C-O 121.776 0.798 . . . . 0.0 110.552 -179.653 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 49.9 tp10 -116.94 147.47 42.22 Favored 'General case' 0 N--CA 1.494 1.736 0 CA-C-O 121.65 0.738 . . . . 0.0 109.241 179.957 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 64' ' ' TYR . . . . . . . . . . . . . 48.3 p90 -149.39 166.18 29.83 Favored 'General case' 0 N--CA 1.49 1.556 0 CA-C-O 122.008 0.909 . . . . 0.0 110.798 -179.323 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 75.5 mm-40 -132.16 147.23 52.41 Favored 'General case' 0 N--CA 1.495 1.791 0 CA-C-O 121.496 0.665 . . . . 0.0 109.475 -179.711 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 66' ' ' VAL . . . . . . . . . . . . . 57.7 t -120.74 130.88 74.1 Favored 'Isoleucine or valine' 0 N--CA 1.5 2.058 0 CA-C-O 121.975 0.893 . . . . 0.0 109.968 -179.571 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -79.22 155.94 76.7 Favored Pre-proline 0 C--N 1.306 -1.299 0 N-CA-C 109.348 -0.612 . . . . 0.0 109.348 -179.484 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 68' ' ' PRO . . . . . . . . . . . . . 89.2 Cg_exo -45.71 127.94 10.39 Favored 'Trans proline' 0 N--CA 1.492 1.409 0 C-N-CA 122.612 2.208 . . . . 0.0 113.075 179.765 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 69' ' ' VAL . . . . . . . . . . . . . 47.9 t -130.89 132.46 63.88 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.898 0 CA-C-O 121.822 0.82 . . . . 0.0 110.057 179.807 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -73.29 151.96 41.14 Favored 'General case' 0 N--CA 1.49 1.527 0 CA-C-O 121.749 0.785 . . . . 0.0 110.146 179.328 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 71' ' ' ASP . . . . . 0.537 ' OD1' ' N ' ' A' ' 72' ' ' ASN . 41.5 p-10 -63.73 -35.11 79.5 Favored 'General case' 0 N--CA 1.489 1.505 0 O-C-N 121.769 -0.582 . . . . 0.0 109.607 -179.825 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 72' ' ' ASN . . . . . 0.537 ' N ' ' OD1' ' A' ' 71' ' ' ASP . 99.2 m-20 -95.59 15.3 20.23 Favored 'General case' 0 N--CA 1.494 1.742 0 N-CA-C 108.972 -0.751 . . . . 0.0 108.972 -179.556 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -61.09 146.93 45.6 Favored 'General case' 0 N--CA 1.498 1.954 0 CA-C-O 121.774 0.797 . . . . 0.0 110.704 -179.645 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 74' ' ' THR . . . . . . . . . . . . . 50.6 p -98.63 -1.68 40.28 Favored 'General case' 0 N--CA 1.498 1.943 0 O-C-N 121.751 -0.593 . . . . 0.0 109.467 -179.758 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 2.9 pp20? -156.13 160.1 39.61 Favored 'General case' 0 N--CA 1.495 1.78 0 O-C-N 121.243 -0.911 . . . . 0.0 110.395 179.695 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 5.4 tt -128.06 135.27 49.61 Favored 'General case' 0 N--CA 1.493 1.707 0 CA-C-O 121.565 0.697 . . . . 0.0 109.876 -179.869 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 77' ' ' HIS . . . . . . . . . . . . . 82.2 t60 -117.22 124.3 48.74 Favored 'General case' 0 N--CA 1.497 1.909 0 CA-C-O 122.143 0.973 . . . . 0.0 109.937 -179.883 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -152.62 159.65 43.22 Favored 'General case' 0 N--CA 1.49 1.565 0 CA-C-O 121.506 0.67 . . . . 0.0 109.591 179.708 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 96.5 mtt-85 -127.07 149.82 49.75 Favored 'General case' 0 N--CA 1.497 1.917 0 CA-C-O 121.553 0.692 . . . . 0.0 109.841 -179.528 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 80' ' ' PHE . . . . . . . . . . . . . 35.8 m-85 -122.9 149.68 43.91 Favored 'General case' 0 N--CA 1.497 1.902 0 CA-C-O 121.736 0.779 . . . . 0.0 109.62 -179.653 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 49.7 mtmt -108.56 115.12 29.51 Favored 'General case' 0 N--CA 1.494 1.749 0 CA-C-O 121.62 0.724 . . . . 0.0 109.437 -179.505 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 82' ' ' PHE . . . . . 0.677 ' C ' ' H ' ' A' ' 84' ' ' VAL . 53.6 m-85 -110.56 -0.7 17.21 Favored 'General case' 0 N--CA 1.497 1.889 0 N-CA-C 108.567 -0.901 . . . . 0.0 108.567 179.643 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 41.7 mm-40 63.62 -20.99 0.06 Allowed 'General case' 0 N--CA 1.492 1.657 0 N-CA-C 109.277 -0.638 . . . . 0.0 109.277 179.936 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 84' ' ' VAL . . . . . 0.677 ' H ' ' C ' ' A' ' 82' ' ' PHE . 3.3 m -133.83 133.58 56.49 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.519 0 CA-C-O 121.822 0.82 . . . . 0.0 109.674 -179.621 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 85' ' ' SER . . . . . 0.52 ' O ' ' N ' ' A' ' 88' ' ' LYS . 14.2 t -64.97 -41.0 95.82 Favored 'General case' 0 C--N 1.3 -1.581 0 CA-C-O 121.214 0.531 . . . . 0.0 110.156 179.919 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 86' ' ' ALA . . . . . 0.423 ' C ' ' O ' ' A' ' 85' ' ' SER . . . -41.15 -38.13 1.02 Allowed 'General case' 0 N--CA 1.496 1.854 0 O-C-N 121.514 -0.742 . . . . 0.0 110.121 -178.802 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -69.95 -32.88 71.36 Favored 'General case' 0 N--CA 1.489 1.5 0 O-C-N 121.481 -0.762 . . . . 0.0 109.517 -179.886 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 88' ' ' LYS . . . . . 0.52 ' N ' ' O ' ' A' ' 85' ' ' SER . 64.3 tttm -61.67 -47.19 86.49 Favored 'General case' 0 C--N 1.3 -1.569 0 O-C-N 121.845 -0.534 . . . . 0.0 109.88 -178.937 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 96.0 mt -64.76 -47.92 76.4 Favored 'General case' 0 N--CA 1.493 1.703 0 O-C-N 121.67 -0.644 . . . . 0.0 110.464 -178.94 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 90' ' ' ILE . . . . . . . . . . . . . 96.3 mt -69.6 -43.97 79.95 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.647 0 O-C-N 121.637 -0.665 . . . . 0.0 109.64 -179.887 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 91' ' ' PHE . . . . . . . . . . . . . 82.6 t80 -62.26 -44.74 95.85 Favored 'General case' 0 N--CA 1.493 1.717 0 O-C-N 121.59 -0.694 . . . . 0.0 109.354 -179.979 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 92' ' ' GLU . . . . . . . . . . . . . 81.4 tt0 -63.55 -43.12 97.99 Favored 'General case' 0 N--CA 1.489 1.507 0 N-CA-C 109.309 -0.626 . . . . 0.0 109.309 -179.576 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 93' ' ' LEU . . . . . 0.612 ' O ' HD23 ' A' ' 93' ' ' LEU . 2.8 tt -63.26 -47.26 83.14 Favored 'General case' 0 N--CA 1.489 1.498 0 CA-C-O 121.667 0.746 . . . . 0.0 109.624 -179.119 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 94' ' ' LYS . . . . . . . . . . . . . 55.2 mtpt -63.9 -44.97 91.4 Favored 'General case' 0 N--CA 1.49 1.559 0 O-C-N 121.492 -0.755 . . . . 0.0 109.792 -179.177 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 14.4 p -66.48 -39.86 89.0 Favored 'General case' 0 N--CA 1.492 1.625 0 O-C-N 121.794 -0.566 . . . . 0.0 110.037 -179.539 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 96' ' ' ARG . . . . . . . . . . . . . 16.1 tpt85 -70.77 -17.99 62.77 Favored 'General case' 0 C--N 1.3 -1.555 0 O-C-N 121.562 -0.711 . . . . 0.0 109.788 -179.484 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 97' ' ' ALA . . . . . . . . . . . . . . . -78.87 -43.69 24.46 Favored 'General case' 0 N--CA 1.491 1.604 0 O-C-N 121.624 -0.673 . . . . 0.0 109.761 -179.25 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 98' ' ' LEU . . . . . . . . . . . . . 2.2 pp -88.81 -18.29 28.0 Favored 'General case' 0 N--CA 1.493 1.689 0 N-CA-C 109.201 -0.666 . . . . 0.0 109.201 -179.302 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 99' ' ' ALA . . . . . . . . . . . . . . . -84.19 -40.66 17.87 Favored 'General case' 0 N--CA 1.492 1.675 0 O-C-N 121.623 -0.673 . . . . 0.0 109.441 -179.062 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 100' ' ' ARG . . . . . . . . . . . . . 9.5 ptm180 -64.34 -31.92 73.31 Favored 'General case' 0 N--CA 1.492 1.647 0 N-CA-C 108.953 -0.758 . . . . 0.0 108.953 -179.9 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 101' ' ' LEU . . . . . . . . . . . . . 96.9 mt -71.73 145.98 48.44 Favored 'General case' 0 N--CA 1.492 1.663 0 CA-C-O 121.651 0.738 . . . . 0.0 110.139 -179.556 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 102' ' ' GLU . . . . . 0.497 ' O ' ' N ' ' A' ' 104' ' ' HIS . 83.4 tt0 -159.45 116.21 2.62 Favored 'General case' 0 N--CA 1.492 1.666 0 CA-C-O 121.753 0.787 . . . . 0.0 109.672 179.809 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 103' ' ' HIS . . . . . . . . . . . . . 92.6 m-70 41.42 -92.59 0.01 OUTLIER 'General case' 0 N--CA 1.494 1.73 0 CA-C-O 121.458 0.647 . . . . 0.0 110.166 179.964 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 104' ' ' HIS . . . . . 0.599 ' ND1' ' N ' ' A' ' 105' ' ' HIS . 0.3 OUTLIER 44.45 -114.69 0.4 Allowed 'General case' 0 N--CA 1.493 1.676 0 CA-C-O 121.262 0.553 . . . . 0.0 110.017 -179.866 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 105' ' ' HIS . . . . . 0.599 ' N ' ' ND1' ' A' ' 104' ' ' HIS . 60.2 t-80 53.72 -80.61 0.01 OUTLIER 'General case' 0 N--CA 1.489 1.521 0 CA-C-O 121.364 0.602 . . . . 0.0 109.985 -179.69 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 106' ' ' HIS . . . . . 0.567 ' N ' ' O ' ' A' ' 104' ' ' HIS . 94.9 m-70 56.42 90.1 0.04 OUTLIER 'General case' 0 C--N 1.302 -1.496 0 CA-C-O 121.721 0.772 . . . . 0.0 109.97 -179.786 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 107' ' ' HIS . . . . . 0.402 ' O ' ' O ' ' A' ' 106' ' ' HIS . 98.7 m-70 46.28 -175.72 0.01 OUTLIER 'General case' 0 N--CA 1.492 1.672 0 CA-C-O 121.766 0.793 . . . . 0.0 110.888 179.608 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 108' ' ' HIS . . . . . . . . . . . . . 41.2 p-80 . . . . . 0 N--CA 1.488 1.437 0 CA-C-O 117.909 -1.044 . . . . 0.0 109.396 -179.732 . . . . . . . . 0 0 . 1 . 007 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 97.4 mmm . . . . . 0 N--CA 1.49 1.54 0 CA-C-O 121.359 0.599 . . . . 0.0 109.97 . . . . . . . . . 0 0 . 1 . 007 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 51.0 m -61.9 -36.54 81.61 Favored 'General case' 0 N--CA 1.494 1.73 0 CA-C-O 121.232 0.539 . . . . 0.0 109.741 -179.579 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 3' ' ' ASN . . . . . . . . . . . . . 76.4 m-20 -62.42 -39.56 93.68 Favored 'General case' 0 N--CA 1.494 1.729 0 N-CA-C 109.105 -0.702 . . . . 0.0 109.105 -179.638 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 77.9 mt-30 57.88 24.28 10.72 Favored 'General case' 0 N--CA 1.493 1.689 0 N-CA-C 109.122 -0.696 . . . . 0.0 109.122 -179.847 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 5' ' ' THR . . . . . 0.407 ' H ' HG22 ' A' ' 5' ' ' THR . 0.0 OUTLIER -56.22 98.83 0.03 OUTLIER 'General case' 0 N--CA 1.491 1.582 0 CA-C-O 121.958 0.885 . . . . 0.0 109.626 -179.673 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 1.7 p -83.6 -70.06 0.59 Allowed 'General case' 0 N--CA 1.49 1.554 0 N-CA-C 109.367 -0.605 . . . . 0.0 109.367 179.964 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 7' ' ' VAL . . . . . . . . . . . . . 88.8 t -105.87 -45.25 8.34 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.84 0 O-C-N 121.729 -0.607 . . . . 0.0 109.504 -179.33 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 44.5 tp10 51.44 93.3 0.02 OUTLIER 'General case' 0 N--CA 1.496 1.84 0 CA-C-O 121.609 0.719 . . . . 0.0 109.613 -179.843 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 52.5 t30 -87.72 111.78 21.69 Favored 'General case' 0 N--CA 1.494 1.752 0 CA-C-O 121.692 0.758 . . . . 0.0 110.137 -179.713 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 96.8 mt-10 -64.43 148.89 49.54 Favored 'General case' 0 N--CA 1.493 1.701 0 CA-C-O 121.756 0.789 . . . . 0.0 110.198 -179.737 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 58.0 t -104.78 127.51 59.19 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.859 0 CA-C-O 121.809 0.814 . . . . 0.0 109.759 -179.31 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 10.7 t -89.69 122.41 32.78 Favored 'General case' 0 N--CA 1.493 1.711 0 CA-C-O 121.665 0.745 . . . . 0.0 110.212 -179.626 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 13' ' ' GLU . . . . . 0.543 ' O ' ' N ' ' A' ' 15' ' ' CYS . 79.8 mm-40 -92.93 -10.17 37.45 Favored 'General case' 0 N--CA 1.493 1.692 0 N-CA-C 108.748 -0.834 . . . . 0.0 108.748 179.228 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . 45.48 13.84 0.01 OUTLIER 'General case' 0 N--CA 1.496 1.858 0 CA-C-O 121.327 0.584 . . . . 0.0 109.848 179.974 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 15' ' ' CYS . . . . . 0.543 ' N ' ' O ' ' A' ' 13' ' ' GLU . 5.4 t -71.83 -31.37 66.47 Favored 'General case' 0 N--CA 1.49 1.558 0 O-C-N 121.822 -0.549 . . . . 0.0 109.524 179.903 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . -81.38 -4.21 90.48 Favored Glycine 0 N--CA 1.492 2.432 0 N-CA-C 109.313 -1.515 . . . . 0.0 109.313 -179.37 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 74.1 m -81.16 57.93 3.34 Favored 'General case' 0 N--CA 1.492 1.66 0 O-C-N 121.707 -0.879 . . . . 0.0 109.497 -179.678 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -170.75 100.46 0.23 Allowed 'General case' 0 N--CA 1.489 1.496 0 CA-C-O 121.764 0.792 . . . . 0.0 109.793 179.24 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 71.0 -175.33 38.89 Favored Glycine 0 N--CA 1.493 2.461 0 N-CA-C 111.05 -0.82 . . . . 0.0 111.05 178.938 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 97.9 mt-10 -70.28 131.18 43.78 Favored 'General case' 0 N--CA 1.491 1.604 0 CA-C-O 121.8 0.809 . . . . 0.0 109.878 -179.754 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 21' ' ' ILE . . . . . 0.509 ' H ' HD13 ' A' ' 21' ' ' ILE . 0.0 OUTLIER -92.15 133.95 31.93 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.715 0 CA-C-O 121.822 0.82 . . . . 0.0 110.273 -179.333 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 80.7 20.44 65.94 Favored Glycine 0 N--CA 1.493 2.454 0 N-CA-C 109.318 -1.513 . . . . 0.0 109.318 179.434 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 23' ' ' PHE . . . . . . . . . . . . . 89.5 t80 -96.11 -10.77 27.49 Favored 'General case' 0 N--CA 1.494 1.763 0 O-C-N 121.683 -0.892 . . . . 0.0 109.541 -179.584 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 16.9 tt -82.99 -16.62 11.35 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.788 0 O-C-N 121.473 -0.767 . . . . 0.0 109.436 179.822 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 25' ' ' ILE . . . . . . . . . . . . . 96.6 mt -64.54 -42.94 96.62 Favored 'Isoleucine or valine' 0 N--CA 1.499 2.004 0 O-C-N 121.419 -0.801 . . . . 0.0 109.229 179.922 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 84.2 mtp180 56.09 174.48 0.03 OUTLIER 'General case' 0 N--CA 1.494 1.744 0 CA-C-O 121.716 0.77 . . . . 0.0 111.059 -179.95 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 82.8 tt0 -69.28 84.04 0.37 Allowed 'General case' 0 N--CA 1.494 1.77 0 CA-C-O 121.71 0.767 . . . . 0.0 110.204 -179.066 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . -84.71 173.58 49.36 Favored Glycine 0 N--CA 1.492 2.372 0 N-CA-C 110.147 -1.181 . . . . 0.0 110.147 179.73 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 99.2 m-20 -69.23 -26.64 64.9 Favored 'General case' 0 N--CA 1.491 1.616 0 O-C-N 121.904 -0.763 . . . . 0.0 109.434 179.975 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 38.3 p30 -97.96 23.91 7.55 Favored 'General case' 0 N--CA 1.495 1.78 0 N-CA-C 108.822 -0.807 . . . . 0.0 108.822 -179.888 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 53.3 t -115.99 133.59 61.97 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.9 0 CA-C-O 121.795 0.807 . . . . 0.0 109.41 179.934 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -97.98 154.18 17.86 Favored 'General case' 0 N--CA 1.494 1.744 0 CA-C-O 121.871 0.843 . . . . 0.0 110.135 -179.47 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 33' ' ' GLU . . . . . 0.508 ' OE2' ' NE2' ' A' ' 77' ' ' HIS . 49.7 tp10 -101.58 124.21 46.87 Favored 'General case' 0 N--CA 1.492 1.645 0 CA-C-O 121.515 0.674 . . . . 0.0 109.528 -179.667 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 34' ' ' VAL . . . . . . . . . . . . . 55.7 t -124.24 131.99 72.02 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.791 0 CA-C-O 121.889 0.852 . . . . 0.0 109.689 179.774 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 38.1 t -136.11 138.78 42.41 Favored 'General case' 0 N--CA 1.492 1.637 0 CA-C-O 121.545 0.688 . . . . 0.0 109.35 179.498 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 47.2 tp -126.89 139.33 53.16 Favored 'General case' 0 N--CA 1.493 1.719 0 CA-C-O 121.795 0.807 . . . . 0.0 110.076 -179.664 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 37' ' ' PHE . . . . . . . . . . . . . 96.9 m-85 -112.36 144.77 41.23 Favored 'General case' 0 N--CA 1.496 1.828 0 CA-C-O 121.797 0.808 . . . . 0.0 109.694 179.917 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . -171.0 176.35 44.41 Favored Glycine 0 N--CA 1.489 2.226 0 N-CA-C 110.23 -1.148 . . . . 0.0 110.23 -179.909 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 1.7 m -83.55 -71.59 0.5 Allowed 'General case' 0 N--CA 1.489 1.482 0 O-C-N 121.854 -0.792 . . . . 0.0 109.751 -179.758 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 40' ' ' ASP . . . . . . . . . . . . . 37.0 t70 -98.78 159.06 15.22 Favored 'General case' 0 N--CA 1.498 1.96 0 CA-C-O 121.952 0.882 . . . . 0.0 110.65 -179.223 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 41' ' ' LYS . . . . . 0.43 ' O ' ' OE1' ' A' ' 45' ' ' GLU . 64.5 tttm -62.79 -42.26 99.63 Favored 'General case' 0 N--CA 1.491 1.587 0 CA-C-N 116.091 -0.504 . . . . 0.0 110.213 -179.971 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -49.88 -43.08 49.15 Favored 'General case' 0 N--CA 1.493 1.71 0 O-C-N 121.591 -0.693 . . . . 0.0 109.747 -178.828 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 43' ' ' HIS . . . . . . . . . . . . . 79.7 m-70 -67.47 -42.42 83.04 Favored 'General case' 0 N--CA 1.49 1.527 0 O-C-N 121.701 -0.624 . . . . 0.0 109.506 -179.933 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 81.8 mt -64.27 -44.0 93.07 Favored 'General case' 0 N--CA 1.494 1.737 0 O-C-N 121.742 -0.599 . . . . 0.0 109.792 -179.633 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 45' ' ' GLU . . . . . 0.503 ' OE1' ' N ' ' A' ' 45' ' ' GLU . 2.7 mp0 -66.7 -40.51 88.51 Favored 'General case' 0 N--CA 1.488 1.474 0 O-C-N 121.69 -0.631 . . . . 0.0 109.352 -179.799 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . -60.72 -44.73 97.59 Favored Glycine 0 N--CA 1.492 2.397 0 N-CA-C 109.699 -1.36 . . . . 0.0 109.699 -179.189 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 54.9 mtpt -71.16 -25.6 62.62 Favored 'General case' 0 N--CA 1.49 1.532 0 O-C-N 121.781 -0.835 . . . . 0.0 109.102 179.843 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 48' ' ' LEU . . . . . 0.59 HD13 ' O ' ' A' ' 48' ' ' LEU . 0.3 OUTLIER -61.52 -44.86 96.29 Favored 'General case' 0 C--N 1.303 -1.434 0 O-C-N 121.572 -0.705 . . . . 0.0 109.353 -179.102 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 49' ' ' ALA . . . . . . . . . . . . . . . -53.83 -35.85 61.9 Favored 'General case' 0 N--CA 1.493 1.721 0 O-C-N 121.442 -0.786 . . . . 0.0 109.488 -179.328 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 72.9 mm-40 -69.16 -37.28 78.13 Favored 'General case' 0 N--CA 1.491 1.597 0 N-CA-C 109.258 -0.645 . . . . 0.0 109.258 -179.983 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 4.4 m-85 -63.46 -39.37 94.28 Favored 'General case' 0 N--CA 1.496 1.859 0 O-C-N 121.669 -0.644 . . . . 0.0 109.496 -179.458 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 52' ' ' ILE . . . . . 0.581 HD12 ' CZ ' ' A' ' 64' ' ' TYR . 31.9 mm -64.07 -44.28 97.68 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.611 0 O-C-N 121.634 -0.666 . . . . 0.0 109.626 -179.424 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 66.9 m -60.55 -41.62 94.91 Favored 'General case' 0 N--CA 1.493 1.7 0 O-C-N 121.815 -0.553 . . . . 0.0 109.574 -179.696 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 54' ' ' LEU . . . . . . . . . . . . . 95.4 mt -64.04 -40.49 96.42 Favored 'General case' 0 N--CA 1.492 1.634 0 O-C-N 121.658 -0.651 . . . . 0.0 109.315 -179.926 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -57.92 -46.47 84.95 Favored 'General case' 0 N--CA 1.491 1.619 0 CA-C-O 121.148 0.499 . . . . 0.0 110.147 -178.984 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 56' ' ' LYS . . . . . 0.447 ' HZ2' HG22 ' A' ' 52' ' ' ILE . 62.7 mttp -64.59 -41.53 96.18 Favored 'General case' 0 N--CA 1.491 1.584 0 O-C-N 121.631 -0.668 . . . . 0.0 109.955 -179.742 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 88.2 mt-30 -64.66 -43.65 92.93 Favored 'General case' 0 N--CA 1.491 1.598 0 O-C-N 121.499 -0.751 . . . . 0.0 109.287 -179.726 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 58' ' ' VAL . . . . . . . . . . . . . 77.9 t -65.92 -44.54 92.47 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.619 0 O-C-N 121.742 -0.599 . . . . 0.0 109.419 -179.881 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 59' ' ' TYR . . . . . 0.404 ' O ' ' O ' ' A' ' 60' ' ' ALA . 75.8 t80 -137.47 151.56 48.6 Favored 'General case' 0 N--CA 1.496 1.861 0 CA-C-O 121.913 0.863 . . . . 0.0 110.318 -179.521 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 60' ' ' ALA . . . . . 0.538 ' O ' ' N ' ' A' ' 62' ' ' VAL . . . -59.85 -143.3 0.0 OUTLIER 'General case' 0 N--CA 1.491 1.587 0 CA-C-O 121.449 0.642 . . . . 0.0 110.693 -179.298 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 61' ' ' ASN . . . . . . . . . . . . . 99.3 m-20 -43.67 91.6 0.0 OUTLIER 'General case' 0 N--CA 1.495 1.802 0 CA-C-O 121.85 0.834 . . . . 0.0 109.879 -178.836 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 62' ' ' VAL . . . . . 0.538 ' N ' ' O ' ' A' ' 60' ' ' ALA . 13.2 p -99.42 132.58 44.58 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.503 0 CA-C-O 121.897 0.856 . . . . 0.0 110.279 -179.438 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 63' ' ' GLU . . . . . 0.533 ' OE1' ' N ' ' A' ' 63' ' ' GLU . 57.1 mp0 -105.42 136.51 44.84 Favored 'General case' 0 N--CA 1.492 1.637 0 CA-C-O 121.726 0.774 . . . . 0.0 109.44 -179.764 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 64' ' ' TYR . . . . . 0.581 ' CZ ' HD12 ' A' ' 52' ' ' ILE . 53.5 p90 -149.6 161.84 41.38 Favored 'General case' 0 N--CA 1.491 1.584 0 CA-C-O 121.778 0.799 . . . . 0.0 110.246 -179.516 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 48.7 tp10 -143.39 144.76 32.18 Favored 'General case' 0 N--CA 1.493 1.703 0 CA-C-O 121.736 0.779 . . . . 0.0 109.266 179.412 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 66' ' ' VAL . . . . . . . . . . . . . 14.7 p -121.27 129.95 75.13 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.713 0 CA-C-O 121.866 0.841 . . . . 0.0 109.893 -179.852 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 67' ' ' ALA . . . . . 0.479 ' HB1' ' HD2' ' A' ' 68' ' ' PRO . . . -77.76 159.85 75.63 Favored Pre-proline 0 N--CA 1.49 1.55 0 N-CA-C 109.398 -0.593 . . . . 0.0 109.398 -179.699 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 68' ' ' PRO . . . . . 0.479 ' HD2' ' HB1' ' A' ' 67' ' ' ALA . 17.9 Cg_endo -59.58 140.28 93.07 Favored 'Trans proline' 0 C--N 1.309 -1.545 0 C-N-CA 122.579 2.186 . . . . 0.0 112.57 179.41 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 69' ' ' VAL . . . . . . . . . . . . . 49.6 t -133.8 136.21 54.3 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.787 0 CA-C-O 121.835 0.826 . . . . 0.0 110.074 -179.723 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -76.69 165.52 24.63 Favored 'General case' 0 N--CA 1.492 1.654 0 CA-C-O 121.875 0.845 . . . . 0.0 110.504 -179.953 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 62.0 t0 -63.14 -44.45 95.51 Favored 'General case' 0 N--CA 1.489 1.487 0 CA-C-O 121.224 0.535 . . . . 0.0 109.926 -179.614 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 72' ' ' ASN . . . . . . . . . . . . . 98.5 m-20 -99.75 24.91 7.75 Favored 'General case' 0 N--CA 1.494 1.768 0 N-CA-C 109.347 -0.612 . . . . 0.0 109.347 -179.146 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 73' ' ' ALA . . . . . 0.55 ' C ' ' H ' ' A' ' 75' ' ' GLU . . . -64.47 -26.11 68.3 Favored 'General case' 0 N--CA 1.492 1.666 0 O-C-N 121.607 -0.683 . . . . 0.0 109.228 179.825 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 74' ' ' THR . . . . . 0.48 ' OG1' ' O ' ' A' ' 73' ' ' ALA . 63.0 p 53.35 4.04 0.04 OUTLIER 'General case' 0 N--CA 1.493 1.683 0 CA-C-O 121.256 0.55 . . . . 0.0 109.625 -179.347 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 75' ' ' GLU . . . . . 0.55 ' H ' ' C ' ' A' ' 73' ' ' ALA . 96.5 mt-10 -144.69 156.83 44.28 Favored 'General case' 0 N--CA 1.491 1.605 0 CA-C-O 121.975 0.893 . . . . 0.0 110.135 179.85 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 4.1 tt -141.24 141.09 34.03 Favored 'General case' 0 C--N 1.304 -1.405 0 CA-C-O 121.622 0.725 . . . . 0.0 109.857 -179.907 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 77' ' ' HIS . . . . . 0.508 ' NE2' ' OE2' ' A' ' 33' ' ' GLU . 63.1 t-80 -120.38 128.48 53.26 Favored 'General case' 0 N--CA 1.494 1.735 0 CA-C-O 121.928 0.87 . . . . 0.0 109.763 -179.978 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -150.16 155.21 39.37 Favored 'General case' 0 N--CA 1.49 1.536 0 CA-C-O 121.688 0.756 . . . . 0.0 109.696 179.937 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 33.2 ptt-85 -135.03 153.16 52.16 Favored 'General case' 0 N--CA 1.495 1.778 0 CA-C-O 121.814 0.816 . . . . 0.0 109.845 -179.778 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 80' ' ' PHE . . . . . . . . . . . . . 45.5 m-85 -133.16 153.38 51.58 Favored 'General case' 0 N--CA 1.495 1.821 0 CA-C-O 121.694 0.759 . . . . 0.0 110.175 -179.265 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 64.2 tttm -107.4 125.66 51.5 Favored 'General case' 0 N--CA 1.496 1.841 0 CA-C-O 121.595 0.712 . . . . 0.0 109.366 179.968 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 82' ' ' PHE . . . . . . . . . . . . . 63.1 m-85 -123.21 146.51 47.76 Favored 'General case' 0 N--CA 1.495 1.821 0 CA-C-O 121.615 0.721 . . . . 0.0 109.936 -179.896 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 81.3 tt0 -69.04 -37.88 78.83 Favored 'General case' 0 N--CA 1.491 1.595 0 N-CA-C 109.222 -0.658 . . . . 0.0 109.222 -179.579 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 84' ' ' VAL . . . . . . . . . . . . . 35.1 m -135.79 159.11 39.72 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.926 0 CA-C-O 121.889 0.852 . . . . 0.0 109.984 -179.933 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 85' ' ' SER . . . . . 0.481 ' O ' ' N ' ' A' ' 88' ' ' LYS . 11.2 t -63.62 -42.61 98.19 Favored 'General case' 0 N--CA 1.49 1.563 0 CA-C-O 121.193 0.521 . . . . 0.0 110.08 -179.775 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 86' ' ' ALA . . . . . . . . . . . . . . . -41.23 -40.95 1.73 Allowed 'General case' 0 N--CA 1.494 1.752 0 CA-C-O 121.278 0.561 . . . . 0.0 110.07 -178.976 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 96.6 mt-10 -67.52 -33.17 74.53 Favored 'General case' 0 N--CA 1.491 1.577 0 O-C-N 121.677 -0.64 . . . . 0.0 109.64 -179.829 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 88' ' ' LYS . . . . . 0.481 ' N ' ' O ' ' A' ' 85' ' ' SER . 64.4 tttm -62.37 -45.61 92.38 Favored 'General case' 0 N--CA 1.493 1.677 0 O-C-N 121.645 -0.659 . . . . 0.0 109.673 -179.627 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 89' ' ' LEU . . . . . 0.494 HD22 ' N ' ' A' ' 89' ' ' LEU . 3.8 mm? -64.3 -42.05 96.56 Favored 'General case' 0 N--CA 1.492 1.633 0 O-C-N 121.519 -0.738 . . . . 0.0 109.796 -179.447 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 90' ' ' ILE . . . . . . . . . . . . . 95.3 mt -65.99 -44.23 92.36 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.669 0 CA-C-O 121.325 0.583 . . . . 0.0 109.934 -179.398 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 91' ' ' PHE . . . . . . . . . . . . . 71.3 t80 -61.97 -45.58 93.01 Favored 'General case' 0 N--CA 1.493 1.707 0 O-C-N 121.689 -0.632 . . . . 0.0 109.993 -179.18 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 92' ' ' GLU . . . . . 0.555 ' N ' ' OE1' ' A' ' 92' ' ' GLU . 1.9 mp0 -64.8 -37.98 89.44 Favored 'General case' 0 N--CA 1.491 1.592 0 O-C-N 121.555 -0.716 . . . . 0.0 110.175 -178.976 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 93' ' ' LEU . . . . . . . . . . . . . 5.1 tt -62.11 -45.17 94.66 Favored 'General case' 0 C--N 1.299 -1.599 0 O-C-N 121.472 -0.767 . . . . 0.0 109.958 -178.845 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 94' ' ' LYS . . . . . . . . . . . . . 98.8 mttt -66.14 -43.13 87.95 Favored 'General case' 0 N--CA 1.493 1.694 0 O-C-N 121.826 -0.546 . . . . 0.0 110.045 -179.508 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 21.2 p -67.94 -38.08 82.41 Favored 'General case' 0 N--CA 1.493 1.708 0 O-C-N 121.557 -0.714 . . . . 0.0 109.629 -179.217 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 96' ' ' ARG . . . . . . . . . . . . . 73.6 mmt-85 -64.47 -40.86 96.49 Favored 'General case' 0 C--N 1.301 -1.502 0 O-C-N 121.592 -0.692 . . . . 0.0 109.639 -179.891 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 97' ' ' ALA . . . . . . . . . . . . . . . -63.47 -47.88 80.0 Favored 'General case' 0 C--N 1.302 -1.472 0 N-CA-C 108.994 -0.743 . . . . 0.0 108.994 -179.93 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 98' ' ' LEU . . . . . . . . . . . . . 88.8 mt -65.25 -42.08 93.67 Favored 'General case' 0 N--CA 1.488 1.466 0 N-CA-C 108.852 -0.796 . . . . 0.0 108.852 179.889 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 99' ' ' ALA . . . . . . . . . . . . . . . -65.01 -38.28 90.4 Favored 'General case' 0 N--CA 1.489 1.475 0 N-CA-C 109.515 -0.55 . . . . 0.0 109.515 -179.7 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 100' ' ' ARG . . . . . 0.435 ' O ' ' O ' ' A' ' 101' ' ' LEU . 84.4 mmt-85 -87.9 -6.24 58.16 Favored 'General case' 0 N--CA 1.493 1.714 0 O-C-N 121.499 -0.751 . . . . 0.0 109.003 179.98 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 101' ' ' LEU . . . . . 0.435 ' O ' ' O ' ' A' ' 100' ' ' ARG . 75.9 mt 58.39 126.09 0.01 OUTLIER 'General case' 0 N--CA 1.491 1.612 0 CA-C-O 121.904 0.859 . . . . 0.0 110.545 179.581 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 102' ' ' GLU . . . . . . . . . . . . . 47.7 tp10 -66.27 135.65 54.74 Favored 'General case' 0 C--N 1.303 -1.436 0 CA-C-O 121.805 0.812 . . . . 0.0 109.902 -179.225 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 103' ' ' HIS . . . . . . . . . . . . . 60.0 t-80 -145.41 133.34 21.3 Favored 'General case' 0 N--CA 1.49 1.57 0 CA-C-O 121.711 0.767 . . . . 0.0 109.921 179.688 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 104' ' ' HIS . . . . . 0.463 ' ND1' ' N ' ' A' ' 104' ' ' HIS . 0.0 OUTLIER -173.4 81.96 0.04 OUTLIER 'General case' 0 N--CA 1.49 1.573 0 CA-C-O 121.488 0.661 . . . . 0.0 109.32 179.443 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 105' ' ' HIS . . . . . 0.402 ' C ' ' O ' ' A' ' 104' ' ' HIS . 98.7 m-70 37.82 90.27 0.01 OUTLIER 'General case' 0 N--CA 1.5 2.027 0 CA-C-O 121.763 0.792 . . . . 0.0 110.661 179.879 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 106' ' ' HIS . . . . . 0.486 ' CG ' ' N ' ' A' ' 107' ' ' HIS . 52.1 p-80 -64.71 -43.47 93.35 Favored 'General case' 0 C--N 1.305 -1.362 0 N-CA-C 109.087 -0.709 . . . . 0.0 109.087 179.856 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 107' ' ' HIS . . . . . 0.486 ' N ' ' CG ' ' A' ' 106' ' ' HIS . 36.5 t-80 -79.22 130.63 35.66 Favored 'General case' 0 N--CA 1.493 1.698 0 CA-C-O 121.939 0.876 . . . . 0.0 110.11 -179.536 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 108' ' ' HIS . . . . . . . . . . . . . 63.2 t-80 . . . . . 0 N--CA 1.489 1.488 0 CA-C-O 117.799 -1.096 . . . . 0.0 109.797 179.779 . . . . . . . . 0 0 . 1 . 008 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 97.5 mmm . . . . . 0 N--CA 1.489 1.497 0 CA-C-O 121.487 0.661 . . . . 0.0 109.862 . . . . . . . . . 0 0 . 1 . 008 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 25.5 p -155.24 161.95 41.03 Favored 'General case' 0 N--CA 1.495 1.776 0 CA-C-O 121.719 0.771 . . . . 0.0 110.11 179.933 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 3' ' ' ASN . . . . . . . . . . . . . 54.6 p30 -106.56 12.03 29.92 Favored 'General case' 0 N--CA 1.497 1.895 0 N-CA-C 109.065 -0.717 . . . . 0.0 109.065 -179.807 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 98.0 mt-30 -73.12 124.78 26.25 Favored 'General case' 0 N--CA 1.493 1.697 0 CA-C-O 121.658 0.742 . . . . 0.0 109.703 -179.69 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 57.5 p -90.69 134.01 34.72 Favored 'General case' 0 N--CA 1.494 1.729 0 CA-C-O 121.691 0.758 . . . . 0.0 109.925 -179.664 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 1.1 t -64.91 -40.4 95.01 Favored 'General case' 0 N--CA 1.489 1.503 0 CA-C-O 121.288 0.566 . . . . 0.0 109.677 -179.913 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 7' ' ' VAL . . . . . . . . . . . . . 4.4 m -86.67 131.72 34.08 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.605 0 CA-C-O 121.695 0.76 . . . . 0.0 110.09 -179.039 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 8' ' ' GLU . . . . . 0.421 ' HG2' ' H ' ' A' ' 10' ' ' GLU . 82.0 tt0 -161.36 -75.79 0.05 Allowed 'General case' 0 N--CA 1.489 1.478 0 N-CA-C 109.264 -0.643 . . . . 0.0 109.264 179.79 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 9' ' ' ASN . . . . . 0.439 ' OD1' ' SG ' ' A' ' 12' ' ' CYS . 37.6 t30 58.45 37.32 25.7 Favored 'General case' 0 N--CA 1.492 1.634 0 CA-C-O 121.466 0.65 . . . . 0.0 109.377 -179.773 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 10' ' ' GLU . . . . . 0.421 ' H ' ' HG2' ' A' ' 8' ' ' GLU . 83.8 tt0 -102.17 -22.26 14.23 Favored 'General case' 0 N--CA 1.494 1.771 0 N-CA-C 109.17 -0.678 . . . . 0.0 109.17 179.922 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 33.1 m -89.78 -5.94 10.74 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.674 0 N-CA-C 108.934 -0.765 . . . . 0.0 108.934 -179.892 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 12' ' ' CYS . . . . . 0.439 ' SG ' ' OD1' ' A' ' 9' ' ' ASN . 16.2 p -83.91 134.28 34.68 Favored 'General case' 0 N--CA 1.492 1.633 0 CA-C-O 121.692 0.758 . . . . 0.0 110.126 179.753 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 16.2 pt-20 -159.1 -24.85 0.07 Allowed 'General case' 0 N--CA 1.49 1.547 0 N-CA-C 109.05 -0.722 . . . . 0.0 109.05 179.756 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -84.23 -7.46 59.34 Favored 'General case' 0 N--CA 1.493 1.691 0 N-CA-C 108.792 -0.818 . . . . 0.0 108.792 -179.812 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 61.3 m -125.88 107.52 10.57 Favored 'General case' 0 N--CA 1.499 1.995 0 CA-C-O 121.784 0.802 . . . . 0.0 109.749 179.82 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . -89.19 -83.6 1.3 Allowed Glycine 0 N--CA 1.491 2.355 0 N-CA-C 109.813 -1.315 . . . . 0.0 109.813 -179.992 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 1.2 t -66.2 -38.91 89.13 Favored 'General case' 0 N--CA 1.493 1.719 0 O-C-N 121.819 -0.812 . . . . 0.0 109.757 -179.464 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . 53.68 34.93 19.93 Favored 'General case' 0 N--CA 1.491 1.608 0 CA-C-O 121.414 0.626 . . . . 0.0 109.422 -179.672 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -81.19 -5.05 90.35 Favored Glycine 0 N--CA 1.491 2.326 0 N-CA-C 109.311 -1.516 . . . . 0.0 109.311 179.961 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 84.7 tt0 -73.34 125.36 27.65 Favored 'General case' 0 N--CA 1.494 1.739 0 O-C-N 121.727 -0.866 . . . . 0.0 109.838 -179.645 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 21' ' ' ILE . . . . . . . . . . . . . 38.9 mm -57.52 -81.02 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.49 1.542 0 N-CA-C 109.515 -0.55 . . . . 0.0 109.515 -179.774 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 41.63 86.4 0.01 OUTLIER Glycine 0 N--CA 1.497 2.711 0 N-CA-C 109.946 -1.262 . . . . 0.0 109.946 -179.843 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 23' ' ' PHE . . . . . . . . . . . . . 49.5 t80 -62.36 -47.51 83.89 Favored 'General case' 0 N--CA 1.489 1.492 0 O-C-N 121.849 -0.795 . . . . 0.0 109.999 -179.66 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 24' ' ' ILE . . . . . 0.435 ' O ' ' O ' ' A' ' 25' ' ' ILE . 10.3 tp -171.53 130.38 0.14 Allowed 'Isoleucine or valine' 0 N--CA 1.49 1.544 0 O-C-N 121.671 -0.643 . . . . 0.0 110.396 179.964 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 25' ' ' ILE . . . . . 0.435 ' O ' ' O ' ' A' ' 24' ' ' ILE . 96.5 mt 41.61 95.02 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.494 1.751 0 CA-C-O 121.519 0.676 . . . . 0.0 110.127 179.635 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 9.6 ptm180 -76.77 156.04 32.67 Favored 'General case' 0 N--CA 1.495 1.81 0 CA-C-O 121.782 0.801 . . . . 0.0 110.766 -179.289 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 27' ' ' GLU . . . . . 0.478 ' CD ' ' N ' ' A' ' 28' ' ' GLY . 15.6 tm-20 -48.64 147.02 2.74 Favored 'General case' 0 N--CA 1.492 1.64 0 CA-C-O 121.838 0.827 . . . . 0.0 110.819 -179.268 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 28' ' ' GLY . . . . . 0.478 ' N ' ' CD ' ' A' ' 27' ' ' GLU . . . 88.7 -153.3 23.83 Favored Glycine 0 N--CA 1.49 2.272 0 N-CA-C 110.344 -1.102 . . . . 0.0 110.344 179.404 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 96.9 m-20 58.15 34.25 23.97 Favored 'General case' 0 N--CA 1.492 1.63 0 CA-C-O 121.316 0.579 . . . . 0.0 109.86 -179.714 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 34.8 t0 62.9 59.37 1.38 Allowed 'General case' 0 N--CA 1.491 1.608 0 CA-C-O 121.505 0.669 . . . . 0.0 109.513 179.391 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 53.6 t -117.79 133.93 63.01 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.802 0 CA-C-O 121.854 0.835 . . . . 0.0 109.276 179.989 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 32' ' ' ALA . . . . . 0.703 ' HB1' ' HZ2' ' A' ' 88' ' ' LYS . . . -99.22 151.67 20.76 Favored 'General case' 0 N--CA 1.49 1.528 0 CA-C-O 121.698 0.761 . . . . 0.0 109.838 -179.637 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 33' ' ' GLU . . . . . 0.543 ' N ' ' OE1' ' A' ' 33' ' ' GLU . 57.4 mp0 -110.17 120.04 41.2 Favored 'General case' 0 N--CA 1.492 1.675 0 CA-C-O 121.619 0.723 . . . . 0.0 109.442 -179.853 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 34' ' ' VAL . . . . . . . . . . . . . 55.0 t -125.42 133.8 68.37 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.73 0 CA-C-O 121.88 0.848 . . . . 0.0 109.605 179.996 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 15.6 m -153.87 138.94 17.33 Favored 'General case' 0 N--CA 1.49 1.532 0 CA-C-O 121.768 0.794 . . . . 0.0 109.425 179.412 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 36' ' ' LEU . . . . . 0.452 HD12 ' N ' ' A' ' 36' ' ' LEU . 8.2 mp -107.73 152.95 23.65 Favored 'General case' 0 N--CA 1.495 1.797 0 CA-C-O 121.823 0.821 . . . . 0.0 109.833 -179.628 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 37' ' ' PHE . . . . . . . . . . . . . 91.8 m-85 -127.67 149.14 50.34 Favored 'General case' 0 N--CA 1.491 1.58 0 CA-C-O 121.929 0.871 . . . . 0.0 109.962 -179.518 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 38' ' ' GLY . . . . . 0.426 ' O ' ' O ' ' A' ' 39' ' ' SER . . . 84.63 178.17 51.23 Favored Glycine 0 N--CA 1.487 2.084 0 N-CA-C 110.396 -1.082 . . . . 0.0 110.396 179.442 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 39' ' ' SER . . . . . 0.524 ' HG ' ' CG ' ' A' ' 43' ' ' HIS . 0.3 OUTLIER 55.66 159.78 0.01 OUTLIER 'General case' 0 N--CA 1.488 1.467 0 CA-C-O 121.659 0.743 . . . . 0.0 110.483 179.819 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 40' ' ' ASP . . . . . . . . . . . . . 54.9 p-10 -79.94 174.26 11.77 Favored 'General case' 0 N--CA 1.489 1.492 0 CA-C-O 121.906 0.86 . . . . 0.0 110.785 -179.11 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 41' ' ' LYS . . . . . 0.424 ' O ' ' OE1' ' A' ' 45' ' ' GLU . 21.1 tptm -59.48 -45.54 91.36 Favored 'General case' 0 C--N 1.306 -1.306 0 CA-C-N 116.022 -0.536 . . . . 0.0 110.105 -179.362 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -57.65 -47.32 82.6 Favored 'General case' 0 N--CA 1.492 1.645 0 O-C-N 121.735 -0.603 . . . . 0.0 109.886 -178.828 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 43' ' ' HIS . . . . . 0.524 ' CG ' ' HG ' ' A' ' 39' ' ' SER . 58.7 t-80 -68.33 -35.77 78.26 Favored 'General case' 0 N--CA 1.49 1.572 0 O-C-N 121.628 -0.67 . . . . 0.0 109.683 -179.736 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 13.9 mt -61.94 -42.53 99.21 Favored 'General case' 0 N--CA 1.492 1.67 0 O-C-N 121.625 -0.672 . . . . 0.0 109.386 -179.013 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 45' ' ' GLU . . . . . 0.512 ' OE1' ' N ' ' A' ' 45' ' ' GLU . 1.2 mp0 -63.32 -46.57 86.06 Favored 'General case' 0 N--CA 1.485 1.323 0 O-C-N 121.681 -0.637 . . . . 0.0 109.389 -179.587 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . -61.81 -44.22 98.17 Favored Glycine 0 N--CA 1.49 2.279 0 N-CA-C 109.044 -1.622 . . . . 0.0 109.044 -179.602 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 41.3 tptt -67.22 -35.41 79.54 Favored 'General case' 0 N--CA 1.485 1.315 0 O-C-N 121.834 -0.804 . . . . 0.0 109.039 179.887 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 27.1 tp -58.17 -29.99 66.05 Favored 'General case' 0 N--CA 1.492 1.638 0 N-CA-C 108.805 -0.813 . . . . 0.0 108.805 -179.394 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 49' ' ' ALA . . . . . . . . . . . . . . . -49.62 -27.93 5.18 Favored 'General case' 0 N--CA 1.492 1.651 0 CA-C-O 121.154 0.502 . . . . 0.0 109.988 -179.33 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 50' ' ' GLU . . . . . 0.507 ' CG ' ' N ' ' A' ' 51' ' ' TYR . 16.4 pt-20 -69.41 -42.36 75.15 Favored 'General case' 0 N--CA 1.489 1.514 0 CA-C-O 121.647 0.737 . . . . 0.0 109.281 -179.875 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 51' ' ' TYR . . . . . 0.507 ' N ' ' CG ' ' A' ' 50' ' ' GLU . 22.4 m-85 -60.91 -48.89 79.75 Favored 'General case' 0 N--CA 1.488 1.468 0 O-C-N 121.733 -0.605 . . . . 0.0 109.787 -178.638 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 52' ' ' ILE . . . . . . . . . . . . . 94.6 mt -66.5 -43.39 90.87 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.637 0 CA-C-O 121.201 0.525 . . . . 0.0 109.817 -179.479 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 68.3 m -59.78 -58.18 9.67 Favored 'General case' 0 N--CA 1.493 1.714 0 O-C-N 121.762 -0.587 . . . . 0.0 110.047 -178.567 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 54' ' ' LEU . . . . . 0.427 ' N ' HD22 ' A' ' 54' ' ' LEU . 4.1 mm? -64.03 -40.84 97.21 Favored 'General case' 0 C--N 1.301 -1.512 0 O-C-N 121.717 -0.614 . . . . 0.0 109.943 -179.724 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -60.05 -43.07 95.62 Favored 'General case' 0 N--CA 1.489 1.523 0 N-CA-C 109.508 -0.553 . . . . 0.0 109.508 -179.126 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 56' ' ' LYS . . . . . . . . . . . . . 65.8 tttm -65.36 -43.4 90.93 Favored 'General case' 0 C--N 1.307 -1.276 0 O-C-N 121.713 -0.617 . . . . 0.0 109.534 -179.981 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 87.7 mt-30 -65.21 -44.24 88.99 Favored 'General case' 0 N--CA 1.491 1.62 0 O-C-N 121.841 -0.537 . . . . 0.0 109.693 -179.393 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 58' ' ' VAL . . . . . . . . . . . . . 77.3 t -64.47 -44.8 97.0 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.536 0 N-CA-C 109.143 -0.688 . . . . 0.0 109.143 -179.667 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 59' ' ' TYR . . . . . 0.434 ' CE1' ' O ' ' A' ' 60' ' ' ALA . 54.5 t80 -130.58 120.25 23.74 Favored 'General case' 0 N--CA 1.495 1.806 0 CA-C-O 121.829 0.823 . . . . 0.0 109.727 -179.874 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 60' ' ' ALA . . . . . 0.434 ' O ' ' CE1' ' A' ' 59' ' ' TYR . . . -69.2 145.71 52.98 Favored 'General case' 0 N--CA 1.489 1.487 0 CA-C-O 121.623 0.725 . . . . 0.0 110.55 -179.771 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 61' ' ' ASN . . . . . . . . . . . . . 32.2 t-20 57.82 42.24 23.62 Favored 'General case' 0 N--CA 1.494 1.765 0 CA-C-O 121.325 0.583 . . . . 0.0 109.745 179.643 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 62' ' ' VAL . . . . . . . . . . . . . 12.6 p -68.87 137.85 23.52 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.628 0 CA-C-O 121.551 0.691 . . . . 0.0 110.179 179.959 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 63' ' ' GLU . . . . . 0.541 ' OE1' ' N ' ' A' ' 63' ' ' GLU . 57.1 mp0 -112.06 137.71 49.71 Favored 'General case' 0 N--CA 1.494 1.769 0 CA-C-O 121.81 0.814 . . . . 0.0 109.587 -179.752 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 64' ' ' TYR . . . . . . . . . . . . . 55.5 p90 -155.8 164.84 38.03 Favored 'General case' 0 N--CA 1.487 1.417 0 CA-C-O 121.931 0.872 . . . . 0.0 110.413 -179.693 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 83.0 tt0 -142.5 153.69 43.84 Favored 'General case' 0 N--CA 1.491 1.622 0 CA-C-O 121.56 0.695 . . . . 0.0 109.318 179.832 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 66' ' ' VAL . . . . . . . . . . . . . 2.9 p -123.53 132.32 71.58 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.794 0 CA-C-O 122.085 0.945 . . . . 0.0 109.887 -179.744 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 67' ' ' ALA . . . . . 0.481 ' HB1' ' HD2' ' A' ' 68' ' ' PRO . . . -85.89 160.23 53.05 Favored Pre-proline 0 N--CA 1.491 1.585 0 N-CA-C 109.221 -0.659 . . . . 0.0 109.221 179.945 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 68' ' ' PRO . . . . . 0.481 ' HD2' ' HB1' ' A' ' 67' ' ' ALA . 28.4 Cg_endo -59.83 134.67 58.56 Favored 'Trans proline' 0 C--N 1.307 -1.631 0 C-N-CA 122.728 2.286 . . . . 0.0 112.593 179.666 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 69' ' ' VAL . . . . . . . . . . . . . 99.5 t -138.63 139.15 41.67 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.8 0 CA-C-O 121.766 0.793 . . . . 0.0 110.442 179.82 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -67.08 154.64 40.7 Favored 'General case' 0 N--CA 1.488 1.47 0 CA-C-O 121.794 0.807 . . . . 0.0 110.018 179.787 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 71' ' ' ASP . . . . . 0.545 ' OD1' ' N ' ' A' ' 72' ' ' ASN . 42.3 p-10 -63.92 -34.44 77.96 Favored 'General case' 0 C--N 1.302 -1.465 0 CA-C-O 121.424 0.631 . . . . 0.0 109.45 -179.597 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 72' ' ' ASN . . . . . 0.545 ' N ' ' OD1' ' A' ' 71' ' ' ASP . 87.6 m-20 -104.28 28.32 6.97 Favored 'General case' 0 N--CA 1.494 1.773 0 N-CA-C 109.114 -0.699 . . . . 0.0 109.114 -179.474 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 73' ' ' ALA . . . . . 0.445 ' C ' ' H ' ' A' ' 75' ' ' GLU . . . -70.43 -11.54 60.99 Favored 'General case' 0 N--CA 1.493 1.695 0 N-CA-C 109.135 -0.691 . . . . 0.0 109.135 -179.88 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 74' ' ' THR . . . . . . . . . . . . . 47.5 p 52.4 10.31 0.13 Allowed 'General case' 0 N--CA 1.493 1.697 0 CA-C-O 121.27 0.557 . . . . 0.0 109.513 179.854 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 75' ' ' GLU . . . . . 0.445 ' H ' ' C ' ' A' ' 73' ' ' ALA . 15.3 pt-20 -153.01 179.91 8.26 Favored 'General case' 0 N--CA 1.49 1.571 0 CA-C-O 121.806 0.812 . . . . 0.0 110.095 179.834 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 7.3 tp -146.06 133.48 20.75 Favored 'General case' 0 C--N 1.303 -1.422 0 CA-C-O 121.708 0.766 . . . . 0.0 109.988 179.878 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 77' ' ' HIS . . . . . . . . . . . . . 97.8 m-70 -116.53 118.32 32.32 Favored 'General case' 0 N--CA 1.493 1.717 0 CA-C-O 121.854 0.835 . . . . 0.0 109.438 179.533 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -151.25 161.53 42.54 Favored 'General case' 0 N--CA 1.49 1.547 0 CA-C-O 121.657 0.742 . . . . 0.0 109.871 -179.885 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 81.0 mtp85 -130.31 150.61 51.47 Favored 'General case' 0 N--CA 1.495 1.789 0 CA-C-O 121.695 0.759 . . . . 0.0 109.803 -179.631 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 80' ' ' PHE . . . . . . . . . . . . . 28.9 m-85 -126.17 150.77 48.07 Favored 'General case' 0 N--CA 1.496 1.847 0 CA-C-O 121.574 0.702 . . . . 0.0 109.852 -179.711 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 88.4 tttt -113.66 126.8 55.66 Favored 'General case' 0 N--CA 1.494 1.755 0 CA-C-O 121.738 0.78 . . . . 0.0 109.593 -179.835 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 82' ' ' PHE . . . . . 0.524 ' CG ' ' OE2' ' A' ' 87' ' ' GLU . 73.0 m-85 -125.41 148.77 48.67 Favored 'General case' 0 N--CA 1.495 1.813 0 CA-C-O 121.796 0.808 . . . . 0.0 109.996 179.907 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 45.6 tp10 -70.51 -33.75 71.54 Favored 'General case' 0 N--CA 1.488 1.462 0 N-CA-C 109.346 -0.613 . . . . 0.0 109.346 -179.586 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 84' ' ' VAL . . . . . . . . . . . . . 33.1 m -131.68 162.52 39.33 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.936 0 CA-C-O 121.965 0.888 . . . . 0.0 110.411 -179.12 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 69.3 m -88.25 -15.65 35.29 Favored 'General case' 0 N--CA 1.492 1.672 0 N-CA-C 109.578 -0.527 . . . . 0.0 109.578 -179.643 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 86' ' ' ALA . . . . . . . . . . . . . . . -60.11 -46.23 90.3 Favored 'General case' 0 N--CA 1.492 1.642 0 O-C-N 121.444 -0.785 . . . . 0.0 109.475 -179.234 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 87' ' ' GLU . . . . . 0.524 ' OE2' ' CG ' ' A' ' 82' ' ' PHE . 2.9 pp20? -67.33 -30.68 70.58 Favored 'General case' 0 N--CA 1.488 1.45 0 O-C-N 121.738 -0.601 . . . . 0.0 109.411 -179.715 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 88' ' ' LYS . . . . . 0.703 ' HZ2' ' HB1' ' A' ' 32' ' ' ALA . 56.8 tttp -62.79 -45.54 92.17 Favored 'General case' 0 N--CA 1.491 1.582 0 O-C-N 121.73 -0.606 . . . . 0.0 109.379 -179.58 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 96.0 mt -62.89 -50.46 70.79 Favored 'General case' 0 N--CA 1.492 1.641 0 O-C-N 121.852 -0.53 . . . . 0.0 110.025 -179.036 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 90' ' ' ILE . . . . . . . . . . . . . 93.5 mt -69.77 -43.79 79.63 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.591 0 O-C-N 121.731 -0.605 . . . . 0.0 110.013 -179.971 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 91' ' ' PHE . . . . . 0.462 ' O ' HG23 ' A' ' 95' ' ' THR . 74.6 t80 -62.6 -45.81 91.15 Favored 'General case' 0 N--CA 1.491 1.614 0 O-C-N 121.57 -0.707 . . . . 0.0 109.799 -179.052 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 92' ' ' GLU . . . . . 0.54 ' CG ' ' NH1' ' A' ' 96' ' ' ARG . 82.1 tt0 -66.12 -40.65 90.83 Favored 'General case' 0 N--CA 1.491 1.599 0 O-C-N 121.662 -0.649 . . . . 0.0 109.332 -179.64 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 93' ' ' LEU . . . . . . . . . . . . . 4.7 tp -65.45 -43.35 90.63 Favored 'General case' 0 N--CA 1.489 1.495 0 O-C-N 121.584 -0.697 . . . . 0.0 109.749 -179.868 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 94' ' ' LYS . . . . . . . . . . . . . 6.9 ttpm? -68.58 -36.61 78.98 Favored 'General case' 0 N--CA 1.491 1.62 0 CA-C-O 121.24 0.543 . . . . 0.0 110.099 -179.073 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 95' ' ' THR . . . . . 0.462 HG23 ' O ' ' A' ' 91' ' ' PHE . 7.0 p -62.02 -50.5 71.8 Favored 'General case' 0 N--CA 1.491 1.606 0 O-C-N 121.64 -0.663 . . . . 0.0 109.824 -178.802 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 96' ' ' ARG . . . . . 0.54 ' NH1' ' CG ' ' A' ' 92' ' ' GLU . 72.5 mtt85 -64.62 -39.61 94.02 Favored 'General case' 0 N--CA 1.488 1.449 0 N-CA-C 108.864 -0.791 . . . . 0.0 108.864 179.39 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 97' ' ' ALA . . . . . . . . . . . . . . . -61.59 -39.35 90.87 Favored 'General case' 0 N--CA 1.488 1.444 0 N-CA-C 108.995 -0.743 . . . . 0.0 108.995 179.995 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 98' ' ' LEU . . . . . 0.657 ' O ' HD23 ' A' ' 98' ' ' LEU . 3.6 tt -63.66 -44.07 94.86 Favored 'General case' 0 N--CA 1.488 1.442 0 N-CA-C 108.934 -0.765 . . . . 0.0 108.934 -179.823 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 99' ' ' ALA . . . . . . . . . . . . . . . -64.42 -40.15 95.21 Favored 'General case' 0 N--CA 1.491 1.582 0 O-C-N 121.612 -0.68 . . . . 0.0 109.521 -179.393 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 100' ' ' ARG . . . . . . . . . . . . . 79.7 mtp85 -63.99 -41.9 97.37 Favored 'General case' 0 N--CA 1.491 1.6 0 O-C-N 121.769 -0.582 . . . . 0.0 109.453 -179.877 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 101' ' ' LEU . . . . . 0.493 HD12 ' N ' ' A' ' 101' ' ' LEU . 11.1 mp -92.72 120.33 33.0 Favored 'General case' 0 N--CA 1.494 1.753 0 CA-C-O 121.687 0.756 . . . . 0.0 109.23 -179.935 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 102' ' ' GLU . . . . . . . . . . . . . 79.5 mm-40 -141.64 106.02 4.83 Favored 'General case' 0 N--CA 1.495 1.814 0 CA-C-O 121.701 0.762 . . . . 0.0 109.744 -179.956 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 103' ' ' HIS . . . . . . . . . . . . . 98.6 m-70 -111.75 124.49 52.44 Favored 'General case' 0 N--CA 1.499 2.02 0 CA-C-O 121.858 0.837 . . . . 0.0 109.948 179.98 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 104' ' ' HIS . . . . . . . . . . . . . 79.0 m80 -82.32 125.49 31.06 Favored 'General case' 0 N--CA 1.492 1.638 0 CA-C-O 121.713 0.768 . . . . 0.0 109.817 -179.831 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 105' ' ' HIS . . . . . . . . . . . . . 78.3 m80 -67.11 -42.22 84.91 Favored 'General case' 0 N--CA 1.491 1.599 0 N-CA-C 109.477 -0.564 . . . . 0.0 109.477 -179.459 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 106' ' ' HIS . . . . . . . . . . . . . 25.6 p80 -107.44 124.98 50.65 Favored 'General case' 0 N--CA 1.497 1.914 0 CA-C-O 121.741 0.782 . . . . 0.0 110.167 -179.611 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 107' ' ' HIS . . . . . . . . . . . . . 94.7 m-70 -66.74 -40.15 88.23 Favored 'General case' 0 N--CA 1.49 1.549 0 N-CA-C 109.025 -0.731 . . . . 0.0 109.025 179.996 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 108' ' ' HIS . . . . . . . . . . . . . 86.4 t60 . . . . . 0 N--CA 1.491 1.583 0 CA-C-O 118.301 -0.857 . . . . 0.0 109.621 179.839 . . . . . . . . 0 0 . 1 . 009 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 95.4 mtp . . . . . 0 N--CA 1.489 1.525 0 CA-C-O 121.702 0.763 . . . . 0.0 109.003 . . . . . . . . . 0 0 . 1 . 009 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 11.3 m -70.86 152.36 43.78 Favored 'General case' 0 N--CA 1.489 1.479 0 CA-C-O 121.985 0.898 . . . . 0.0 110.718 -179.57 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 3' ' ' ASN . . . . . . . . . . . . . 99.9 m-20 47.88 -169.74 0.02 OUTLIER 'General case' 0 N--CA 1.489 1.488 0 CA-C-O 121.811 0.815 . . . . 0.0 110.787 179.742 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 78.2 mt-30 -71.84 -166.95 0.24 Allowed 'General case' 0 C--N 1.304 -1.402 0 CA-C-O 121.908 0.861 . . . . 0.0 110.45 -179.415 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 97.3 m 50.1 93.03 0.02 OUTLIER 'General case' 0 N--CA 1.489 1.506 0 CA-C-O 121.858 0.837 . . . . 0.0 110.147 -179.835 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 6' ' ' CYS . . . . . 0.414 ' SG ' ' O ' ' A' ' 6' ' ' CYS . 28.1 p -171.17 67.12 0.04 OUTLIER 'General case' 0 N--CA 1.489 1.511 0 N-CA-C 108.693 -0.854 . . . . 0.0 108.693 179.574 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 7' ' ' VAL . . . . . 0.416 HG22 ' H ' ' A' ' 7' ' ' VAL . 2.6 m -90.92 122.76 42.64 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.692 0 CA-C-O 121.746 0.784 . . . . 0.0 109.98 -179.48 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 15.1 pt-20 -94.92 -7.6 39.54 Favored 'General case' 0 N--CA 1.492 1.632 0 N-CA-C 108.715 -0.846 . . . . 0.0 108.715 179.334 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 93.8 m-20 -70.71 148.38 48.06 Favored 'General case' 0 N--CA 1.494 1.769 0 O-C-N 121.462 -0.774 . . . . 0.0 110.67 -178.969 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 51.0 tp10 -156.63 114.44 3.23 Favored 'General case' 0 N--CA 1.492 1.645 0 O-C-N 121.441 -0.787 . . . . 0.0 109.534 179.684 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 14.5 p -72.1 136.22 26.16 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.697 0 CA-C-O 121.603 0.716 . . . . 0.0 110.101 -179.856 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 12' ' ' CYS . . . . . 0.48 ' SG ' ' N ' ' A' ' 13' ' ' GLU . 48.2 t -149.9 166.87 28.27 Favored 'General case' 0 N--CA 1.49 1.529 0 O-C-N 121.371 -0.831 . . . . 0.0 109.421 179.945 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 13' ' ' GLU . . . . . 0.544 ' O ' ' N ' ' A' ' 15' ' ' CYS . 43.7 tp10 -151.04 66.79 0.91 Allowed 'General case' 0 N--CA 1.491 1.608 0 O-C-N 121.474 -0.766 . . . . 0.0 109.227 -179.851 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . 44.1 16.13 0.01 OUTLIER 'General case' 0 N--CA 1.494 1.768 0 CA-C-O 121.653 0.74 . . . . 0.0 110.045 -179.779 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 15' ' ' CYS . . . . . 0.544 ' N ' ' O ' ' A' ' 13' ' ' GLU . 7.7 t -144.92 137.13 25.99 Favored 'General case' 0 N--CA 1.49 1.551 0 O-C-N 121.237 -0.915 . . . . 0.0 110.066 -179.959 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 76.21 21.17 76.3 Favored Glycine 0 N--CA 1.492 2.389 0 N-CA-C 109.542 -1.423 . . . . 0.0 109.542 -179.992 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 97.4 m -64.28 -40.42 95.93 Favored 'General case' 0 N--CA 1.491 1.601 0 O-C-N 121.361 -1.082 . . . . 0.0 109.528 179.897 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -71.31 143.04 50.43 Favored 'General case' 0 N--CA 1.493 1.721 0 O-C-N 121.215 -0.928 . . . . 0.0 110.535 -179.781 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 170.88 42.96 0.03 OUTLIER Glycine 0 N--CA 1.491 2.304 0 N-CA-C 108.822 -1.711 . . . . 0.0 108.822 179.626 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 20' ' ' GLU . . . . . 0.668 ' CD ' ' H ' ' A' ' 20' ' ' GLU . 1.7 pm0 -61.1 147.46 43.81 Favored 'General case' 0 N--CA 1.494 1.765 0 O-C-N 121.439 -1.036 . . . . 0.0 110.009 -179.521 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 21' ' ' ILE . . . . . . . . . . . . . 5.1 mp -97.29 126.18 50.18 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.691 0 O-C-N 121.359 -0.838 . . . . 0.0 110.359 -179.366 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 169.25 -113.86 0.53 Allowed Glycine 0 N--CA 1.487 2.033 0 N-CA-C 109.656 -1.378 . . . . 0.0 109.656 179.918 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 23' ' ' PHE . . . . . . . . . . . . . 94.9 m-85 -101.58 148.86 24.73 Favored 'General case' 0 N--CA 1.498 1.943 0 O-C-N 121.401 -1.058 . . . . 0.0 110.417 -179.525 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 24' ' ' ILE . . . . . 0.519 ' O ' HG23 ' A' ' 24' ' ' ILE . 19.9 tt -162.19 121.22 0.22 Allowed 'Isoleucine or valine' 0 N--CA 1.489 1.493 0 O-C-N 121.44 -0.787 . . . . 0.0 109.678 -179.757 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 25' ' ' ILE . . . . . . . . . . . . . 95.3 mt -83.22 -75.41 0.22 Allowed 'Isoleucine or valine' 0 N--CA 1.491 1.612 0 O-C-N 121.583 -0.698 . . . . 0.0 109.726 -179.88 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 26' ' ' ARG . . . . . 0.434 ' O ' ' O ' ' A' ' 27' ' ' GLU . 78.6 ttt180 -156.02 -17.95 0.1 Allowed 'General case' 0 N--CA 1.491 1.621 0 O-C-N 121.201 -0.937 . . . . 0.0 109.212 -179.609 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 27' ' ' GLU . . . . . 0.434 ' O ' ' O ' ' A' ' 26' ' ' ARG . 97.7 mt-10 56.07 159.46 0.01 OUTLIER 'General case' 0 N--CA 1.496 1.868 0 CA-C-O 121.474 0.654 . . . . 0.0 110.42 179.605 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . 117.26 -169.67 13.22 Favored Glycine 0 N--CA 1.498 2.778 0 N-CA-C 110.826 -0.909 . . . . 0.0 110.826 179.284 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 99.3 m-20 -70.53 -16.91 62.93 Favored 'General case' 0 N--CA 1.493 1.677 0 O-C-N 121.821 -0.811 . . . . 0.0 108.926 179.67 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 90.1 m-20 -82.88 -0.1 46.68 Favored 'General case' 0 N--CA 1.489 1.481 0 N-CA-C 108.414 -0.958 . . . . 0.0 108.414 179.463 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 31' ' ' VAL . . . . . 0.611 HG11 HH21 ' A' ' 79' ' ' ARG . 52.2 t -126.64 135.38 63.9 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.9 0 N-CA-C 109.109 -0.7 . . . . 0.0 109.109 179.827 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -112.25 155.83 23.39 Favored 'General case' 0 N--CA 1.495 1.777 0 CA-C-O 121.629 0.728 . . . . 0.0 109.906 -179.378 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 83.6 tt0 -107.07 123.05 47.66 Favored 'General case' 0 N--CA 1.494 1.757 0 O-C-N 121.647 -0.658 . . . . 0.0 109.614 -179.578 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 34' ' ' VAL . . . . . . . . . . . . . 55.0 t -127.51 132.92 68.81 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.727 0 CA-C-O 121.681 0.753 . . . . 0.0 109.436 179.757 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 37.3 t -148.71 141.0 24.11 Favored 'General case' 0 N--CA 1.49 1.529 0 N-CA-C 109.143 -0.688 . . . . 0.0 109.143 179.61 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 4.9 mp -130.74 151.12 51.52 Favored 'General case' 0 N--CA 1.494 1.766 0 CA-C-O 121.76 0.79 . . . . 0.0 109.928 -179.683 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 37' ' ' PHE . . . . . . . . . . . . . 32.4 p90 -143.69 159.73 41.95 Favored 'General case' 0 C--N 1.301 -1.501 0 CA-C-O 121.551 0.691 . . . . 0.0 109.656 -179.733 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . 114.33 152.96 10.66 Favored Glycine 0 N--CA 1.493 2.475 0 N-CA-C 110.263 -1.135 . . . . 0.0 110.263 179.6 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 39' ' ' SER . . . . . 0.561 ' OG ' ' N ' ' A' ' 40' ' ' ASP . 16.8 t 52.59 -169.24 0.04 OUTLIER 'General case' 0 N--CA 1.491 1.598 0 CA-C-O 122.019 0.914 . . . . 0.0 110.883 179.622 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 40' ' ' ASP . . . . . 0.561 ' N ' ' OG ' ' A' ' 39' ' ' SER . 54.5 p-10 -85.42 178.48 7.43 Favored 'General case' 0 C--N 1.306 -1.318 0 CA-C-O 121.654 0.74 . . . . 0.0 110.178 -179.606 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 88.5 tttt -62.35 -39.0 91.69 Favored 'General case' 0 N--CA 1.49 1.559 0 CA-C-O 121.393 0.616 . . . . 0.0 110.32 -179.577 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -53.31 -41.91 66.13 Favored 'General case' 0 N--CA 1.493 1.714 0 O-C-N 121.286 -0.884 . . . . 0.0 109.825 -179.437 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 43' ' ' HIS . . . . . . . . . . . . . 86.5 t60 -66.76 -41.25 88.05 Favored 'General case' 0 N--CA 1.493 1.712 0 O-C-N 121.242 -0.911 . . . . 0.0 109.488 179.513 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 96.7 mt -63.18 -40.07 96.47 Favored 'General case' 0 N--CA 1.495 1.78 0 O-C-N 121.327 -0.858 . . . . 0.0 109.216 -180.0 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 97.1 mt-10 -61.23 -39.41 90.2 Favored 'General case' 0 N--CA 1.493 1.714 0 O-C-N 121.439 -0.788 . . . . 0.0 109.724 -179.921 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . -60.43 -49.12 82.06 Favored Glycine 0 N--CA 1.492 2.394 0 N-CA-C 109.814 -1.314 . . . . 0.0 109.814 179.96 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 52.1 mtpt -65.9 -37.91 87.35 Favored 'General case' 0 C--N 1.301 -1.526 0 O-C-N 121.429 -1.042 . . . . 0.0 109.565 179.62 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 48' ' ' LEU . . . . . 0.558 HD13 ' O ' ' A' ' 48' ' ' LEU . 0.2 OUTLIER -62.58 -44.39 96.44 Favored 'General case' 0 C--N 1.302 -1.486 0 O-C-N 121.324 -0.86 . . . . 0.0 109.596 -178.805 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 49' ' ' ALA . . . . . . . . . . . . . . . -62.23 -41.76 98.69 Favored 'General case' 0 C--N 1.299 -1.601 0 O-C-N 121.069 -1.019 . . . . 0.0 109.471 -179.617 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 77.1 tt0 -69.47 -36.83 76.93 Favored 'General case' 0 C--N 1.306 -1.316 0 O-C-N 121.419 -0.8 . . . . 0.0 109.199 179.718 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 3.1 m-85 -61.98 -43.49 98.73 Favored 'General case' 0 N--CA 1.496 1.828 0 O-C-N 121.579 -0.701 . . . . 0.0 109.361 -179.996 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 52' ' ' ILE . . . . . 0.407 HD13 ' CZ ' ' A' ' 64' ' ' TYR . 76.7 mt -63.66 -43.19 98.02 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.606 0 O-C-N 121.539 -0.726 . . . . 0.0 109.726 -179.883 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 78.1 p -61.13 -41.71 97.21 Favored 'General case' 0 N--CA 1.493 1.687 0 O-C-N 121.423 -0.798 . . . . 0.0 110.19 -179.253 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 54' ' ' LEU . . . . . . . . . . . . . 93.6 mt -64.98 -42.48 94.51 Favored 'General case' 0 N--CA 1.494 1.737 0 O-C-N 121.264 -0.897 . . . . 0.0 109.4 179.822 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 55' ' ' ALA . . . . . 0.408 ' HB2' ' CE1' ' A' ' 91' ' ' PHE . . . -67.07 -37.06 83.34 Favored 'General case' 0 N--CA 1.491 1.596 0 O-C-N 121.504 -0.748 . . . . 0.0 109.568 179.799 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 56' ' ' LYS . . . . . . . . . . . . . 56.4 tttp -63.27 -43.97 96.43 Favored 'General case' 0 N--CA 1.487 1.377 0 O-C-N 121.491 -0.756 . . . . 0.0 109.568 -179.718 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 77.5 mt-30 -66.13 -44.4 84.35 Favored 'General case' 0 N--CA 1.493 1.687 0 O-C-N 121.324 -0.86 . . . . 0.0 109.433 179.898 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 58' ' ' VAL . . . . . . . . . . . . . 72.3 t -65.18 -45.09 94.98 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.554 0 O-C-N 121.498 -0.751 . . . . 0.0 109.47 179.627 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 59' ' ' TYR . . . . . . . . . . . . . 87.1 t80 -125.05 127.45 46.96 Favored 'General case' 0 N--CA 1.497 1.901 0 CA-C-O 121.748 0.785 . . . . 0.0 109.666 -179.653 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -66.17 148.74 51.38 Favored 'General case' 0 N--CA 1.49 1.554 0 CA-C-O 121.829 0.824 . . . . 0.0 110.848 -179.182 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 61' ' ' ASN . . . . . . . . . . . . . 6.3 p-10 42.93 66.72 0.73 Allowed 'General case' 0 N--CA 1.493 1.71 0 CA-C-O 121.844 0.83 . . . . 0.0 109.966 179.904 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 62' ' ' VAL . . . . . . . . . . . . . 11.7 p -85.55 136.29 23.14 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.616 0 O-C-N 121.549 -0.719 . . . . 0.0 109.794 179.824 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 96.1 mt-10 -111.97 145.24 39.95 Favored 'General case' 0 N--CA 1.496 1.872 0 CA-C-O 121.734 0.778 . . . . 0.0 109.971 -179.517 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 64' ' ' TYR . . . . . 0.407 ' CZ ' HD13 ' A' ' 52' ' ' ILE . 46.9 p90 -149.52 161.54 41.93 Favored 'General case' 0 N--CA 1.49 1.552 0 CA-C-O 121.798 0.809 . . . . 0.0 110.212 -179.424 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 78.4 mm-40 -141.19 146.18 36.6 Favored 'General case' 0 N--CA 1.494 1.734 0 N-CA-C 109.034 -0.728 . . . . 0.0 109.034 179.851 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 66' ' ' VAL . . . . . . . . . . . . . 8.8 p -127.2 131.45 70.64 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.967 0 CA-C-O 121.608 0.718 . . . . 0.0 110.184 -179.744 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 67' ' ' ALA . . . . . 0.462 ' HB1' ' HD2' ' A' ' 68' ' ' PRO . . . -78.95 167.18 36.95 Favored Pre-proline 0 C--N 1.305 -1.356 0 N-CA-C 109.155 -0.683 . . . . 0.0 109.155 -179.95 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 68' ' ' PRO . . . . . 0.462 ' HD2' ' HB1' ' A' ' 67' ' ' ALA . 53.0 Cg_exo -52.27 127.49 23.96 Favored 'Trans proline' 0 N--CA 1.495 1.57 0 C-N-CA 122.383 2.055 . . . . 0.0 112.905 179.573 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 69' ' ' VAL . . . . . . . . . . . . . 70.9 t -132.5 133.27 59.9 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.845 0 O-C-N 121.541 -0.724 . . . . 0.0 109.621 179.482 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -82.04 157.86 24.0 Favored 'General case' 0 C--N 1.302 -1.495 0 O-C-N 121.607 -0.683 . . . . 0.0 109.951 179.637 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 43.4 t0 -64.01 -37.98 89.42 Favored 'General case' 0 N--CA 1.493 1.696 0 CA-C-O 121.606 0.717 . . . . 0.0 109.697 179.552 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 72' ' ' ASN . . . . . . . . . . . . . 90.4 m-20 -92.45 12.9 21.24 Favored 'General case' 0 N--CA 1.494 1.743 0 O-C-N 121.422 -0.799 . . . . 0.0 109.467 -179.567 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -64.25 146.51 54.22 Favored 'General case' 0 N--CA 1.496 1.83 0 O-C-N 121.19 -0.944 . . . . 0.0 110.406 -179.551 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 74' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -101.08 -4.35 27.53 Favored 'General case' 0 N--CA 1.494 1.748 0 O-C-N 121.515 -0.741 . . . . 0.0 109.69 179.819 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 82.9 tt0 -144.13 148.02 34.5 Favored 'General case' 0 N--CA 1.497 1.91 0 O-C-N 120.901 -1.125 . . . . 0.0 109.748 179.898 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 3.5 tt -126.17 135.31 51.49 Favored 'General case' 0 N--CA 1.49 1.573 0 CA-C-O 121.502 0.668 . . . . 0.0 109.549 -179.925 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 77' ' ' HIS . . . . . . . . . . . . . 99.1 m-70 -107.78 129.63 55.04 Favored 'General case' 0 N--CA 1.494 1.727 0 CA-C-O 121.578 0.704 . . . . 0.0 109.705 -179.519 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -148.03 153.99 39.67 Favored 'General case' 0 N--CA 1.49 1.529 0 O-C-N 121.587 -0.696 . . . . 0.0 109.438 -179.866 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 79' ' ' ARG . . . . . 0.611 HH21 HG11 ' A' ' 31' ' ' VAL . 79.7 mtp85 -132.74 149.36 52.29 Favored 'General case' 0 N--CA 1.494 1.726 0 CA-C-O 121.393 0.616 . . . . 0.0 109.387 -179.817 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 80' ' ' PHE . . . . . . . . . . . . . 61.8 m-85 -127.53 150.63 49.6 Favored 'General case' 0 N--CA 1.495 1.802 0 CA-C-O 121.536 0.684 . . . . 0.0 109.455 -179.872 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 53.7 tttp -110.5 112.85 25.05 Favored 'General case' 0 N--CA 1.493 1.678 0 CA-C-O 121.569 0.7 . . . . 0.0 109.35 179.874 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 82' ' ' PHE . . . . . . . . . . . . . 59.1 m-85 -111.24 145.22 39.12 Favored 'General case' 0 N--CA 1.495 1.788 0 CA-C-O 121.598 0.713 . . . . 0.0 109.71 179.915 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 46.2 tp10 -66.46 -38.65 87.81 Favored 'General case' 0 C--N 1.301 -1.505 0 O-C-N 121.692 -0.63 . . . . 0.0 109.904 -179.818 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 84' ' ' VAL . . . . . 0.431 ' CG2' ' OE2' ' A' ' 87' ' ' GLU . 16.6 m -136.17 161.24 37.88 Favored 'Isoleucine or valine' 0 N--CA 1.499 1.994 0 O-C-N 121.322 -0.861 . . . . 0.0 110.52 -179.421 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 33.9 m -70.57 -16.54 62.87 Favored 'General case' 0 N--CA 1.49 1.556 0 CA-C-O 121.367 0.604 . . . . 0.0 109.883 -179.902 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 86' ' ' ALA . . . . . . . . . . . . . . . -60.78 -42.37 97.38 Favored 'General case' 0 N--CA 1.493 1.724 0 O-C-N 121.188 -0.945 . . . . 0.0 109.567 -179.876 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 87' ' ' GLU . . . . . 0.551 ' OE1' ' N ' ' A' ' 87' ' ' GLU . 0.4 OUTLIER -70.36 -34.06 72.16 Favored 'General case' 0 N--CA 1.491 1.605 0 O-C-N 121.33 -0.856 . . . . 0.0 109.224 179.858 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 88' ' ' LYS . . . . . . . . . . . . . 88.5 tttt -61.79 -47.07 86.79 Favored 'General case' 0 N--CA 1.49 1.53 0 O-C-N 121.293 -0.88 . . . . 0.0 109.77 -179.921 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 56.6 tp -63.38 -45.77 89.57 Favored 'General case' 0 N--CA 1.489 1.515 0 O-C-N 121.288 -0.883 . . . . 0.0 109.715 -179.489 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 90' ' ' ILE . . . . . . . . . . . . . 96.5 mt -66.04 -44.54 92.03 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.611 0 O-C-N 121.508 -0.745 . . . . 0.0 109.839 -179.832 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 91' ' ' PHE . . . . . 0.408 ' CE1' ' HB2' ' A' ' 55' ' ' ALA . 54.1 t80 -62.98 -43.95 97.38 Favored 'General case' 0 N--CA 1.492 1.629 0 CA-C-O 121.64 0.733 . . . . 0.0 109.799 -179.636 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 92' ' ' GLU . . . . . . . . . . . . . 40.6 tp10 -56.28 -58.98 5.66 Favored 'General case' 0 N--CA 1.493 1.682 0 O-C-N 121.461 -0.775 . . . . 0.0 110.444 -178.897 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 93' ' ' LEU . . . . . 0.476 HD12 ' N ' ' A' ' 93' ' ' LEU . 10.8 mp -64.53 -39.27 93.46 Favored 'General case' 0 N--CA 1.495 1.778 0 O-C-N 121.266 -0.896 . . . . 0.0 110.553 -179.444 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 94' ' ' LYS . . . . . . . . . . . . . 38.6 ttmt -61.73 -46.96 87.41 Favored 'General case' 0 N--CA 1.493 1.719 0 O-C-N 120.997 -1.064 . . . . 0.0 110.639 -178.764 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 21.0 p -69.0 -40.6 78.61 Favored 'General case' 0 N--CA 1.493 1.719 0 O-C-N 120.887 -1.133 . . . . 0.0 109.686 -179.667 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 96' ' ' ARG . . . . . . . . . . . . . 82.6 mtp180 -64.89 -40.61 95.37 Favored 'General case' 0 N--CA 1.491 1.603 0 O-C-N 121.395 -0.816 . . . . 0.0 109.337 179.52 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 97' ' ' ALA . . . . . . . . . . . . . . . -61.65 -36.83 81.94 Favored 'General case' 0 N--CA 1.49 1.559 0 O-C-N 121.448 -0.783 . . . . 0.0 109.518 179.907 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 98' ' ' LEU . . . . . 0.651 ' O ' HD23 ' A' ' 98' ' ' LEU . 5.3 tt -62.62 -45.06 94.61 Favored 'General case' 0 N--CA 1.491 1.587 0 CA-C-O 121.698 0.761 . . . . 0.0 109.442 -179.932 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 99' ' ' ALA . . . . . . . . . . . . . . . -67.13 -20.85 65.83 Favored 'General case' 0 N--CA 1.491 1.613 0 O-C-N 121.468 -0.77 . . . . 0.0 109.59 -179.895 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 100' ' ' ARG . . . . . . . . . . . . . 99.2 mtt180 -82.26 3.71 26.45 Favored 'General case' 0 N--CA 1.49 1.539 0 O-C-N 121.409 -0.807 . . . . 0.0 109.38 179.653 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 101' ' ' LEU . . . . . . . . . . . . . 91.6 mt -85.67 -4.52 59.19 Favored 'General case' 0 N--CA 1.493 1.685 0 O-C-N 121.339 -0.851 . . . . 0.0 108.865 179.583 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 102' ' ' GLU . . . . . . . . . . . . . 71.3 mm-40 -59.57 133.7 56.34 Favored 'General case' 0 N--CA 1.491 1.593 0 CA-C-O 121.818 0.818 . . . . 0.0 110.229 -179.628 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 103' ' ' HIS . . . . . . . . . . . . . 57.8 t-80 -101.97 60.26 0.86 Allowed 'General case' 0 N--CA 1.492 1.628 0 O-C-N 121.641 -0.662 . . . . 0.0 109.404 179.938 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 104' ' ' HIS . . . . . 0.464 ' C ' ' H ' ' A' ' 106' ' ' HIS . 74.6 m80 -125.91 6.48 7.32 Favored 'General case' 0 N--CA 1.498 1.953 0 N-CA-C 108.686 -0.857 . . . . 0.0 108.686 179.611 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 105' ' ' HIS . . . . . . . . . . . . . 78.8 m80 52.15 9.63 0.1 Allowed 'General case' 0 N--CA 1.496 1.831 0 O-C-N 121.499 -0.75 . . . . 0.0 109.64 -179.945 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 106' ' ' HIS . . . . . 0.464 ' H ' ' C ' ' A' ' 104' ' ' HIS . 43.5 m80 -133.61 145.42 50.0 Favored 'General case' 0 N--CA 1.496 1.842 0 O-C-N 121.392 -0.818 . . . . 0.0 109.963 179.862 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 107' ' ' HIS . . . . . . . . . . . . . 94.1 m-70 -66.77 -38.84 87.37 Favored 'General case' 0 N--CA 1.49 1.564 0 CA-C-O 121.52 0.676 . . . . 0.0 109.675 179.718 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 108' ' ' HIS . . . . . . . . . . . . . 85.4 t60 . . . . . 0 N--CA 1.492 1.64 0 CA-C-O 118.019 -0.991 . . . . 0.0 109.691 -179.948 . . . . . . . . 0 0 . 1 . 010 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 38.2 ttm . . . . . 0 N--CA 1.489 1.493 0 N-CA-C 108.984 -0.747 . . . . 0.0 108.984 . . . . . . . . . 0 0 . 1 . 010 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 12.4 p 52.49 51.02 16.98 Favored 'General case' 0 N--CA 1.493 1.686 0 CA-C-O 121.66 0.743 . . . . 0.0 109.774 179.913 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 3' ' ' ASN . . . . . . . . . . . . . 54.3 t-20 -64.02 -40.46 96.39 Favored 'General case' 0 N--CA 1.493 1.694 0 CA-C-O 121.575 0.702 . . . . 0.0 109.879 179.552 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 14.4 mm100 -70.41 127.79 33.94 Favored 'General case' 0 N--CA 1.494 1.732 0 O-C-N 121.469 -0.769 . . . . 0.0 109.872 -179.278 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 81.5 p -78.06 165.51 23.93 Favored 'General case' 0 N--CA 1.492 1.652 0 CA-C-O 121.566 0.698 . . . . 0.0 110.364 -179.529 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 28.0 p -129.72 128.03 41.66 Favored 'General case' 0 N--CA 1.498 1.933 0 CA-C-O 121.72 0.771 . . . . 0.0 109.799 -179.571 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 7' ' ' VAL . . . . . . . . . . . . . 71.6 t -92.22 131.08 40.28 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.684 0 CA-C-O 122.016 0.912 . . . . 0.0 110.443 -179.408 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 8' ' ' GLU . . . . . 0.423 ' O ' HG12 ' A' ' 11' ' ' VAL . 98.0 mt-10 46.53 85.31 0.02 OUTLIER 'General case' 0 N--CA 1.489 1.509 0 CA-C-O 121.734 0.778 . . . . 0.0 110.179 179.804 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 9' ' ' ASN . . . . . 0.505 ' N ' ' OE2' ' A' ' 10' ' ' GLU . 54.4 p30 -89.79 -6.44 55.95 Favored 'General case' 0 N--CA 1.493 1.686 0 CA-C-O 121.321 0.582 . . . . 0.0 109.478 179.744 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 10' ' ' GLU . . . . . 0.58 ' CD ' ' H ' ' A' ' 10' ' ' GLU . 2.3 pm0 -94.08 -5.6 47.0 Favored 'General case' 0 N--CA 1.497 1.88 0 O-C-N 121.397 -0.815 . . . . 0.0 109.362 -179.998 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 11' ' ' VAL . . . . . 0.436 ' O ' HG13 ' A' ' 11' ' ' VAL . 7.0 p -73.83 128.35 36.2 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.711 0 O-C-N 121.405 -0.809 . . . . 0.0 109.971 -179.497 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 38.1 m -98.14 81.6 2.83 Favored 'General case' 0 N--CA 1.495 1.785 0 CA-C-O 121.589 0.709 . . . . 0.0 109.7 -179.579 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 48.3 tp10 -82.44 135.99 35.02 Favored 'General case' 0 N--CA 1.494 1.729 0 CA-C-O 121.733 0.778 . . . . 0.0 110.081 -179.727 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -82.3 112.81 19.62 Favored 'General case' 0 N--CA 1.494 1.747 0 CA-C-O 121.669 0.747 . . . . 0.0 110.396 -179.565 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 66.5 m -142.09 155.57 45.37 Favored 'General case' 0 N--CA 1.496 1.855 0 CA-C-O 121.645 0.735 . . . . 0.0 109.902 -179.948 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 16' ' ' GLY . . . . . 0.453 ' O ' ' O ' ' A' ' 17' ' ' CYS . . . 89.36 -6.74 83.13 Favored Glycine 0 N--CA 1.493 2.455 0 N-CA-C 109.901 -1.279 . . . . 0.0 109.901 179.903 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 17' ' ' CYS . . . . . 0.453 ' O ' ' O ' ' A' ' 16' ' ' GLY . 62.1 m 37.51 97.0 0.0 OUTLIER 'General case' 0 N--CA 1.5 2.058 0 CA-C-O 121.731 0.776 . . . . 0.0 110.724 179.892 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -56.23 139.77 46.78 Favored 'General case' 0 N--CA 1.492 1.654 0 CA-C-O 121.708 0.766 . . . . 0.0 110.462 -179.481 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -166.35 69.93 0.18 Allowed Glycine 0 N--CA 1.491 2.306 0 N-CA-C 109.31 -1.516 . . . . 0.0 109.31 179.959 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 74.7 mm-40 55.43 35.66 25.51 Favored 'General case' 0 N--CA 1.494 1.735 0 O-C-N 121.716 -0.873 . . . . 0.0 109.462 179.812 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 21' ' ' ILE . . . . . 0.543 HG22 ' O ' ' A' ' 21' ' ' ILE . 95.9 mt -67.82 0.05 1.02 Allowed 'Isoleucine or valine' 0 N--CA 1.49 1.531 0 CA-C-O 121.756 0.789 . . . . 0.0 109.333 179.522 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 89.57 70.67 1.24 Allowed Glycine 0 N--CA 1.493 2.437 0 N-CA-C 109.888 -1.285 . . . . 0.0 109.888 179.765 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 23' ' ' PHE . . . . . . . . . . . . . 55.6 p90 -82.45 15.84 2.34 Favored 'General case' 0 N--CA 1.492 1.645 0 O-C-N 121.673 -0.898 . . . . 0.0 109.243 179.681 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 16.3 pt -76.9 139.66 18.42 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.775 0 CA-C-O 121.65 0.738 . . . . 0.0 110.472 -179.717 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 25' ' ' ILE . . . . . . . . . . . . . 92.0 mt -99.0 131.74 45.67 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.623 0 CA-C-O 121.73 0.776 . . . . 0.0 110.443 -179.622 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 25.6 mmt85 -63.35 142.42 58.4 Favored 'General case' 0 C--N 1.302 -1.458 0 CA-C-O 122.11 0.957 . . . . 0.0 110.362 -179.514 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 27' ' ' GLU . . . . . 0.653 ' CD ' ' H ' ' A' ' 27' ' ' GLU . 2.1 pm0 -73.73 164.84 26.12 Favored 'General case' 0 C--N 1.3 -1.585 0 CA-C-O 121.835 0.826 . . . . 0.0 110.664 -179.253 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 28' ' ' GLY . . . . . 0.446 ' O ' ' OD1' ' A' ' 29' ' ' ASP . . . 91.53 -157.87 24.94 Favored Glycine 0 N--CA 1.49 2.29 0 N-CA-C 110.486 -1.046 . . . . 0.0 110.486 179.528 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 29' ' ' ASP . . . . . 0.446 ' OD1' ' O ' ' A' ' 28' ' ' GLY . 7.1 p-10 40.32 -145.98 0.03 OUTLIER 'General case' 0 N--CA 1.49 1.55 0 CA-C-O 121.86 0.838 . . . . 0.0 111.126 179.969 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 30' ' ' ASP . . . . . 0.402 ' OD2' ' O ' ' A' ' 82' ' ' PHE . 9.0 p-10 -82.74 72.74 9.81 Favored 'General case' 0 C--N 1.303 -1.451 0 O-C-N 121.596 -0.69 . . . . 0.0 109.777 -179.302 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 31' ' ' VAL . . . . . 0.596 ' CG1' HH11 ' A' ' 79' ' ' ARG . 53.5 t -124.96 135.33 64.42 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.881 0 CA-C-O 121.426 0.632 . . . . 0.0 109.433 179.858 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -130.56 140.98 50.46 Favored 'General case' 0 N--CA 1.494 1.759 0 CA-C-O 121.585 0.707 . . . . 0.0 109.471 -179.915 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 22.2 pt-20 -96.01 140.36 30.86 Favored 'General case' 0 N--CA 1.493 1.686 0 CA-C-O 121.501 0.667 . . . . 0.0 110.055 -179.495 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 34' ' ' VAL . . . . . 0.4 HG21 ' CD1' ' A' ' 80' ' ' PHE . 55.4 t -127.0 132.8 69.58 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.763 0 CA-C-O 121.513 0.673 . . . . 0.0 109.304 179.885 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 35' ' ' SER . . . . . 0.506 ' C ' HD12 ' A' ' 36' ' ' LEU . 39.4 t -140.35 128.27 21.99 Favored 'General case' 0 N--CA 1.493 1.701 0 CA-C-O 121.506 0.669 . . . . 0.0 109.724 -179.968 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 36' ' ' LEU . . . . . 0.506 HD12 ' C ' ' A' ' 35' ' ' SER . 11.0 mp -111.25 154.06 24.99 Favored 'General case' 0 N--CA 1.499 2.0 0 CA-C-O 121.509 0.671 . . . . 0.0 109.434 179.977 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 37' ' ' PHE . . . . . . . . . . . . . 92.3 t80 -124.58 130.24 52.07 Favored 'General case' 0 N--CA 1.493 1.679 0 CA-C-O 121.644 0.735 . . . . 0.0 109.508 -179.794 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . -164.95 -171.34 31.07 Favored Glycine 0 N--CA 1.491 2.314 0 N-CA-C 110.182 -1.167 . . . . 0.0 110.182 -179.697 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 14.0 p -85.99 -90.06 0.11 Allowed 'General case' 0 N--CA 1.497 1.903 0 O-C-N 121.909 -0.759 . . . . 0.0 110.738 -179.312 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 40' ' ' ASP . . . . . . . . . . . . . 52.6 p-10 -84.67 168.65 15.08 Favored 'General case' 0 N--CA 1.494 1.742 0 CA-C-O 121.777 0.799 . . . . 0.0 110.525 -178.944 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 88.9 tttt -65.2 -38.08 89.33 Favored 'General case' 0 N--CA 1.496 1.874 0 CA-C-O 121.311 0.577 . . . . 0.0 110.584 -179.506 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -55.1 -41.7 71.97 Favored 'General case' 0 N--CA 1.498 1.933 0 O-C-N 121.358 -0.839 . . . . 0.0 110.413 -178.974 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 43' ' ' HIS . . . . . . . . . . . . . 54.8 t-80 -66.63 -42.09 87.31 Favored 'General case' 0 N--CA 1.496 1.854 0 O-C-N 121.473 -0.767 . . . . 0.0 110.258 -179.555 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 74.1 mt -63.94 -40.34 96.24 Favored 'General case' 0 N--CA 1.497 1.897 0 O-C-N 121.469 -0.769 . . . . 0.0 109.767 -179.412 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 71.7 mm-40 -61.44 -43.46 98.83 Favored 'General case' 0 N--CA 1.492 1.655 0 CA-C-O 121.54 0.686 . . . . 0.0 109.794 -179.451 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . -62.2 -48.33 83.59 Favored Glycine 0 N--CA 1.494 2.534 0 N-CA-C 110.226 -1.15 . . . . 0.0 110.226 -179.648 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 61.5 tttp -66.82 -30.2 70.33 Favored 'General case' 0 N--CA 1.495 1.786 0 O-C-N 121.527 -0.984 . . . . 0.0 109.536 179.936 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 45.3 tp -62.23 -38.24 88.45 Favored 'General case' 0 N--CA 1.491 1.624 0 CA-C-O 121.492 0.663 . . . . 0.0 109.574 -179.509 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 49' ' ' ALA . . . . . . . . . . . . . . . -51.53 -33.47 32.16 Favored 'General case' 0 N--CA 1.493 1.687 0 O-C-N 121.565 -0.71 . . . . 0.0 109.559 -179.588 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 97.8 mt-10 -63.65 -43.2 97.44 Favored 'General case' 0 N--CA 1.493 1.695 0 O-C-N 121.585 -0.697 . . . . 0.0 109.622 -179.906 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 51' ' ' TYR . . . . . 0.468 ' CE1' HD21 ' A' ' 36' ' ' LEU . 32.8 m-85 -62.13 -46.39 89.23 Favored 'General case' 0 N--CA 1.494 1.764 0 O-C-N 121.466 -0.771 . . . . 0.0 109.706 -179.975 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 52' ' ' ILE . . . . . . . . . . . . . 96.5 mt -65.08 -43.99 95.79 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.652 0 O-C-N 121.649 -0.657 . . . . 0.0 109.871 -179.444 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 9.7 t -63.01 -46.63 86.72 Favored 'General case' 0 N--CA 1.495 1.807 0 O-C-N 121.48 -0.762 . . . . 0.0 109.656 -179.701 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 54' ' ' LEU . . . . . . . . . . . . . 91.0 mt -67.32 -40.0 85.92 Favored 'General case' 0 N--CA 1.494 1.732 0 CA-C-O 121.743 0.782 . . . . 0.0 109.181 179.54 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -58.83 -46.33 87.91 Favored 'General case' 0 N--CA 1.494 1.735 0 CA-C-O 121.46 0.648 . . . . 0.0 109.858 -179.447 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 56' ' ' LYS . . . . . . . . . . . . . 68.0 mttm -64.2 -41.21 97.16 Favored 'General case' 0 N--CA 1.492 1.668 0 O-C-N 121.537 -0.727 . . . . 0.0 109.647 179.834 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 67.2 tp60 -65.41 -46.1 81.32 Favored 'General case' 0 N--CA 1.491 1.608 0 O-C-N 121.591 -0.693 . . . . 0.0 109.506 -179.739 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 58' ' ' VAL . . . . . . . . . . . . . 71.5 t -65.89 -44.08 92.78 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.568 0 O-C-N 121.622 -0.673 . . . . 0.0 109.441 -179.98 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 59' ' ' TYR . . . . . 0.412 ' O ' ' O ' ' A' ' 60' ' ' ALA . 52.8 t80 -125.37 133.1 52.66 Favored 'General case' 0 N--CA 1.498 1.964 0 CA-C-O 121.799 0.809 . . . . 0.0 109.758 -179.874 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 60' ' ' ALA . . . . . 0.412 ' O ' ' O ' ' A' ' 59' ' ' TYR . . . -46.45 -100.04 0.0 OUTLIER 'General case' 0 N--CA 1.494 1.733 0 CA-C-O 121.562 0.696 . . . . 0.0 111.042 -179.471 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 61' ' ' ASN . . . . . . . . . . . . . 97.7 m-20 -86.01 90.09 8.0 Favored 'General case' 0 N--CA 1.491 1.612 0 CA-C-O 121.805 0.812 . . . . 0.0 109.79 -178.676 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 62' ' ' VAL . . . . . . . . . . . . . 9.6 p -90.89 140.45 15.96 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.587 0 CA-C-O 121.488 0.661 . . . . 0.0 109.952 179.947 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 76.1 mm-40 -112.67 134.44 54.19 Favored 'General case' 0 N--CA 1.494 1.741 0 CA-C-O 121.589 0.709 . . . . 0.0 109.445 -179.809 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 64' ' ' TYR . . . . . . . . . . . . . 47.0 p90 -148.9 162.5 39.73 Favored 'General case' 0 N--CA 1.492 1.661 0 CA-C-O 121.718 0.771 . . . . 0.0 110.078 -179.333 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 15.7 pt-20 -143.18 154.37 43.8 Favored 'General case' 0 N--CA 1.494 1.732 0 N-CA-C 109.2 -0.667 . . . . 0.0 109.2 179.905 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 66' ' ' VAL . . . . . . . . . . . . . 77.3 t -119.83 130.42 74.2 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.878 0 CA-C-O 121.686 0.755 . . . . 0.0 109.856 -179.569 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 67' ' ' ALA . . . . . 0.601 ' HB1' ' HD2' ' A' ' 68' ' ' PRO . . . -84.36 170.99 12.12 Favored Pre-proline 0 N--CA 1.49 1.559 0 N-CA-C 109.423 -0.584 . . . . 0.0 109.423 -179.932 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 68' ' ' PRO . . . . . 0.601 ' HD2' ' HB1' ' A' ' 67' ' ' ALA . 62.9 Cg_exo -52.01 131.47 38.97 Favored 'Trans proline' 0 N--CA 1.496 1.659 0 C-N-CA 122.699 2.266 . . . . 0.0 112.971 -179.806 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 69' ' ' VAL . . . . . . . . . . . . . 53.3 t -132.33 131.99 60.6 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.897 0 CA-C-O 121.651 0.738 . . . . 0.0 109.896 179.838 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -74.9 152.72 38.84 Favored 'General case' 0 N--CA 1.491 1.59 0 CA-C-O 121.731 0.776 . . . . 0.0 110.021 179.625 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 53.3 m-20 -64.11 -36.0 82.6 Favored 'General case' 0 N--CA 1.493 1.677 0 CA-C-O 121.541 0.686 . . . . 0.0 109.267 179.969 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 72' ' ' ASN . . . . . . . . . . . . . 63.2 t30 -94.58 13.37 24.35 Favored 'General case' 0 N--CA 1.494 1.745 0 O-C-N 121.279 -0.888 . . . . 0.0 109.279 179.977 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -58.05 145.38 36.58 Favored 'General case' 0 N--CA 1.497 1.889 0 CA-C-O 121.74 0.781 . . . . 0.0 110.806 -179.273 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 74' ' ' THR . . . . . . . . . . . . . 41.0 p -98.45 -1.03 42.34 Favored 'General case' 0 N--CA 1.493 1.717 0 N-CA-C 109.309 -0.626 . . . . 0.0 109.309 179.6 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 18.9 pt-20 -154.3 163.04 40.76 Favored 'General case' 0 N--CA 1.494 1.747 0 O-C-N 121.259 -0.9 . . . . 0.0 109.912 179.887 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 5.3 tt -126.41 127.81 46.02 Favored 'General case' 0 N--CA 1.494 1.738 0 CA-C-O 121.574 0.702 . . . . 0.0 109.728 -179.855 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 77' ' ' HIS . . . . . . . . . . . . . 60.6 t-80 -97.83 124.01 42.04 Favored 'General case' 0 N--CA 1.491 1.606 0 CA-C-O 121.775 0.798 . . . . 0.0 109.88 -179.765 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -142.75 158.03 44.05 Favored 'General case' 0 N--CA 1.491 1.618 0 N-CA-C 108.881 -0.785 . . . . 0.0 108.881 179.693 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 79' ' ' ARG . . . . . 0.596 HH11 ' CG1' ' A' ' 31' ' ' VAL . 63.2 ttm-85 -128.83 137.67 51.62 Favored 'General case' 0 N--CA 1.493 1.693 0 CA-C-O 121.536 0.684 . . . . 0.0 109.551 -179.685 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 80' ' ' PHE . . . . . 0.4 ' CD1' HG21 ' A' ' 34' ' ' VAL . 59.3 m-85 -123.78 146.67 48.16 Favored 'General case' 0 N--CA 1.496 1.844 0 CA-C-O 121.521 0.677 . . . . 0.0 109.524 -179.803 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 63.6 tttp -115.76 128.91 56.21 Favored 'General case' 0 N--CA 1.496 1.845 0 N-CA-C 109.115 -0.698 . . . . 0.0 109.115 -179.859 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 82' ' ' PHE . . . . . 0.402 ' O ' ' OD2' ' A' ' 30' ' ' ASP . 94.4 m-85 -122.55 -122.01 0.28 Allowed 'General case' 0 N--CA 1.499 1.979 0 CA-C-O 121.346 0.593 . . . . 0.0 109.902 -179.413 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 52.8 tp10 -150.71 -39.84 0.13 Allowed 'General case' 0 N--CA 1.489 1.521 0 N-CA-C 108.747 -0.834 . . . . 0.0 108.747 -179.544 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 84' ' ' VAL . . . . . . . . . . . . . 25.6 m -137.12 157.7 35.48 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.888 0 O-C-N 121.469 -0.77 . . . . 0.0 109.686 179.928 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 85' ' ' SER . . . . . 0.482 ' O ' ' N ' ' A' ' 88' ' ' LYS . 11.3 t -64.08 -42.03 97.11 Favored 'General case' 0 N--CA 1.494 1.726 0 CA-C-O 121.33 0.586 . . . . 0.0 110.329 -179.979 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 86' ' ' ALA . . . . . 0.42 ' C ' ' O ' ' A' ' 85' ' ' SER . . . -39.22 -46.06 1.45 Allowed 'General case' 0 N--CA 1.5 2.026 0 CA-C-O 121.45 0.643 . . . . 0.0 110.587 -179.01 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 96.1 mt-10 -62.73 -33.94 76.16 Favored 'General case' 0 N--CA 1.494 1.73 0 O-C-N 121.469 -0.769 . . . . 0.0 110.008 -179.779 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 88' ' ' LYS . . . . . 0.482 ' N ' ' O ' ' A' ' 85' ' ' SER . 88.2 tttt -63.02 -43.11 99.62 Favored 'General case' 0 N--CA 1.492 1.664 0 O-C-N 121.414 -0.804 . . . . 0.0 109.648 -179.802 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 89' ' ' LEU . . . . . 0.55 HD12 ' N ' ' A' ' 89' ' ' LEU . 10.6 mp -63.47 -48.47 77.53 Favored 'General case' 0 N--CA 1.495 1.788 0 O-C-N 121.604 -0.685 . . . . 0.0 110.371 -179.093 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 90' ' ' ILE . . . . . 0.52 ' N ' HD12 ' A' ' 90' ' ' ILE . 1.4 mp -69.67 -43.65 80.03 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.756 0 O-C-N 121.355 -0.84 . . . . 0.0 108.972 179.962 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 91' ' ' PHE . . . . . . . . . . . . . 88.3 t80 -59.2 -47.6 84.74 Favored 'General case' 0 C--N 1.302 -1.478 0 CA-C-O 121.725 0.774 . . . . 0.0 109.184 -179.585 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 92' ' ' GLU . . . . . . . . . . . . . 84.2 tt0 -69.97 -31.83 69.74 Favored 'General case' 0 N--CA 1.49 1.56 0 CA-C-O 121.533 0.682 . . . . 0.0 109.431 179.681 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 93' ' ' LEU . . . . . . . . . . . . . 61.6 tp -62.99 -45.46 92.3 Favored 'General case' 0 N--CA 1.492 1.651 0 O-C-N 121.328 -0.857 . . . . 0.0 109.754 -179.455 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 94' ' ' LYS . . . . . . . . . . . . . 52.4 mtmt -65.24 -42.38 93.43 Favored 'General case' 0 N--CA 1.491 1.6 0 CA-C-O 121.467 0.651 . . . . 0.0 110.088 -179.386 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 34.2 p -67.02 -38.35 85.79 Favored 'General case' 0 N--CA 1.492 1.669 0 O-C-N 121.514 -0.741 . . . . 0.0 110.193 -179.325 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 96' ' ' ARG . . . . . . . . . . . . . 77.8 mmt-85 -66.19 -39.02 89.38 Favored 'General case' 0 N--CA 1.493 1.686 0 O-C-N 121.302 -0.874 . . . . 0.0 109.563 -179.954 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 97' ' ' ALA . . . . . . . . . . . . . . . -64.83 -41.67 95.55 Favored 'General case' 0 C--N 1.301 -1.535 0 CA-C-O 121.635 0.731 . . . . 0.0 109.187 179.997 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 98' ' ' LEU . . . . . . . . . . . . . 81.6 mt -64.64 -42.79 95.21 Favored 'General case' 0 N--CA 1.492 1.661 0 CA-C-O 121.548 0.689 . . . . 0.0 109.665 179.865 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 99' ' ' ALA . . . . . . . . . . . . . . . -71.82 -47.41 53.42 Favored 'General case' 0 N--CA 1.493 1.689 0 CA-C-O 121.602 0.715 . . . . 0.0 109.909 -179.792 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 100' ' ' ARG . . . . . . . . . . . . . 94.9 mtt-85 -66.17 -43.09 87.88 Favored 'General case' 0 N--CA 1.492 1.671 0 O-C-N 121.561 -0.712 . . . . 0.0 110.018 -179.637 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 101' ' ' LEU . . . . . . . . . . . . . 69.2 mt -100.61 130.46 46.67 Favored 'General case' 0 N--CA 1.495 1.799 0 O-C-N 121.409 -0.807 . . . . 0.0 109.901 -179.448 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 102' ' ' GLU . . . . . . . . . . . . . 81.5 tt0 -90.01 -12.17 39.41 Favored 'General case' 0 N--CA 1.488 1.464 0 N-CA-C 109.153 -0.684 . . . . 0.0 109.153 179.814 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 103' ' ' HIS . . . . . . . . . . . . . 41.9 p-80 -150.9 162.46 40.75 Favored 'General case' 0 N--CA 1.498 1.932 0 O-C-N 121.212 -0.93 . . . . 0.0 110.191 179.949 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 104' ' ' HIS . . . . . . . . . . . . . 97.5 m-70 -88.85 118.63 28.69 Favored 'General case' 0 N--CA 1.493 1.724 0 CA-C-O 121.758 0.79 . . . . 0.0 110.011 -179.801 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 105' ' ' HIS . . . . . 0.419 ' ND1' ' C ' ' A' ' 105' ' ' HIS . 0.0 OUTLIER -97.31 10.09 40.51 Favored 'General case' 0 N--CA 1.493 1.7 0 CA-C-O 121.605 0.717 . . . . 0.0 109.103 179.707 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 106' ' ' HIS . . . . . . . . . . . . . 70.8 m80 -61.77 -39.08 90.39 Favored 'General case' 0 N--CA 1.492 1.663 0 CA-C-O 121.563 0.697 . . . . 0.0 109.26 179.435 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 107' ' ' HIS . . . . . . . . . . . . . 78.8 m80 -71.9 134.3 45.95 Favored 'General case' 0 N--CA 1.49 1.55 0 CA-C-O 121.74 0.781 . . . . 0.0 109.924 -179.442 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 108' ' ' HIS . . . . . . . . . . . . . 51.1 p-80 . . . . . 0 N--CA 1.494 1.752 0 CA-C-O 118.04 -0.981 . . . . 0.0 109.644 -179.815 . . . . . . . . 0 0 . 1 . 011 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 65.3 ttp . . . . . 0 N--CA 1.49 1.57 0 CA-C-O 121.493 0.663 . . . . 0.0 109.455 . . . . . . . . . 0 0 . 1 . 011 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 97.3 p -157.98 163.51 37.72 Favored 'General case' 0 N--CA 1.494 1.744 0 CA-C-O 121.703 0.763 . . . . 0.0 110.233 -179.954 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 3' ' ' ASN . . . . . . . . . . . . . 11.1 p30 -87.32 117.15 25.89 Favored 'General case' 0 N--CA 1.495 1.775 0 CA-C-O 121.51 0.672 . . . . 0.0 109.604 -179.815 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 7.2 pt20 -87.02 -2.25 58.49 Favored 'General case' 0 N--CA 1.495 1.788 0 N-CA-C 108.996 -0.742 . . . . 0.0 108.996 -179.68 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 70.7 p 46.53 -141.99 0.38 Allowed 'General case' 0 N--CA 1.494 1.744 0 CA-C-O 121.537 0.684 . . . . 0.0 110.582 179.656 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 21.1 p -158.67 177.35 11.29 Favored 'General case' 0 C--N 1.303 -1.434 0 CA-C-O 121.558 0.694 . . . . 0.0 110.03 -179.482 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 7' ' ' VAL . . . . . . . . . . . . . 78.0 t -71.22 -21.96 22.21 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.593 0 N-CA-C 109.29 -0.633 . . . . 0.0 109.29 -179.278 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 97.9 mt-10 -83.97 120.24 25.87 Favored 'General case' 0 N--CA 1.492 1.665 0 CA-C-O 121.585 0.707 . . . . 0.0 109.753 -179.929 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 66.1 t30 -151.91 -49.18 0.11 Allowed 'General case' 0 N--CA 1.492 1.639 0 O-C-N 121.556 -0.715 . . . . 0.0 109.074 179.522 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 98.1 mt-10 -72.87 150.17 42.87 Favored 'General case' 0 N--CA 1.496 1.868 0 CA-C-O 121.68 0.753 . . . . 0.0 110.812 -179.219 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 78.1 t -73.41 132.92 32.69 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.71 0 CA-C-O 121.728 0.775 . . . . 0.0 110.416 -179.308 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 47.6 m -94.63 143.02 26.78 Favored 'General case' 0 N--CA 1.493 1.685 0 CA-C-O 121.805 0.812 . . . . 0.0 110.428 -179.349 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 83.2 tt0 -161.61 83.79 0.61 Allowed 'General case' 0 N--CA 1.49 1.549 0 CA-C-O 121.513 0.673 . . . . 0.0 109.478 179.682 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -83.89 106.47 15.59 Favored 'General case' 0 N--CA 1.494 1.73 0 CA-C-O 121.629 0.728 . . . . 0.0 109.811 179.68 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 58.5 m 41.11 57.0 2.93 Favored 'General case' 0 N--CA 1.492 1.673 0 CA-C-O 121.496 0.665 . . . . 0.0 109.795 179.928 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . -66.98 141.22 39.37 Favored Glycine 0 N--CA 1.492 2.419 0 N-CA-C 110.577 -1.009 . . . . 0.0 110.577 -179.449 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 14.9 p -90.15 142.12 28.03 Favored 'General case' 0 N--CA 1.489 1.515 0 CA-C-O 121.615 0.721 . . . . 0.0 109.881 179.892 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -77.84 -78.11 0.14 Allowed 'General case' 0 C--N 1.3 -1.567 0 N-CA-C 109.4 -0.593 . . . . 0.0 109.4 179.859 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -84.84 135.23 13.33 Favored Glycine 0 N--CA 1.494 2.562 0 N-CA-C 111.146 -0.782 . . . . 0.0 111.146 -178.924 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 20' ' ' GLU . . . . . 0.485 ' HG3' ' H ' ' A' ' 22' ' ' GLY . 27.9 tp10 -71.51 153.03 42.5 Favored 'General case' 0 N--CA 1.488 1.437 0 CA-C-O 121.669 0.747 . . . . 0.0 109.998 179.835 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 21' ' ' ILE . . . . . . . . . . . . . 37.1 pt -91.36 -4.25 10.72 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.747 0 N-CA-C 109.087 -0.708 . . . . 0.0 109.087 -179.791 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 22' ' ' GLY . . . . . 0.485 ' H ' ' HG3' ' A' ' 20' ' ' GLU . . . 63.71 107.26 0.01 OUTLIER Glycine 0 N--CA 1.494 2.516 0 N-CA-C 110.846 -0.901 . . . . 0.0 110.846 179.113 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 23' ' ' PHE . . . . . . . . . . . . . 86.0 m-85 -76.95 -178.18 4.8 Favored 'General case' 0 N--CA 1.493 1.696 0 CA-C-O 121.611 0.719 . . . . 0.0 110.366 179.732 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 38.3 mm -65.12 -43.68 95.7 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.61 0 O-C-N 121.72 -0.613 . . . . 0.0 109.655 -179.233 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 25' ' ' ILE . . . . . . . . . . . . . 96.6 mt -79.91 125.38 38.86 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.688 0 CA-C-O 121.928 0.87 . . . . 0.0 109.687 -179.573 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 73.9 ttp85 -77.53 132.72 38.5 Favored 'General case' 0 N--CA 1.493 1.694 0 CA-C-O 121.809 0.814 . . . . 0.0 110.68 -178.81 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 15.1 pt-20 -77.87 147.21 35.22 Favored 'General case' 0 N--CA 1.49 1.537 0 CA-C-O 121.813 0.816 . . . . 0.0 110.496 179.987 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . -175.91 -172.58 40.83 Favored Glycine 0 N--CA 1.487 2.1 0 N-CA-C 110.25 -1.14 . . . . 0.0 110.25 179.702 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 98.8 m-20 -68.15 -16.05 63.84 Favored 'General case' 0 N--CA 1.489 1.504 0 O-C-N 121.95 -0.735 . . . . 0.0 109.114 -179.575 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 39.1 p-10 -88.5 2.16 53.42 Favored 'General case' 0 N--CA 1.494 1.743 0 O-C-N 121.729 -0.607 . . . . 0.0 109.366 -179.776 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 50.3 t -123.64 133.6 68.76 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.955 0 CA-C-O 121.602 0.715 . . . . 0.0 109.985 179.519 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 32' ' ' ALA . . . . . 0.626 ' HB1' ' NZ ' ' A' ' 88' ' ' LYS . . . -116.96 150.6 38.28 Favored 'General case' 0 N--CA 1.497 1.919 0 CA-C-O 121.977 0.894 . . . . 0.0 110.113 179.825 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 16.4 pt-20 -98.34 142.23 30.24 Favored 'General case' 0 N--CA 1.494 1.727 0 CA-C-O 121.615 0.722 . . . . 0.0 110.118 -179.821 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 34' ' ' VAL . . . . . . . . . . . . . 53.0 t -125.96 134.5 66.4 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.833 0 CA-C-O 121.789 0.804 . . . . 0.0 109.459 179.881 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 34.7 p -137.87 129.51 28.22 Favored 'General case' 0 N--CA 1.494 1.742 0 CA-C-O 121.726 0.774 . . . . 0.0 110.15 179.825 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 25.6 tp -127.99 139.83 52.34 Favored 'General case' 0 N--CA 1.492 1.64 0 CA-C-O 121.725 0.774 . . . . 0.0 109.574 179.656 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 37' ' ' PHE . . . . . . . . . . . . . 46.8 p90 -139.7 148.23 42.05 Favored 'General case' 0 N--CA 1.492 1.663 0 CA-C-O 121.902 0.858 . . . . 0.0 110.109 179.934 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . 155.31 128.52 1.15 Allowed Glycine 0 N--CA 1.49 2.234 0 N-CA-C 109.831 -1.308 . . . . 0.0 109.831 179.796 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 14.7 m 47.84 -146.6 0.25 Allowed 'General case' 0 N--CA 1.488 1.45 0 O-C-N 121.75 -0.853 . . . . 0.0 110.205 179.625 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 40' ' ' ASP . . . . . . . . . . . . . 56.1 p30 -86.94 -177.74 6.13 Favored 'General case' 0 N--CA 1.492 1.666 0 CA-C-O 121.606 0.717 . . . . 0.0 110.451 -178.903 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 88.8 tttt -62.66 -42.03 99.39 Favored 'General case' 0 N--CA 1.494 1.733 0 O-C-N 121.93 -0.481 . . . . 0.0 110.085 -179.091 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -49.86 -41.76 46.07 Favored 'General case' 0 N--CA 1.495 1.825 0 O-C-N 121.662 -0.648 . . . . 0.0 109.738 -178.645 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 43' ' ' HIS . . . . . . . . . . . . . 84.7 t60 -64.01 -41.55 97.42 Favored 'General case' 0 N--CA 1.491 1.614 0 CA-C-O 121.353 0.597 . . . . 0.0 109.619 -179.809 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 49.8 mt -64.11 -40.11 95.5 Favored 'General case' 0 N--CA 1.492 1.64 0 O-C-N 121.628 -0.67 . . . . 0.0 109.627 -179.467 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 79.6 mm-40 -62.93 -39.59 95.05 Favored 'General case' 0 N--CA 1.493 1.68 0 O-C-N 121.769 -0.582 . . . . 0.0 109.474 -179.263 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . -62.34 -42.4 99.71 Favored Glycine 0 N--CA 1.492 2.383 0 N-CA-C 109.604 -1.398 . . . . 0.0 109.604 -179.646 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 55.1 mtpt -83.19 -18.24 39.99 Favored 'General case' 0 N--CA 1.491 1.594 0 O-C-N 121.661 -0.905 . . . . 0.0 109.255 -179.634 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 58.2 tp -64.13 -39.83 94.88 Favored 'General case' 0 N--CA 1.488 1.45 0 N-CA-C 108.901 -0.777 . . . . 0.0 108.901 179.719 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 49' ' ' ALA . . . . . . . . . . . . . . . -58.02 -41.2 82.65 Favored 'General case' 0 N--CA 1.494 1.758 0 N-CA-C 109.588 -0.523 . . . . 0.0 109.588 -179.018 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 79.5 mm-40 -68.92 -37.16 78.76 Favored 'General case' 0 N--CA 1.494 1.753 0 O-C-N 121.648 -0.657 . . . . 0.0 109.244 179.966 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 3.6 m-85 -61.54 -43.88 98.06 Favored 'General case' 0 N--CA 1.496 1.836 0 O-C-N 121.615 -0.678 . . . . 0.0 109.505 -179.326 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 52' ' ' ILE . . . . . . . . . . . . . 90.8 mt -64.22 -42.38 95.3 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.653 0 N-CA-C 109.0 -0.741 . . . . 0.0 109.0 -179.973 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 11.5 t -59.01 -42.69 90.73 Favored 'General case' 0 N--CA 1.489 1.523 0 N-CA-C 109.092 -0.707 . . . . 0.0 109.092 -179.017 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 54' ' ' LEU . . . . . . . . . . . . . 88.8 mt -63.15 -40.95 99.05 Favored 'General case' 0 C--N 1.301 -1.541 0 N-CA-C 109.231 -0.655 . . . . 0.0 109.231 -179.962 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -65.93 -38.86 89.75 Favored 'General case' 0 N--CA 1.494 1.758 0 O-C-N 121.939 -0.476 . . . . 0.0 110.002 -179.253 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 56' ' ' LYS . . . . . . . . . . . . . 64.7 mttm -64.81 -41.46 95.76 Favored 'General case' 0 N--CA 1.493 1.717 0 O-C-N 121.528 -0.732 . . . . 0.0 109.79 -179.821 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 87.8 mt-30 -61.66 -46.23 90.64 Favored 'General case' 0 N--CA 1.488 1.474 0 N-CA-C 109.074 -0.713 . . . . 0.0 109.074 -179.502 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 58' ' ' VAL . . . . . . . . . . . . . 76.0 t -66.41 -44.27 90.75 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.591 0 N-CA-C 109.235 -0.654 . . . . 0.0 109.235 179.794 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 59' ' ' TYR . . . . . . . . . . . . . 87.7 t80 -140.42 118.53 11.95 Favored 'General case' 0 N--CA 1.498 1.929 0 CA-C-O 121.813 0.816 . . . . 0.0 110.046 -179.844 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -70.79 149.15 47.15 Favored 'General case' 0 N--CA 1.495 1.797 0 CA-C-O 121.572 0.701 . . . . 0.0 110.895 -179.854 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 61' ' ' ASN . . . . . . . . . . . . . 50.2 t-20 61.42 42.47 11.54 Favored 'General case' 0 N--CA 1.493 1.687 0 CA-C-O 121.602 0.715 . . . . 0.0 109.089 179.671 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 62' ' ' VAL . . . . . . . . . . . . . 9.4 p -80.37 137.27 21.78 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.531 0 CA-C-O 121.636 0.731 . . . . 0.0 110.383 -179.811 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 96.6 mt-10 -111.39 146.17 37.62 Favored 'General case' 0 N--CA 1.495 1.793 0 CA-C-O 121.967 0.889 . . . . 0.0 109.932 -179.844 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 64' ' ' TYR . . . . . . . . . . . . . 55.1 p90 -151.47 161.03 43.4 Favored 'General case' 0 N--CA 1.489 1.516 0 CA-C-O 121.503 0.668 . . . . 0.0 110.023 -179.667 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 74.6 mm-40 -138.13 151.02 47.37 Favored 'General case' 0 N--CA 1.5 2.049 0 CA-C-O 121.707 0.765 . . . . 0.0 110.406 -179.481 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 66' ' ' VAL . . . . . . . . . . . . . 53.4 t -122.62 130.84 74.21 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.969 0 CA-C-O 121.923 0.868 . . . . 0.0 110.163 -179.549 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 67' ' ' ALA . . . . . 0.591 ' HB1' ' HD2' ' A' ' 68' ' ' PRO . . . -81.41 170.28 15.88 Favored Pre-proline 0 N--CA 1.487 1.38 0 CA-C-O 121.167 0.508 . . . . 0.0 109.739 179.812 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 68' ' ' PRO . . . . . 0.591 ' HD2' ' HB1' ' A' ' 67' ' ' ALA . 31.5 Cg_exo -56.55 122.86 12.54 Favored 'Trans proline' 0 N--CA 1.494 1.557 0 C-N-CA 122.537 2.158 . . . . 0.0 112.601 179.922 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 69' ' ' VAL . . . . . . . . . . . . . 67.8 t -135.45 134.1 52.16 Favored 'Isoleucine or valine' 0 N--CA 1.499 1.975 0 CA-C-O 121.789 0.804 . . . . 0.0 110.379 179.903 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -71.55 151.64 43.67 Favored 'General case' 0 N--CA 1.497 1.877 0 CA-C-O 121.578 0.704 . . . . 0.0 110.583 179.934 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 98.4 m-20 -62.43 -35.93 80.81 Favored 'General case' 0 N--CA 1.493 1.722 0 N-CA-C 109.531 -0.544 . . . . 0.0 109.531 -179.537 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 72' ' ' ASN . . . . . . . . . . . . . 56.6 p30 -92.04 11.54 24.92 Favored 'General case' 0 N--CA 1.495 1.775 0 O-C-N 121.555 -0.716 . . . . 0.0 109.363 -179.288 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -66.14 144.03 56.92 Favored 'General case' 0 N--CA 1.493 1.723 0 O-C-N 121.496 -0.752 . . . . 0.0 109.736 179.833 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 74' ' ' THR . . . . . . . . . . . . . 3.8 m -99.18 -3.54 34.17 Favored 'General case' 0 N--CA 1.493 1.681 0 N-CA-C 108.697 -0.853 . . . . 0.0 108.697 -179.873 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 84.0 tt0 -135.88 150.49 49.38 Favored 'General case' 0 N--CA 1.492 1.656 0 CA-C-O 121.792 0.806 . . . . 0.0 109.522 179.977 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 4.7 tt -131.21 128.29 39.66 Favored 'General case' 0 N--CA 1.489 1.52 0 CA-C-O 121.806 0.812 . . . . 0.0 109.841 -179.725 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 77' ' ' HIS . . . . . . . . . . . . . 80.5 m80 -96.92 131.41 43.72 Favored 'General case' 0 N--CA 1.493 1.686 0 CA-C-O 121.857 0.836 . . . . 0.0 109.435 -179.805 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -147.64 155.78 42.12 Favored 'General case' 0 N--CA 1.49 1.551 0 CA-C-O 121.716 0.77 . . . . 0.0 109.995 -179.85 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 95.2 mtt180 -128.54 137.66 51.86 Favored 'General case' 0 N--CA 1.496 1.849 0 CA-C-O 121.794 0.807 . . . . 0.0 109.728 -179.881 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 80' ' ' PHE . . . . . . . . . . . . . 30.0 m-85 -129.44 147.78 51.29 Favored 'General case' 0 N--CA 1.495 1.809 0 CA-C-O 121.723 0.773 . . . . 0.0 109.629 179.885 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -124.96 146.24 49.48 Favored 'General case' 0 N--CA 1.495 1.813 0 CA-C-O 121.622 0.725 . . . . 0.0 109.774 179.902 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 82' ' ' PHE . . . . . . . . . . . . . 97.7 m-85 -132.67 -97.6 0.3 Allowed 'General case' 0 N--CA 1.496 1.873 0 CA-C-O 121.351 0.596 . . . . 0.0 109.701 -179.869 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 6.1 pt-20 -177.32 -28.87 0.01 OUTLIER 'General case' 0 N--CA 1.494 1.757 0 O-C-N 121.341 -0.85 . . . . 0.0 108.812 -179.82 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 84' ' ' VAL . . . . . . . . . . . . . 33.7 m -134.27 160.11 41.79 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.903 0 CA-C-O 121.814 0.816 . . . . 0.0 110.208 -179.918 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 35.6 m -79.61 -18.06 52.43 Favored 'General case' 0 N--CA 1.493 1.706 0 CA-C-O 121.348 0.595 . . . . 0.0 109.679 -179.711 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 86' ' ' ALA . . . . . . . . . . . . . . . -63.27 -42.93 99.19 Favored 'General case' 0 N--CA 1.493 1.712 0 O-C-N 121.519 -0.738 . . . . 0.0 109.515 -179.337 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 92.5 mt-10 -67.31 -29.64 69.27 Favored 'General case' 0 N--CA 1.493 1.708 0 O-C-N 121.523 -0.736 . . . . 0.0 109.471 -179.701 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 88' ' ' LYS . . . . . 0.626 ' NZ ' ' HB1' ' A' ' 32' ' ' ALA . 64.6 tttp -63.22 -46.06 88.74 Favored 'General case' 0 N--CA 1.489 1.498 0 O-C-N 121.681 -0.637 . . . . 0.0 109.531 -179.413 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 96.6 mt -64.14 -48.87 74.36 Favored 'General case' 0 N--CA 1.491 1.606 0 O-C-N 121.685 -0.634 . . . . 0.0 110.095 -178.965 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 90' ' ' ILE . . . . . 0.521 ' N ' HD12 ' A' ' 90' ' ' ILE . 1.3 mp -68.68 -44.21 82.6 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.612 0 O-C-N 121.766 -0.584 . . . . 0.0 109.735 179.904 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 91' ' ' PHE . . . . . . . . . . . . . 85.7 t80 -61.81 -44.73 96.28 Favored 'General case' 0 C--N 1.301 -1.542 0 N-CA-C 108.723 -0.843 . . . . 0.0 108.723 -178.972 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 92' ' ' GLU . . . . . . . . . . . . . 50.8 tp10 -63.16 -37.52 87.54 Favored 'General case' 0 C--N 1.302 -1.463 0 N-CA-C 109.28 -0.637 . . . . 0.0 109.28 -179.628 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 93' ' ' LEU . . . . . . . . . . . . . 6.3 tt -63.27 -46.6 86.06 Favored 'General case' 0 N--CA 1.489 1.511 0 CA-C-O 121.426 0.631 . . . . 0.0 109.677 -179.43 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 94' ' ' LYS . . . . . . . . . . . . . 67.8 mttm -66.5 -44.84 81.46 Favored 'General case' 0 N--CA 1.491 1.589 0 O-C-N 121.792 -0.568 . . . . 0.0 110.262 -179.408 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 22.3 p -69.13 -41.77 76.91 Favored 'General case' 0 N--CA 1.494 1.765 0 O-C-N 121.518 -0.738 . . . . 0.0 109.847 -179.188 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 96' ' ' ARG . . . . . . . . . . . . . 64.0 ttm-85 -68.23 -42.3 79.97 Favored 'General case' 0 N--CA 1.491 1.623 0 O-C-N 121.536 -0.727 . . . . 0.0 109.042 -179.818 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 97' ' ' ALA . . . . . . . . . . . . . . . -63.7 -41.42 98.13 Favored 'General case' 0 N--CA 1.49 1.526 0 N-CA-C 109.217 -0.661 . . . . 0.0 109.217 -179.499 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 98' ' ' LEU . . . . . 0.686 ' O ' HD23 ' A' ' 98' ' ' LEU . 3.1 tt -63.66 -40.66 97.39 Favored 'General case' 0 C--N 1.303 -1.452 0 CA-C-O 121.672 0.748 . . . . 0.0 109.026 -179.568 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 99' ' ' ALA . . . . . . . . . . . . . . . -61.44 -35.72 78.37 Favored 'General case' 0 C--N 1.301 -1.533 0 O-C-N 121.501 -0.749 . . . . 0.0 109.348 -179.1 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 100' ' ' ARG . . . . . . . . . . . . . 27.1 mmt180 -61.42 -44.94 96.26 Favored 'General case' 0 N--CA 1.492 1.675 0 O-C-N 121.748 -0.595 . . . . 0.0 110.416 -179.164 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 101' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -102.36 123.93 47.03 Favored 'General case' 0 N--CA 1.497 1.916 0 CA-C-O 121.729 0.776 . . . . 0.0 109.633 -179.728 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 102' ' ' GLU . . . . . 0.606 ' CD ' ' H ' ' A' ' 102' ' ' GLU . 0.8 OUTLIER -93.99 118.9 32.15 Favored 'General case' 0 N--CA 1.495 1.793 0 CA-C-O 121.952 0.882 . . . . 0.0 110.189 -179.986 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 103' ' ' HIS . . . . . . . . . . . . . 52.1 m170 -67.41 -39.45 85.52 Favored 'General case' 0 N--CA 1.488 1.466 0 N-CA-C 109.002 -0.74 . . . . 0.0 109.002 179.446 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 104' ' ' HIS . . . . . . . . . . . . . 77.6 m80 -78.3 154.0 31.28 Favored 'General case' 0 N--CA 1.492 1.649 0 CA-C-O 121.753 0.787 . . . . 0.0 110.346 -179.501 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 105' ' ' HIS . . . . . . . . . . . . . 78.4 m80 45.59 48.69 11.19 Favored 'General case' 0 N--CA 1.49 1.564 0 CA-C-O 121.626 0.727 . . . . 0.0 109.388 -179.747 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 106' ' ' HIS . . . . . . . . . . . . . 84.6 t60 -63.9 -41.68 97.63 Favored 'General case' 0 N--CA 1.489 1.479 0 N-CA-C 109.3 -0.63 . . . . 0.0 109.3 179.703 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 107' ' ' HIS . . . . . . . . . . . . . 84.2 t60 -64.34 -44.79 90.38 Favored 'General case' 0 N--CA 1.492 1.625 0 O-C-N 121.634 -0.666 . . . . 0.0 109.843 -179.44 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 108' ' ' HIS . . . . . . . . . . . . . 85.3 t60 . . . . . 0 N--CA 1.494 1.744 0 CA-C-O 117.7 -1.143 . . . . 0.0 109.8 -179.487 . . . . . . . . 0 0 . 1 . 012 nuclear build full ' A' A ' 1' ' ' MET . . . . . 0.411 ' SD ' ' N ' ' A' ' 1' ' ' MET . 4.3 mpp? . . . . . 0 N--CA 1.492 1.626 0 CA-C-O 121.792 0.806 . . . . 0.0 109.196 . . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 42.8 t -68.16 145.17 54.6 Favored 'General case' 0 N--CA 1.491 1.592 0 CA-C-O 121.682 0.754 . . . . 0.0 110.466 -179.251 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 3' ' ' ASN . . . . . . . . . . . . . 51.8 p30 -92.83 169.08 10.74 Favored 'General case' 0 N--CA 1.49 1.543 0 CA-C-O 121.8 0.809 . . . . 0.0 110.401 -179.767 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 99.4 mt-30 45.57 -168.36 0.01 OUTLIER 'General case' 0 N--CA 1.49 1.548 0 CA-C-O 121.904 0.859 . . . . 0.0 110.749 179.93 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 5' ' ' THR . . . . . 0.469 HG22 ' H ' ' A' ' 6' ' ' CYS . 3.5 m 62.35 -129.91 0.61 Allowed 'General case' 0 N--CA 1.489 1.507 0 CA-C-O 121.631 0.729 . . . . 0.0 110.965 179.802 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 6' ' ' CYS . . . . . 0.469 ' H ' HG22 ' A' ' 5' ' ' THR . 1.0 OUTLIER -60.42 -28.08 67.98 Favored 'General case' 0 N--CA 1.485 1.283 0 O-C-N 121.631 -0.668 . . . . 0.0 109.444 -179.501 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 7' ' ' VAL . . . . . . . . . . . . . 57.3 t -99.88 130.71 48.58 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.733 0 O-C-N 121.442 -0.787 . . . . 0.0 110.012 -179.354 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 84.1 tt0 -173.33 -44.66 0.01 OUTLIER 'General case' 0 N--CA 1.49 1.561 0 N-CA-C 109.151 -0.685 . . . . 0.0 109.151 179.427 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 63.8 t30 -79.91 -9.98 59.73 Favored 'General case' 0 N--CA 1.497 1.878 0 O-C-N 121.173 -0.954 . . . . 0.0 109.447 179.743 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 10' ' ' GLU . . . . . 0.539 ' OE1' ' N ' ' A' ' 10' ' ' GLU . 57.5 mp0 -87.2 151.23 23.35 Favored 'General case' 0 N--CA 1.494 1.738 0 O-C-N 121.329 -0.857 . . . . 0.0 110.079 -179.448 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 46.1 t -110.98 130.64 64.04 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.748 0 CA-C-O 121.97 0.89 . . . . 0.0 110.143 -179.105 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 12' ' ' CYS . . . . . 0.418 ' O ' ' C ' ' A' ' 13' ' ' GLU . 7.4 t -73.54 -74.75 0.17 Allowed 'General case' 0 N--CA 1.49 1.531 0 CA-C-N 115.954 -0.566 . . . . 0.0 110.319 -179.669 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 13' ' ' GLU . . . . . 0.418 ' C ' ' O ' ' A' ' 12' ' ' CYS . 95.7 mt-10 38.64 70.78 0.19 Allowed 'General case' 0 N--CA 1.496 1.874 0 CA-C-O 121.602 0.715 . . . . 0.0 109.899 -179.373 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -63.03 140.55 58.88 Favored 'General case' 0 N--CA 1.488 1.474 0 CA-C-O 121.716 0.769 . . . . 0.0 110.024 -179.264 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 96.9 m -100.0 147.19 25.86 Favored 'General case' 0 N--CA 1.491 1.612 0 CA-C-O 121.8 0.81 . . . . 0.0 110.085 -179.567 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . -89.09 -72.89 1.28 Allowed Glycine 0 N--CA 1.489 2.232 0 N-CA-C 110.09 -1.204 . . . . 0.0 110.09 -179.84 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 17' ' ' CYS . . . . . 0.522 ' O ' ' N ' ' A' ' 19' ' ' GLY . 96.7 m -64.63 -35.9 82.52 Favored 'General case' 0 N--CA 1.493 1.717 0 O-C-N 121.495 -1.003 . . . . 0.0 109.452 -179.837 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . 47.95 12.16 0.03 OUTLIER 'General case' 0 N--CA 1.492 1.673 0 O-C-N 121.588 -0.695 . . . . 0.0 109.738 -179.846 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 19' ' ' GLY . . . . . 0.522 ' N ' ' O ' ' A' ' 17' ' ' CYS . . . -85.28 2.53 88.1 Favored Glycine 0 N--CA 1.493 2.435 0 N-CA-C 109.2 -1.56 . . . . 0.0 109.2 179.535 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 7.1 pt-20 -43.62 95.05 0.01 OUTLIER 'General case' 0 N--CA 1.494 1.762 0 O-C-N 121.676 -0.896 . . . . 0.0 110.017 -179.702 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 21' ' ' ILE . . . . . 0.474 ' N ' ' O ' ' A' ' 19' ' ' GLY . 19.5 tt -89.8 129.72 40.26 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.583 0 CA-C-O 121.704 0.764 . . . . 0.0 110.142 -179.619 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 172.4 107.4 0.2 Allowed Glycine 0 N--CA 1.49 2.252 0 N-CA-C 109.448 -1.461 . . . . 0.0 109.448 179.664 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 23' ' ' PHE . . . . . . . . . . . . . 68.2 t80 -101.52 122.1 43.19 Favored 'General case' 0 N--CA 1.495 1.804 0 O-C-N 121.562 -0.963 . . . . 0.0 109.16 -179.913 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 3.5 pt -83.82 147.79 5.49 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.559 0 CA-C-O 121.948 0.88 . . . . 0.0 110.729 -179.311 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 25' ' ' ILE . . . . . 0.416 ' O ' ' O ' ' A' ' 26' ' ' ARG . 96.3 mt 53.39 101.67 0.02 OUTLIER 'Isoleucine or valine' 0 N--CA 1.486 1.358 0 CA-C-O 121.815 0.817 . . . . 0.0 109.785 179.864 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 26' ' ' ARG . . . . . 0.449 ' CG ' ' H ' ' A' ' 27' ' ' GLU . 11.3 tpt180 -60.21 -137.06 0.0 OUTLIER 'General case' 0 N--CA 1.491 1.6 0 CA-C-O 121.689 0.757 . . . . 0.0 110.83 -179.2 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 27' ' ' GLU . . . . . 0.449 ' H ' ' CG ' ' A' ' 26' ' ' ARG . 37.9 tp10 -132.92 58.73 1.76 Allowed 'General case' 0 N--CA 1.493 1.692 0 CA-C-O 121.649 0.738 . . . . 0.0 109.345 -179.819 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 28' ' ' GLY . . . . . 0.508 ' O ' HG12 ' A' ' 31' ' ' VAL . . . -66.43 169.29 33.25 Favored Glycine 0 N--CA 1.492 2.376 0 N-CA-C 110.585 -1.006 . . . . 0.0 110.585 -179.857 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 29' ' ' ASP . . . . . 0.407 ' N ' ' OD1' ' A' ' 29' ' ' ASP . 37.4 p-10 -79.54 -2.63 43.19 Favored 'General case' 0 N--CA 1.489 1.515 0 O-C-N 121.72 -0.87 . . . . 0.0 109.496 179.868 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 62.3 t0 -94.36 25.96 3.61 Favored 'General case' 0 N--CA 1.492 1.662 0 N-CA-C 108.674 -0.861 . . . . 0.0 108.674 -179.95 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 31' ' ' VAL . . . . . 0.508 HG12 ' O ' ' A' ' 28' ' ' GLY . 4.2 p -129.25 153.98 39.45 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.804 0 CA-C-O 121.349 0.595 . . . . 0.0 109.851 -179.58 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -133.18 148.12 52.06 Favored 'General case' 0 N--CA 1.493 1.71 0 CA-C-O 121.661 0.744 . . . . 0.0 109.575 -179.953 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 98.2 mt-10 -92.17 148.06 22.45 Favored 'General case' 0 N--CA 1.49 1.557 0 CA-C-O 121.559 0.695 . . . . 0.0 110.084 -179.877 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 34' ' ' VAL . . . . . . . . . . . . . 51.6 t -127.01 132.64 69.73 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.671 0 CA-C-O 121.556 0.693 . . . . 0.0 109.385 -179.962 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 70.7 m -125.48 122.75 37.53 Favored 'General case' 0 N--CA 1.492 1.65 0 N-CA-C 109.342 -0.614 . . . . 0.0 109.342 179.918 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 39.8 tp -120.85 133.07 55.31 Favored 'General case' 0 N--CA 1.496 1.841 0 CA-C-O 121.602 0.715 . . . . 0.0 109.336 179.741 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 37' ' ' PHE . . . . . . . . . . . . . 83.4 m-85 -93.94 147.79 22.77 Favored 'General case' 0 N--CA 1.49 1.557 0 CA-C-O 121.646 0.736 . . . . 0.0 110.083 -179.526 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . 179.96 -179.29 48.81 Favored Glycine 0 N--CA 1.487 2.045 0 N-CA-C 110.05 -1.22 . . . . 0.0 110.05 179.877 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 39' ' ' SER . . . . . 0.43 ' O ' ' O ' ' A' ' 73' ' ' ALA . 13.3 p -82.7 -102.85 0.04 OUTLIER 'General case' 0 N--CA 1.49 1.54 0 O-C-N 121.692 -0.887 . . . . 0.0 110.325 -179.715 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 40' ' ' ASP . . . . . . . . . . . . . 52.4 p-10 -83.8 174.97 9.98 Favored 'General case' 0 N--CA 1.492 1.629 0 O-C-N 121.371 -0.83 . . . . 0.0 110.777 -179.037 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 37.5 ttmt -62.95 -39.91 96.06 Favored 'General case' 0 N--CA 1.49 1.54 0 O-C-N 121.712 -0.617 . . . . 0.0 110.63 -179.353 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -56.17 -43.32 78.26 Favored 'General case' 0 N--CA 1.495 1.815 0 O-C-N 121.223 -0.923 . . . . 0.0 109.893 -179.166 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 43' ' ' HIS . . . . . . . . . . . . . 83.2 t60 -66.9 -43.11 84.27 Favored 'General case' 0 N--CA 1.494 1.773 0 O-C-N 121.408 -0.808 . . . . 0.0 109.878 -179.853 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 47.5 mt -63.86 -40.58 96.9 Favored 'General case' 0 N--CA 1.494 1.774 0 O-C-N 121.302 -0.874 . . . . 0.0 109.939 -179.642 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 97.1 mt-10 -65.09 -36.12 83.29 Favored 'General case' 0 N--CA 1.494 1.765 0 O-C-N 121.315 -0.865 . . . . 0.0 109.662 -179.708 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . -61.02 -42.47 99.81 Favored Glycine 0 N--CA 1.492 2.395 0 N-CA-C 109.407 -1.477 . . . . 0.0 109.407 179.993 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 97.4 mttt -83.19 -17.11 44.0 Favored 'General case' 0 N--CA 1.492 1.633 0 O-C-N 121.533 -0.98 . . . . 0.0 109.308 179.548 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 48' ' ' LEU . . . . . 0.564 HD13 ' CD2' ' A' ' 76' ' ' LEU . 51.5 tp -65.18 -39.44 92.91 Favored 'General case' 0 N--CA 1.491 1.611 0 O-C-N 121.536 -0.728 . . . . 0.0 109.697 179.954 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 49' ' ' ALA . . . . . . . . . . . . . . . -54.25 -28.59 42.52 Favored 'General case' 0 N--CA 1.491 1.618 0 O-C-N 121.591 -0.693 . . . . 0.0 109.571 -179.131 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 80.5 mm-40 -66.72 -42.75 85.83 Favored 'General case' 0 N--CA 1.492 1.638 0 O-C-N 121.384 -0.822 . . . . 0.0 109.335 179.78 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 32.0 m-85 -61.2 -44.62 96.99 Favored 'General case' 0 N--CA 1.495 1.811 0 O-C-N 121.551 -0.718 . . . . 0.0 109.891 -179.969 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 52' ' ' ILE . . . . . . . . . . . . . 96.6 mt -65.28 -43.75 95.09 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.59 0 O-C-N 121.676 -0.64 . . . . 0.0 110.58 -179.208 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 5.2 t -61.06 -51.62 68.39 Favored 'General case' 0 N--CA 1.494 1.741 0 O-C-N 121.271 -0.893 . . . . 0.0 110.316 -179.037 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 54' ' ' LEU . . . . . . . . . . . . . 4.0 mm? -66.0 -38.07 87.53 Favored 'General case' 0 N--CA 1.492 1.657 0 O-C-N 121.525 -0.734 . . . . 0.0 109.886 179.716 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -55.39 -48.12 74.82 Favored 'General case' 0 N--CA 1.49 1.572 0 O-C-N 121.513 -0.742 . . . . 0.0 110.332 -179.029 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 56' ' ' LYS . . . . . . . . . . . . . 61.4 mttp -65.65 -42.68 91.12 Favored 'General case' 0 N--CA 1.493 1.683 0 O-C-N 121.299 -0.876 . . . . 0.0 110.121 -179.921 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 95.9 mt-30 -65.62 -45.69 82.14 Favored 'General case' 0 N--CA 1.493 1.7 0 O-C-N 121.402 -0.811 . . . . 0.0 109.488 -179.656 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 58' ' ' VAL . . . . . . . . . . . . . 71.7 t -65.15 -45.86 92.76 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.478 0 O-C-N 121.589 -0.695 . . . . 0.0 109.343 179.783 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 59' ' ' TYR . . . . . . . . . . . . . 52.4 t80 -132.33 119.52 20.85 Favored 'General case' 0 N--CA 1.496 1.853 0 CA-C-O 121.616 0.722 . . . . 0.0 109.108 -179.979 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -70.51 144.39 51.36 Favored 'General case' 0 N--CA 1.491 1.592 0 CA-C-O 121.813 0.816 . . . . 0.0 110.913 -179.236 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 61' ' ' ASN . . . . . . . . . . . . . 40.3 t-20 57.79 41.81 24.4 Favored 'General case' 0 N--CA 1.492 1.63 0 CA-C-O 121.851 0.834 . . . . 0.0 109.349 179.926 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 62' ' ' VAL . . . . . . . . . . . . . 8.2 p -74.09 138.84 20.35 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.48 0 CA-C-O 121.631 0.729 . . . . 0.0 110.452 -179.776 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 71.7 mm-40 -112.64 137.59 50.68 Favored 'General case' 0 N--CA 1.494 1.751 0 CA-C-O 121.609 0.719 . . . . 0.0 109.402 179.968 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 64' ' ' TYR . . . . . . . . . . . . . 50.9 p90 -149.64 161.08 42.88 Favored 'General case' 0 N--CA 1.489 1.493 0 CA-C-O 121.721 0.772 . . . . 0.0 110.337 -179.585 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 50.8 tp10 -142.4 148.72 38.29 Favored 'General case' 0 N--CA 1.49 1.573 0 N-CA-C 108.997 -0.742 . . . . 0.0 108.997 179.782 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 66' ' ' VAL . . . . . . . . . . . . . 54.9 t -111.62 130.87 64.41 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.791 0 CA-C-O 121.79 0.805 . . . . 0.0 109.839 -179.59 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -82.18 158.91 66.22 Favored Pre-proline 0 N--CA 1.488 1.425 0 N-CA-C 109.605 -0.517 . . . . 0.0 109.605 -179.759 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 68' ' ' PRO . . . . . . . . . . . . . 48.6 Cg_exo -51.26 128.8 26.58 Favored 'Trans proline' 0 N--CA 1.493 1.45 0 C-N-CA 122.233 1.955 . . . . 0.0 112.178 179.039 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 69' ' ' VAL . . . . . . . . . . . . . 54.0 t -131.27 135.31 59.83 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.754 0 CA-C-O 121.649 0.738 . . . . 0.0 110.02 -179.827 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -69.71 152.47 44.62 Favored 'General case' 0 C--N 1.303 -1.451 0 CA-C-O 121.75 0.786 . . . . 0.0 110.006 179.554 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 12.9 m-20 -64.27 -34.49 78.24 Favored 'General case' 0 N--CA 1.491 1.586 0 O-C-N 121.629 -0.67 . . . . 0.0 109.424 179.886 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 72' ' ' ASN . . . . . . . . . . . . . 57.1 p30 -94.8 16.32 16.18 Favored 'General case' 0 N--CA 1.493 1.704 0 O-C-N 121.348 -0.845 . . . . 0.0 109.435 -179.445 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 73' ' ' ALA . . . . . 0.43 ' O ' ' O ' ' A' ' 39' ' ' SER . . . -66.6 144.95 56.11 Favored 'General case' 0 N--CA 1.491 1.594 0 O-C-N 121.525 -0.734 . . . . 0.0 110.059 179.964 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 74' ' ' THR . . . . . . . . . . . . . 61.4 p -101.13 -0.96 35.2 Favored 'General case' 0 N--CA 1.493 1.688 0 O-C-N 121.551 -0.718 . . . . 0.0 109.299 179.857 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 95.3 mt-10 -139.58 160.05 40.76 Favored 'General case' 0 N--CA 1.496 1.856 0 O-C-N 121.256 -0.903 . . . . 0.0 109.835 -179.856 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 76' ' ' LEU . . . . . 0.564 ' CD2' HD13 ' A' ' 48' ' ' LEU . 6.5 tp -123.8 131.15 53.53 Favored 'General case' 0 N--CA 1.491 1.617 0 CA-C-O 121.524 0.678 . . . . 0.0 109.37 -179.95 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 77' ' ' HIS . . . . . . . . . . . . . 97.2 m-70 -106.35 126.77 52.65 Favored 'General case' 0 N--CA 1.493 1.681 0 CA-C-O 121.541 0.686 . . . . 0.0 109.689 -179.767 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -149.4 159.75 44.03 Favored 'General case' 0 N--CA 1.49 1.529 0 CA-C-O 121.507 0.67 . . . . 0.0 109.848 -179.763 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 86.4 mtm-85 -127.47 142.37 51.42 Favored 'General case' 0 N--CA 1.495 1.8 0 CA-C-O 121.508 0.671 . . . . 0.0 109.433 -179.847 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 80' ' ' PHE . . . . . . . . . . . . . 44.1 m-85 -127.87 149.47 50.28 Favored 'General case' 0 N--CA 1.498 1.931 0 CA-C-O 121.401 0.619 . . . . 0.0 109.741 -179.482 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 82.8 tttt -111.73 133.36 54.01 Favored 'General case' 0 N--CA 1.493 1.698 0 CA-C-O 121.554 0.692 . . . . 0.0 109.685 -179.861 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 82' ' ' PHE . . . . . . . . . . . . . 71.8 m-85 -137.54 -128.53 0.13 Allowed 'General case' 0 N--CA 1.494 1.73 0 CA-C-O 121.442 0.639 . . . . 0.0 109.711 -179.665 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 81.3 tt0 -149.8 -34.14 0.18 Allowed 'General case' 0 N--CA 1.489 1.489 0 O-C-N 121.519 -0.738 . . . . 0.0 109.132 -179.765 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 84' ' ' VAL . . . . . . . . . . . . . 34.8 m -135.08 158.28 41.05 Favored 'Isoleucine or valine' 0 N--CA 1.499 1.98 0 O-C-N 121.31 -0.869 . . . . 0.0 110.348 -179.971 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 82.8 p -74.07 -16.77 61.02 Favored 'General case' 0 N--CA 1.491 1.582 0 CA-C-O 121.327 0.584 . . . . 0.0 109.823 -179.952 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 86' ' ' ALA . . . . . . . . . . . . . . . -63.89 -38.2 90.22 Favored 'General case' 0 N--CA 1.492 1.667 0 O-C-N 121.367 -0.833 . . . . 0.0 109.457 -179.761 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 94.4 mt-10 -68.08 -35.05 77.56 Favored 'General case' 0 N--CA 1.491 1.624 0 O-C-N 121.499 -0.75 . . . . 0.0 109.302 179.683 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 88' ' ' LYS . . . . . . . . . . . . . 49.1 tptt -61.95 -44.48 96.67 Favored 'General case' 0 C--N 1.302 -1.491 0 O-C-N 121.436 -0.79 . . . . 0.0 109.211 179.82 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 42.5 tp -62.07 -50.16 73.08 Favored 'General case' 0 C--N 1.303 -1.431 0 O-C-N 121.651 -0.655 . . . . 0.0 109.817 -179.029 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 90' ' ' ILE . . . . . . . . . . . . . 96.6 mt -66.66 -43.03 90.5 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.773 0 O-C-N 121.529 -0.732 . . . . 0.0 109.878 179.929 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 91' ' ' PHE . . . . . 0.422 ' O ' HG23 ' A' ' 95' ' ' THR . 71.1 t80 -59.35 -46.09 89.59 Favored 'General case' 0 N--CA 1.493 1.679 0 O-C-N 121.468 -0.77 . . . . 0.0 109.649 -179.186 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 92' ' ' GLU . . . . . . . . . . . . . 9.5 tm-20 -66.98 -41.18 87.22 Favored 'General case' 0 N--CA 1.49 1.536 0 CA-C-O 121.691 0.758 . . . . 0.0 109.191 179.881 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 93' ' ' LEU . . . . . 0.544 HD13 ' O ' ' A' ' 93' ' ' LEU . 0.3 OUTLIER -63.87 -47.71 79.61 Favored 'General case' 0 C--N 1.303 -1.437 0 CA-C-O 121.932 0.873 . . . . 0.0 109.651 -179.226 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 94' ' ' LYS . . . . . . . . . . . . . 54.9 mtpt -65.04 -43.52 92.05 Favored 'General case' 0 C--N 1.3 -1.567 0 O-C-N 121.411 -0.806 . . . . 0.0 109.786 -179.252 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 95' ' ' THR . . . . . 0.422 HG23 ' O ' ' A' ' 91' ' ' PHE . 40.9 p -69.06 -35.56 76.69 Favored 'General case' 0 N--CA 1.491 1.6 0 O-C-N 121.608 -0.683 . . . . 0.0 109.847 -179.867 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 96' ' ' ARG . . . . . 0.492 ' NE ' HH21 ' A' ' 100' ' ' ARG . 74.1 ttt180 -64.63 -42.9 95.16 Favored 'General case' 0 N--CA 1.491 1.587 0 O-C-N 121.487 -0.758 . . . . 0.0 109.267 179.798 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 97' ' ' ALA . . . . . . . . . . . . . . . -62.24 -40.54 96.5 Favored 'General case' 0 N--CA 1.493 1.704 0 CA-C-O 121.477 0.656 . . . . 0.0 109.482 -179.946 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 98' ' ' LEU . . . . . . . . . . . . . 93.6 mt -64.26 -40.7 96.51 Favored 'General case' 0 N--CA 1.492 1.636 0 O-C-N 121.583 -0.698 . . . . 0.0 109.449 179.745 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 99' ' ' ALA . . . . . . . . . . . . . . . -83.03 -6.4 59.48 Favored 'General case' 0 N--CA 1.49 1.528 0 N-CA-C 109.19 -0.67 . . . . 0.0 109.19 179.901 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 100' ' ' ARG . . . . . 0.492 HH21 ' NE ' ' A' ' 96' ' ' ARG . 44.5 ttm180 -85.71 -15.91 40.7 Favored 'General case' 0 N--CA 1.493 1.721 0 O-C-N 121.521 -0.737 . . . . 0.0 109.022 179.71 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 101' ' ' LEU . . . . . 0.575 HD22 ' N ' ' A' ' 101' ' ' LEU . 3.7 mm? 59.52 121.41 0.01 OUTLIER 'General case' 0 N--CA 1.493 1.705 0 CA-C-O 121.948 0.88 . . . . 0.0 110.163 -179.701 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 102' ' ' GLU . . . . . . . . . . . . . 12.2 pt-20 -60.18 133.07 55.75 Favored 'General case' 0 N--CA 1.488 1.427 0 CA-C-O 121.546 0.689 . . . . 0.0 109.979 -179.602 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 103' ' ' HIS . . . . . . . . . . . . . 52.5 t-80 -95.3 -75.44 0.52 Allowed 'General case' 0 N--CA 1.494 1.774 0 CA-C-O 121.7 0.762 . . . . 0.0 109.437 -179.97 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 104' ' ' HIS . . . . . 0.687 ' CG ' ' H ' ' A' ' 105' ' ' HIS . 43.7 t60 42.04 -152.82 0.02 OUTLIER 'General case' 0 N--CA 1.494 1.731 0 CA-C-O 121.573 0.702 . . . . 0.0 110.404 179.994 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 105' ' ' HIS . . . . . 0.687 ' H ' ' CG ' ' A' ' 104' ' ' HIS . 1.3 p80 -150.32 165.15 33.91 Favored 'General case' 0 N--CA 1.487 1.4 0 O-C-N 121.471 -0.768 . . . . 0.0 109.579 -179.583 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 106' ' ' HIS . . . . . . . . . . . . . 80.3 t60 -75.86 131.35 39.64 Favored 'General case' 0 N--CA 1.489 1.495 0 CA-C-O 121.711 0.767 . . . . 0.0 110.484 -179.252 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 107' ' ' HIS . . . . . . . . . . . . . 45.9 p-80 -150.63 162.35 40.83 Favored 'General case' 0 N--CA 1.489 1.524 0 CA-C-O 121.536 0.684 . . . . 0.0 109.874 179.652 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 108' ' ' HIS . . . . . . . . . . . . . 42.7 p-80 . . . . . 0 N--CA 1.491 1.613 0 CA-C-O 118.004 -0.998 . . . . 0.0 109.156 179.883 . . . . . . . . 0 0 . 1 . 013 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 63.8 ttp . . . . . 0 N--CA 1.493 1.698 0 CA-C-O 121.428 0.632 . . . . 0.0 109.538 . . . . . . . . . 0 0 . 1 . 013 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 79.4 p -63.79 -33.19 75.12 Favored 'General case' 0 N--CA 1.494 1.728 0 O-C-N 121.556 -0.715 . . . . 0.0 109.67 -179.907 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 3' ' ' ASN . . . . . . . . . . . . . 98.9 m-20 -64.34 -39.76 94.55 Favored 'General case' 0 N--CA 1.493 1.705 0 O-C-N 121.455 -0.778 . . . . 0.0 109.47 179.895 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 85.9 mt-30 -81.48 119.74 24.12 Favored 'General case' 0 N--CA 1.489 1.52 0 O-C-N 121.358 -0.839 . . . . 0.0 109.736 -179.74 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 71.9 p -101.8 -10.58 19.78 Favored 'General case' 0 N--CA 1.493 1.677 0 N-CA-C 108.867 -0.79 . . . . 0.0 108.867 179.624 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 1.9 t -90.98 5.71 47.68 Favored 'General case' 0 N--CA 1.498 1.945 0 O-C-N 121.451 -0.781 . . . . 0.0 109.495 179.7 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 7' ' ' VAL . . . . . . . . . . . . . 12.9 p -67.46 136.52 26.47 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.735 0 O-C-N 121.305 -0.872 . . . . 0.0 110.489 -179.222 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 19.5 pt-20 -150.86 -159.21 1.0 Allowed 'General case' 0 N--CA 1.489 1.478 0 CA-C-O 121.443 0.64 . . . . 0.0 109.421 179.683 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 97.7 m-20 -73.1 -119.64 0.0 OUTLIER 'General case' 0 N--CA 1.491 1.614 0 CA-C-O 121.889 0.852 . . . . 0.0 110.246 -179.47 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 81.5 tt0 45.71 82.42 0.03 OUTLIER 'General case' 0 N--CA 1.489 1.493 0 O-C-N 121.537 -0.727 . . . . 0.0 109.651 -179.516 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 54.9 t -118.63 132.25 69.04 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.959 0 CA-C-O 121.777 0.798 . . . . 0.0 109.987 -179.514 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 12' ' ' CYS . . . . . 0.429 ' O ' ' N ' ' A' ' 14' ' ' ALA . 69.2 m 47.84 22.47 0.36 Allowed 'General case' 0 N--CA 1.492 1.655 0 CA-C-O 121.646 0.736 . . . . 0.0 109.786 179.974 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 79.6 mm-40 53.88 -90.42 0.02 OUTLIER 'General case' 0 N--CA 1.493 1.688 0 CA-C-O 121.591 0.71 . . . . 0.0 110.17 179.498 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 14' ' ' ALA . . . . . 0.429 ' N ' ' O ' ' A' ' 12' ' ' CYS . . . 49.85 82.39 0.05 Allowed 'General case' 0 N--CA 1.494 1.751 0 CA-C-O 121.867 0.841 . . . . 0.0 109.685 -179.508 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 54.2 m -93.46 141.99 27.84 Favored 'General case' 0 N--CA 1.494 1.734 0 CA-C-O 121.789 0.804 . . . . 0.0 110.253 -179.599 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . -83.28 37.63 2.74 Favored Glycine 0 N--CA 1.492 2.379 0 N-CA-C 109.62 -1.392 . . . . 0.0 109.62 179.656 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -61.74 -37.43 84.23 Favored 'General case' 0 N--CA 1.491 1.596 0 O-C-N 121.321 -1.105 . . . . 0.0 109.194 179.761 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -63.9 140.81 58.91 Favored 'General case' 0 N--CA 1.491 1.595 0 CA-C-O 121.88 0.848 . . . . 0.0 110.291 -178.977 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 19' ' ' GLY . . . . . 0.427 ' C ' ' N ' ' A' ' 21' ' ' ILE . . . -91.24 -6.01 66.96 Favored Glycine 0 N--CA 1.493 2.442 0 N-CA-C 109.464 -1.454 . . . . 0.0 109.464 179.754 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 20' ' ' GLU . . . . . 0.452 ' O ' ' O ' ' A' ' 21' ' ' ILE . 22.0 tp10 47.66 20.65 0.21 Allowed 'General case' 0 N--CA 1.493 1.699 0 O-C-N 121.483 -1.01 . . . . 0.0 109.238 -179.785 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 21' ' ' ILE . . . . . 0.452 ' O ' ' O ' ' A' ' 20' ' ' GLU . 93.7 mt 58.31 139.8 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.492 1.669 0 CA-C-O 122.023 0.916 . . . . 0.0 110.263 179.388 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . -72.78 -174.04 25.03 Favored Glycine 0 N--CA 1.487 2.055 0 N-CA-C 110.826 -0.91 . . . . 0.0 110.826 -179.354 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 23' ' ' PHE . . . . . . . . . . . . . 91.7 m-85 -86.32 131.21 34.27 Favored 'General case' 0 N--CA 1.491 1.58 0 O-C-N 121.689 -0.889 . . . . 0.0 110.276 -179.651 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 35.8 mm -69.38 -41.71 80.92 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.695 0 CA-C-O 121.673 0.749 . . . . 0.0 109.765 179.642 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 25' ' ' ILE . . . . . 0.404 ' O ' ' O ' ' A' ' 26' ' ' ARG . 34.1 mm -61.75 -42.29 93.84 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.68 0 O-C-N 121.274 -0.891 . . . . 0.0 109.511 -179.386 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 26' ' ' ARG . . . . . 0.404 ' O ' ' O ' ' A' ' 25' ' ' ILE . 95.9 mtt-85 59.78 121.18 0.01 OUTLIER 'General case' 0 N--CA 1.494 1.742 0 CA-C-O 121.847 0.832 . . . . 0.0 109.991 -179.971 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 97.9 mt-10 -64.21 137.56 58.0 Favored 'General case' 0 N--CA 1.491 1.623 0 CA-C-O 121.685 0.755 . . . . 0.0 110.421 -179.37 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . 156.56 -62.39 0.33 Allowed Glycine 0 N--CA 1.49 2.247 0 N-CA-C 109.544 -1.422 . . . . 0.0 109.544 179.834 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 99.3 m-20 -70.62 -168.7 0.27 Allowed 'General case' 0 N--CA 1.495 1.786 0 O-C-N 121.444 -1.033 . . . . 0.0 111.284 -179.406 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 97.3 m-20 -75.74 94.31 3.25 Favored 'General case' 0 N--CA 1.488 1.472 0 CA-C-O 121.515 0.674 . . . . 0.0 109.846 -179.415 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 8.6 p -123.13 144.62 32.06 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.708 0 CA-C-O 121.354 0.597 . . . . 0.0 109.487 179.955 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -116.71 155.46 28.82 Favored 'General case' 0 N--CA 1.495 1.781 0 CA-C-O 121.473 0.654 . . . . 0.0 109.383 -179.404 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 77.7 mm-40 -108.26 136.06 48.55 Favored 'General case' 0 N--CA 1.494 1.729 0 CA-C-O 121.598 0.713 . . . . 0.0 109.61 179.858 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 34' ' ' VAL . . . . . . . . . . . . . 56.0 t -127.26 134.38 66.02 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.874 0 CA-C-O 121.592 0.711 . . . . 0.0 109.937 -179.579 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 45.8 p -136.68 122.42 19.86 Favored 'General case' 0 N--CA 1.493 1.704 0 N-CA-C 108.73 -0.841 . . . . 0.0 108.73 179.299 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 51.0 tp -117.7 143.59 46.05 Favored 'General case' 0 N--CA 1.497 1.882 0 CA-C-O 121.645 0.736 . . . . 0.0 110.109 -179.443 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 37' ' ' PHE . . . . . . . . . . . . . 82.9 m-85 -105.84 145.62 30.98 Favored 'General case' 0 N--CA 1.494 1.752 0 CA-C-O 121.657 0.741 . . . . 0.0 109.998 -179.858 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 38' ' ' GLY . . . . . 0.426 ' N ' HD21 ' A' ' 44' ' ' LEU . . . -173.55 175.28 46.27 Favored Glycine 0 N--CA 1.487 2.081 0 N-CA-C 109.77 -1.332 . . . . 0.0 109.77 -179.972 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 52.5 p -81.85 -92.28 0.06 Allowed 'General case' 0 N--CA 1.492 1.633 0 O-C-N 121.582 -0.952 . . . . 0.0 109.989 -179.819 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 40' ' ' ASP . . . . . . . . . . . . . 99.8 m-20 -82.24 168.82 17.25 Favored 'General case' 0 N--CA 1.495 1.779 0 O-C-N 121.225 -0.922 . . . . 0.0 110.631 -179.387 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 65.8 tttm -64.04 -38.82 92.46 Favored 'General case' 0 N--CA 1.497 1.908 0 O-C-N 121.652 -0.655 . . . . 0.0 110.514 -179.933 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -56.01 -39.21 71.55 Favored 'General case' 0 N--CA 1.494 1.766 0 O-C-N 121.314 -0.866 . . . . 0.0 109.935 -179.246 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 43' ' ' HIS . . . . . 0.68 ' CE1' ' HZ3' ' A' ' 47' ' ' LYS . 78.1 t60 -66.79 -45.2 79.16 Favored 'General case' 0 N--CA 1.494 1.743 0 O-C-N 121.315 -0.866 . . . . 0.0 109.861 -179.928 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 44' ' ' LEU . . . . . 0.426 HD21 ' N ' ' A' ' 38' ' ' GLY . 81.8 mt -64.69 -41.67 95.87 Favored 'General case' 0 N--CA 1.497 1.91 0 O-C-N 121.382 -0.823 . . . . 0.0 109.955 -179.69 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 71.1 mm-40 -63.91 -38.4 90.93 Favored 'General case' 0 N--CA 1.491 1.593 0 CA-C-O 121.66 0.743 . . . . 0.0 109.573 -179.81 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . -57.86 -54.81 34.45 Favored Glycine 0 N--CA 1.492 2.394 0 N-CA-C 109.823 -1.311 . . . . 0.0 109.823 -179.589 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 47' ' ' LYS . . . . . 0.68 ' HZ3' ' CE1' ' A' ' 43' ' ' HIS . 50.5 mttp -66.29 -37.8 86.27 Favored 'General case' 0 N--CA 1.494 1.755 0 O-C-N 121.497 -1.002 . . . . 0.0 109.761 179.45 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 50.5 tp -49.45 -36.17 21.71 Favored 'General case' 0 N--CA 1.492 1.632 0 O-C-N 121.497 -0.752 . . . . 0.0 109.394 -179.525 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 49' ' ' ALA . . . . . . . . . . . . . . . -55.03 -40.1 69.87 Favored 'General case' 0 N--CA 1.493 1.718 0 O-C-N 121.407 -0.808 . . . . 0.0 109.715 -179.918 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 96.8 mt-10 -67.21 -39.43 86.28 Favored 'General case' 0 N--CA 1.497 1.887 0 O-C-N 121.355 -0.84 . . . . 0.0 109.939 -179.888 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 12.4 m-85 -61.6 -47.41 85.61 Favored 'General case' 0 N--CA 1.496 1.856 0 O-C-N 121.36 -0.837 . . . . 0.0 109.918 -179.556 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 52' ' ' ILE . . . . . . . . . . . . . 96.8 mt -66.17 -43.13 92.15 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.629 0 O-C-N 121.524 -0.735 . . . . 0.0 109.884 -179.619 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 80.5 p -58.93 -43.21 91.14 Favored 'General case' 0 N--CA 1.494 1.769 0 O-C-N 121.371 -0.831 . . . . 0.0 109.498 -179.328 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 54' ' ' LEU . . . . . . . . . . . . . 79.7 mt -64.95 -39.88 94.17 Favored 'General case' 0 N--CA 1.494 1.734 0 O-C-N 121.461 -0.774 . . . . 0.0 109.366 179.358 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -58.56 -42.68 88.48 Favored 'General case' 0 N--CA 1.49 1.546 0 CA-C-O 121.535 0.683 . . . . 0.0 109.595 -179.774 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 56' ' ' LYS . . . . . . . . . . . . . 54.0 mtmt -64.9 -45.31 86.44 Favored 'General case' 0 N--CA 1.492 1.672 0 O-C-N 121.326 -0.859 . . . . 0.0 109.554 179.658 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 99.3 mm-40 -63.47 -44.13 95.33 Favored 'General case' 0 N--CA 1.494 1.736 0 O-C-N 121.589 -0.694 . . . . 0.0 109.64 -179.866 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 58' ' ' VAL . . . . . . . . . . . . . 79.4 t -65.17 -45.43 93.98 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.691 0 O-C-N 121.283 -0.885 . . . . 0.0 109.443 179.823 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 59' ' ' TYR . . . . . . . . . . . . . 82.8 t80 -140.25 120.06 13.45 Favored 'General case' 0 N--CA 1.497 1.881 0 O-C-N 121.272 -0.893 . . . . 0.0 109.589 -179.975 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -68.09 148.1 51.42 Favored 'General case' 0 N--CA 1.491 1.586 0 CA-C-O 121.819 0.818 . . . . 0.0 110.631 -179.717 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 61' ' ' ASN . . . . . . . . . . . . . 8.5 t-20 59.44 40.73 20.42 Favored 'General case' 0 N--CA 1.493 1.68 0 CA-C-O 121.689 0.757 . . . . 0.0 109.693 -179.879 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 62' ' ' VAL . . . . . . . . . . . . . 14.9 p -74.84 139.62 18.85 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.618 0 O-C-N 121.52 -0.737 . . . . 0.0 110.056 179.782 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 63' ' ' GLU . . . . . 0.548 ' OE1' ' N ' ' A' ' 63' ' ' GLU . 56.6 mp0 -109.84 137.15 48.04 Favored 'General case' 0 N--CA 1.495 1.785 0 CA-C-O 121.583 0.706 . . . . 0.0 109.474 -179.656 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 64' ' ' TYR . . . . . . . . . . . . . 53.4 p90 -148.68 163.37 37.51 Favored 'General case' 0 N--CA 1.492 1.643 0 CA-C-O 121.718 0.771 . . . . 0.0 110.252 -179.22 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 44.9 tt0 -141.96 147.81 37.59 Favored 'General case' 0 N--CA 1.494 1.762 0 N-CA-C 108.979 -0.749 . . . . 0.0 108.979 179.711 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 66' ' ' VAL . . . . . . . . . . . . . 92.1 t -120.13 130.19 74.6 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.965 0 CA-C-O 121.654 0.74 . . . . 0.0 110.204 -179.825 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 67' ' ' ALA . . . . . 0.413 ' O ' HG23 ' A' ' 69' ' ' VAL . . . -75.72 152.35 85.01 Favored Pre-proline 0 N--CA 1.485 1.319 0 N-CA-C 109.349 -0.611 . . . . 0.0 109.349 -179.888 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 68' ' ' PRO . . . . . . . . . . . . . 80.4 Cg_exo -42.44 131.39 5.09 Favored 'Trans proline' 0 C--N 1.31 -1.449 0 C-N-CA 122.637 2.224 . . . . 0.0 112.89 179.672 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 69' ' ' VAL . . . . . 0.413 HG23 ' O ' ' A' ' 67' ' ' ALA . 88.3 t -125.32 131.21 72.58 Favored 'Isoleucine or valine' 0 N--CA 1.499 1.985 0 CA-C-O 121.722 0.772 . . . . 0.0 109.978 -179.955 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -76.98 156.33 31.98 Favored 'General case' 0 C--N 1.302 -1.495 0 CA-C-O 121.619 0.723 . . . . 0.0 110.016 179.863 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 71' ' ' ASP . . . . . 0.404 ' O ' ' OD1' ' A' ' 71' ' ' ASP . 62.9 t0 -63.13 -37.77 88.55 Favored 'General case' 0 N--CA 1.493 1.692 0 O-C-N 121.542 -0.724 . . . . 0.0 109.694 179.727 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 72' ' ' ASN . . . . . . . . . . . . . 96.0 m-20 -94.23 13.05 24.62 Favored 'General case' 0 N--CA 1.496 1.846 0 O-C-N 121.226 -0.922 . . . . 0.0 109.171 -179.948 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -60.03 141.82 55.04 Favored 'General case' 0 N--CA 1.493 1.723 0 O-C-N 121.34 -0.85 . . . . 0.0 109.972 -179.696 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 74' ' ' THR . . . . . . . . . . . . . 16.4 p -104.83 0.23 27.86 Favored 'General case' 0 N--CA 1.494 1.73 0 N-CA-C 109.013 -0.736 . . . . 0.0 109.013 179.585 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 84.3 tt0 -144.46 149.84 36.65 Favored 'General case' 0 N--CA 1.494 1.772 0 O-C-N 121.143 -0.973 . . . . 0.0 109.614 179.766 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 6.3 tt -124.47 130.35 52.31 Favored 'General case' 0 N--CA 1.494 1.726 0 CA-C-O 121.325 0.583 . . . . 0.0 109.512 179.885 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 77' ' ' HIS . . . . . . . . . . . . . 96.4 m-70 -107.59 130.76 54.86 Favored 'General case' 0 N--CA 1.495 1.808 0 CA-C-O 121.655 0.74 . . . . 0.0 109.679 -179.711 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -146.15 156.82 43.69 Favored 'General case' 0 N--CA 1.49 1.561 0 O-C-N 121.6 -0.687 . . . . 0.0 109.318 -179.697 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 84.6 mtt85 -129.67 145.91 51.49 Favored 'General case' 0 N--CA 1.495 1.82 0 O-C-N 121.646 -0.659 . . . . 0.0 109.629 -179.62 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 80' ' ' PHE . . . . . . . . . . . . . 92.8 m-85 -129.64 145.92 51.47 Favored 'General case' 0 N--CA 1.495 1.816 0 O-C-N 121.637 -0.664 . . . . 0.0 109.353 -179.862 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 27.6 ttpt -117.04 121.53 41.6 Favored 'General case' 0 N--CA 1.494 1.752 0 CA-C-O 121.507 0.67 . . . . 0.0 109.721 -179.785 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 82' ' ' PHE . . . . . . . . . . . . . 68.8 m-85 -111.42 148.81 32.29 Favored 'General case' 0 N--CA 1.495 1.816 0 CA-C-O 121.637 0.732 . . . . 0.0 109.756 179.784 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 80.6 tt0 -64.16 -31.79 73.12 Favored 'General case' 0 N--CA 1.49 1.555 0 O-C-N 121.733 -0.604 . . . . 0.0 109.521 179.957 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 84' ' ' VAL . . . . . 0.425 HG23 ' H ' ' A' ' 87' ' ' GLU . 27.6 m -134.11 156.48 40.88 Favored 'Isoleucine or valine' 0 N--CA 1.5 2.044 0 O-C-N 121.359 -0.838 . . . . 0.0 110.139 -179.853 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 78.3 p -70.26 -24.02 62.99 Favored 'General case' 0 N--CA 1.492 1.64 0 CA-C-O 121.51 0.672 . . . . 0.0 109.962 179.802 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 86' ' ' ALA . . . . . . . . . . . . . . . -59.21 -46.08 89.4 Favored 'General case' 0 N--CA 1.494 1.736 0 O-C-N 121.316 -0.865 . . . . 0.0 109.663 -179.712 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 87' ' ' GLU . . . . . 0.425 ' H ' HG23 ' A' ' 84' ' ' VAL . 98.4 mt-10 -70.52 -32.43 69.9 Favored 'General case' 0 N--CA 1.495 1.799 0 CA-C-O 121.742 0.782 . . . . 0.0 109.36 179.593 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 88' ' ' LYS . . . . . . . . . . . . . 14.1 tmtt? -61.98 -47.22 85.81 Favored 'General case' 0 C--N 1.301 -1.539 0 O-C-N 121.52 -0.737 . . . . 0.0 110.081 -179.713 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 95.8 mt -64.34 -43.26 95.15 Favored 'General case' 0 N--CA 1.494 1.766 0 O-C-N 121.419 -0.801 . . . . 0.0 109.639 -179.988 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 90' ' ' ILE . . . . . . . . . . . . . 96.9 mt -65.64 -43.54 93.86 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.667 0 CA-C-O 121.569 0.7 . . . . 0.0 109.793 -179.631 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 91' ' ' PHE . . . . . . . . . . . . . 76.5 t80 -61.4 -45.48 94.14 Favored 'General case' 0 N--CA 1.493 1.717 0 O-C-N 121.573 -0.704 . . . . 0.0 110.05 -179.465 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 92' ' ' GLU . . . . . . . . . . . . . 48.2 tp10 -66.01 -45.79 80.25 Favored 'General case' 0 N--CA 1.492 1.659 0 O-C-N 121.334 -0.854 . . . . 0.0 109.595 -179.691 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 93' ' ' LEU . . . . . . . . . . . . . 82.8 mt -64.44 -43.22 94.99 Favored 'General case' 0 N--CA 1.497 1.881 0 O-C-N 121.327 -0.858 . . . . 0.0 109.934 -179.917 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 94' ' ' LYS . . . . . . . . . . . . . 38.0 ttmt -66.57 -44.41 82.32 Favored 'General case' 0 N--CA 1.494 1.75 0 O-C-N 121.356 -0.84 . . . . 0.0 109.956 -179.824 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 20.9 p -66.35 -43.74 85.22 Favored 'General case' 0 N--CA 1.494 1.747 0 O-C-N 121.407 -0.808 . . . . 0.0 109.632 -179.716 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 96' ' ' ARG . . . . . . . . . . . . . 41.6 mmm-85 -65.94 -38.92 89.9 Favored 'General case' 0 N--CA 1.493 1.693 0 O-C-N 121.485 -0.759 . . . . 0.0 109.547 179.97 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 97' ' ' ALA . . . . . . . . . . . . . . . -64.35 -37.78 88.72 Favored 'General case' 0 N--CA 1.493 1.712 0 O-C-N 121.525 -0.734 . . . . 0.0 109.581 -179.957 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 98' ' ' LEU . . . . . . . . . . . . . 6.4 tt -63.55 -42.85 98.36 Favored 'General case' 0 C--N 1.299 -1.602 0 O-C-N 121.436 -0.79 . . . . 0.0 109.612 -179.939 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 99' ' ' ALA . . . . . . . . . . . . . . . -75.03 -42.33 57.46 Favored 'General case' 0 N--CA 1.493 1.714 0 O-C-N 121.541 -0.724 . . . . 0.0 110.079 -179.81 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 100' ' ' ARG . . . . . . . . . . . . . 41.0 ttm180 -66.17 -40.91 90.86 Favored 'General case' 0 N--CA 1.497 1.9 0 O-C-N 121.456 -0.778 . . . . 0.0 110.234 -179.575 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 101' ' ' LEU . . . . . 0.458 HD12 ' NE2' ' A' ' 104' ' ' HIS . 74.8 mt 57.67 -170.21 0.11 Allowed 'General case' 0 N--CA 1.497 1.878 0 CA-C-O 121.648 0.737 . . . . 0.0 110.62 179.911 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 102' ' ' GLU . . . . . 0.42 ' O ' ' O ' ' A' ' 103' ' ' HIS . 34.4 tp10 -105.59 53.4 0.71 Allowed 'General case' 0 N--CA 1.495 1.811 0 CA-C-O 121.529 0.68 . . . . 0.0 109.269 -179.541 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 103' ' ' HIS . . . . . 0.42 ' O ' ' O ' ' A' ' 102' ' ' GLU . 99.8 m-70 57.52 118.18 0.01 OUTLIER 'General case' 0 N--CA 1.494 1.731 0 CA-C-O 121.977 0.894 . . . . 0.0 110.681 179.642 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 104' ' ' HIS . . . . . 0.458 ' NE2' HD12 ' A' ' 101' ' ' LEU . 60.7 m170 -62.31 -47.62 83.46 Favored 'General case' 0 N--CA 1.49 1.556 0 O-C-N 121.61 -0.681 . . . . 0.0 109.59 179.779 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 105' ' ' HIS . . . . . 0.424 ' C ' ' O ' ' A' ' 104' ' ' HIS . 85.5 t60 38.62 84.38 0.02 OUTLIER 'General case' 0 N--CA 1.497 1.889 0 CA-C-O 121.703 0.764 . . . . 0.0 110.207 -179.908 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 106' ' ' HIS . . . . . . . . . . . . . 62.7 t-80 -152.13 135.48 15.95 Favored 'General case' 0 N--CA 1.491 1.593 0 O-C-N 121.346 -0.846 . . . . 0.0 109.786 -179.855 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 107' ' ' HIS . . . . . . . . . . . . . 56.8 p-80 -154.69 -7.98 0.14 Allowed 'General case' 0 N--CA 1.49 1.566 0 N-CA-C 109.015 -0.735 . . . . 0.0 109.015 179.698 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 108' ' ' HIS . . . . . . . . . . . . . 86.3 t60 . . . . . 0 N--CA 1.497 1.917 0 CA-C-O 117.942 -1.028 . . . . 0.0 109.538 179.805 . . . . . . . . 0 0 . 1 . 014 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 97.2 mmm . . . . . 0 N--CA 1.491 1.607 0 N-CA-C 109.011 -0.737 . . . . 0.0 109.011 . . . . . . . . . 0 0 . 1 . 014 nuclear build full ' A' A ' 2' ' ' SER . . . . . 0.41 ' O ' ' CG ' ' A' ' 3' ' ' ASN . 23.2 t -156.24 39.1 0.35 Allowed 'General case' 0 N--CA 1.49 1.56 0 O-C-N 121.367 -0.833 . . . . 0.0 108.817 179.815 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 3' ' ' ASN . . . . . 0.41 ' CG ' ' O ' ' A' ' 2' ' ' SER . 16.3 p30 42.07 42.48 2.41 Favored 'General case' 0 N--CA 1.497 1.902 0 CA-C-O 121.436 0.636 . . . . 0.0 109.798 -179.695 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 4' ' ' GLN . . . . . 0.415 ' O ' ' O ' ' A' ' 5' ' ' THR . 78.2 mt-30 -60.11 -117.1 0.0 OUTLIER 'General case' 0 N--CA 1.495 1.785 0 O-C-N 121.44 -0.787 . . . . 0.0 110.034 -179.783 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 5' ' ' THR . . . . . 0.415 ' O ' ' O ' ' A' ' 4' ' ' GLN . 64.6 p 40.53 -163.58 0.0 OUTLIER 'General case' 0 N--CA 1.498 1.927 0 CA-C-O 121.589 0.709 . . . . 0.0 110.975 -179.946 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 48.4 t -79.27 136.56 37.08 Favored 'General case' 0 N--CA 1.492 1.667 0 CA-C-O 121.443 0.639 . . . . 0.0 109.861 -179.39 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 7' ' ' VAL . . . . . . . . . . . . . 26.9 m -79.32 133.33 30.12 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.697 0 O-C-N 121.218 -0.926 . . . . 0.0 109.689 -179.916 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 80.8 tt0 -66.78 128.65 37.11 Favored 'General case' 0 N--CA 1.492 1.633 0 O-C-N 121.238 -0.914 . . . . 0.0 109.529 -179.822 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 38.0 p-10 -93.03 119.55 32.4 Favored 'General case' 0 N--CA 1.494 1.767 0 O-C-N 121.225 -0.922 . . . . 0.0 109.965 -179.892 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 83.8 tt0 -98.2 -21.49 16.68 Favored 'General case' 0 N--CA 1.496 1.849 0 O-C-N 121.294 -0.879 . . . . 0.0 108.975 179.426 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 23.5 m -112.19 129.46 67.65 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.97 0 O-C-N 121.657 -0.652 . . . . 0.0 109.441 -179.963 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 39.4 m -145.07 104.45 3.97 Favored 'General case' 0 N--CA 1.494 1.762 0 O-C-N 121.29 -0.881 . . . . 0.0 109.126 179.978 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 97.5 mt-10 -82.7 -2.55 54.47 Favored 'General case' 0 N--CA 1.49 1.555 0 O-C-N 121.282 -0.886 . . . . 0.0 109.016 179.94 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . 56.31 38.62 29.92 Favored 'General case' 0 N--CA 1.49 1.567 0 O-C-N 121.578 -0.701 . . . . 0.0 109.223 -179.948 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 7.2 t -84.78 132.09 34.47 Favored 'General case' 0 N--CA 1.493 1.719 0 O-C-N 121.474 -0.766 . . . . 0.0 109.72 -179.828 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . -178.53 -105.6 0.19 Allowed Glycine 0 N--CA 1.495 2.62 0 N-CA-C 109.234 -1.546 . . . . 0.0 109.234 179.646 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 7.6 t 51.05 -176.24 0.02 OUTLIER 'General case' 0 N--CA 1.498 1.93 0 O-C-N 121.319 -1.106 . . . . 0.0 110.872 179.215 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . 44.2 59.79 3.07 Favored 'General case' 0 N--CA 1.495 1.786 0 O-C-N 121.562 -0.711 . . . . 0.0 109.315 -179.689 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -66.41 147.33 49.79 Favored Glycine 0 N--CA 1.493 2.449 0 N-CA-C 109.713 -1.355 . . . . 0.0 109.713 -179.644 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 49.8 tp10 -67.02 141.57 57.52 Favored 'General case' 0 N--CA 1.494 1.729 0 O-C-N 121.395 -1.062 . . . . 0.0 110.027 -179.657 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 21' ' ' ILE . . . . . . . . . . . . . 96.8 mt -64.12 -43.94 97.53 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.611 0 O-C-N 121.489 -0.757 . . . . 0.0 109.668 179.487 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . -88.17 99.28 2.5 Favored Glycine 0 N--CA 1.495 2.624 0 N-CA-C 110.178 -1.169 . . . . 0.0 110.178 -179.322 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 23' ' ' PHE . . . . . . . . . . . . . 91.2 t80 -173.56 -38.3 0.01 OUTLIER 'General case' 0 N--CA 1.492 1.659 0 O-C-N 121.324 -1.103 . . . . 0.0 108.838 179.246 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 24' ' ' ILE . . . . . 0.513 ' O ' ' N ' ' A' ' 26' ' ' ARG . 20.5 tt -69.37 -37.93 76.37 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.494 0 O-C-N 121.566 -0.709 . . . . 0.0 109.478 179.574 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 25' ' ' ILE . . . . . 0.641 HG22 ' O ' ' A' ' 25' ' ' ILE . 93.5 mt 49.09 11.0 0.04 OUTLIER 'Isoleucine or valine' 0 N--CA 1.495 1.794 0 O-C-N 121.286 -0.884 . . . . 0.0 109.153 -179.331 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 26' ' ' ARG . . . . . 0.513 ' N ' ' O ' ' A' ' 24' ' ' ILE . 99.7 mtt180 50.87 23.72 1.53 Allowed 'General case' 0 N--CA 1.492 1.664 0 O-C-N 121.216 -0.927 . . . . 0.0 109.872 179.455 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 96.8 mt-10 53.71 73.36 0.38 Allowed 'General case' 0 N--CA 1.496 1.834 0 O-C-N 121.466 -0.771 . . . . 0.0 109.776 179.586 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . -55.26 178.43 0.37 Allowed Glycine 0 N--CA 1.494 2.561 0 N-CA-C 110.46 -1.056 . . . . 0.0 110.46 -179.724 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 29' ' ' ASP . . . . . 0.443 ' O ' ' O ' ' A' ' 30' ' ' ASP . 93.5 m-20 -66.48 118.51 10.21 Favored 'General case' 0 N--CA 1.494 1.745 0 O-C-N 121.509 -0.994 . . . . 0.0 110.518 -179.337 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 30' ' ' ASP . . . . . 0.443 ' O ' ' O ' ' A' ' 29' ' ' ASP . 98.1 m-20 51.17 104.29 0.01 OUTLIER 'General case' 0 N--CA 1.493 1.683 0 CA-C-O 121.56 0.695 . . . . 0.0 110.262 179.468 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 31' ' ' VAL . . . . . 0.412 HG11 HH21 ' A' ' 79' ' ' ARG . 9.8 p -128.23 139.24 52.43 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.904 0 N-CA-C 108.717 -0.846 . . . . 0.0 108.717 179.544 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -114.93 153.6 30.26 Favored 'General case' 0 N--CA 1.498 1.958 0 O-C-N 121.633 -0.667 . . . . 0.0 109.353 -179.515 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 33' ' ' GLU . . . . . 0.547 ' N ' ' OE1' ' A' ' 33' ' ' GLU . 55.7 mp0 -103.13 145.56 29.73 Favored 'General case' 0 N--CA 1.495 1.777 0 O-C-N 121.619 -0.676 . . . . 0.0 109.381 -179.438 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 34' ' ' VAL . . . . . . . . . . . . . 46.3 t -126.14 133.75 68.11 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.936 0 N-CA-C 108.85 -0.796 . . . . 0.0 108.85 179.879 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 40.8 t -129.88 131.56 46.1 Favored 'General case' 0 N--CA 1.495 1.806 0 N-CA-C 108.86 -0.793 . . . . 0.0 108.86 179.756 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 44.5 tp -126.01 131.38 52.22 Favored 'General case' 0 N--CA 1.499 2.014 0 O-C-N 121.418 -0.801 . . . . 0.0 108.967 179.717 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 37' ' ' PHE . . . . . . . . . . . . . 93.7 m-85 -115.74 144.99 43.19 Favored 'General case' 0 N--CA 1.497 1.911 0 N-CA-C 109.294 -0.632 . . . . 0.0 109.294 -179.614 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . -174.07 176.94 46.49 Favored Glycine 0 N--CA 1.491 2.301 0 N-CA-C 109.585 -1.406 . . . . 0.0 109.585 179.907 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 34.6 p -61.36 -98.98 0.0 OUTLIER 'General case' 0 C--N 1.301 -1.528 0 O-C-N 121.267 -1.137 . . . . 0.0 110.776 -179.268 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 40' ' ' ASP . . . . . 0.418 ' OD1' ' N ' ' A' ' 41' ' ' LYS . 51.4 t0 -76.84 153.43 34.83 Favored 'General case' 0 N--CA 1.494 1.727 0 CA-C-O 121.71 0.766 . . . . 0.0 110.938 -178.67 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 41' ' ' LYS . . . . . 0.418 ' N ' ' OD1' ' A' ' 40' ' ' ASP . 65.5 tttm -64.97 -35.64 81.84 Favored 'General case' 0 N--CA 1.491 1.597 0 O-C-N 121.614 -0.679 . . . . 0.0 109.978 -179.974 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -55.94 -39.53 71.83 Favored 'General case' 0 N--CA 1.492 1.659 0 O-C-N 121.276 -0.89 . . . . 0.0 109.496 -179.382 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 43' ' ' HIS . . . . . . . . . . . . . 11.7 t-160 -62.97 -38.56 91.6 Favored 'General case' 0 N--CA 1.489 1.494 0 O-C-N 121.307 -0.871 . . . . 0.0 109.127 179.865 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 46.2 mt -61.3 -40.71 95.18 Favored 'General case' 0 N--CA 1.489 1.497 0 O-C-N 121.23 -0.919 . . . . 0.0 109.299 -179.724 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 97.7 mt-10 -62.76 -36.35 82.78 Favored 'General case' 0 N--CA 1.491 1.579 0 O-C-N 121.344 -0.848 . . . . 0.0 109.306 -179.939 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . -60.86 -41.62 99.29 Favored Glycine 0 N--CA 1.492 2.402 0 N-CA-C 109.501 -1.44 . . . . 0.0 109.501 -179.902 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 97.5 mttt -77.37 -25.13 50.65 Favored 'General case' 0 N--CA 1.493 1.702 0 O-C-N 121.118 -1.225 . . . . 0.0 109.687 179.776 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 57.8 tp -61.66 -39.2 90.54 Favored 'General case' 0 N--CA 1.49 1.554 0 O-C-N 121.432 -0.793 . . . . 0.0 109.44 179.975 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 49' ' ' ALA . . . . . . . . . . . . . . . -53.66 -42.2 67.61 Favored 'General case' 0 N--CA 1.491 1.621 0 O-C-N 121.3 -0.875 . . . . 0.0 109.948 -179.315 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 50' ' ' GLU . . . . . 0.476 ' OE1' ' N ' ' A' ' 50' ' ' GLU . 58.2 mp0 -69.96 -42.35 73.31 Favored 'General case' 0 N--CA 1.494 1.742 0 O-C-N 121.236 -0.915 . . . . 0.0 109.84 -179.679 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 51' ' ' TYR . . . . . 0.461 ' CZ ' ' CG2' ' A' ' 95' ' ' THR . 4.3 m-85 -50.85 -49.11 59.63 Favored 'General case' 0 N--CA 1.489 1.516 0 O-C-N 121.138 -0.976 . . . . 0.0 108.779 -179.193 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 52' ' ' ILE . . . . . 0.47 HD13 ' OH ' ' A' ' 64' ' ' TYR . 93.6 mt -65.52 -43.57 94.26 Favored 'Isoleucine or valine' 0 C--N 1.297 -1.675 0 O-C-N 121.57 -0.706 . . . . 0.0 110.066 179.878 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 48.0 t -58.2 -49.51 76.78 Favored 'General case' 0 N--CA 1.493 1.696 0 O-C-N 121.132 -0.98 . . . . 0.0 110.503 -178.583 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 54' ' ' LEU . . . . . 0.654 HD12 ' NZ ' ' A' ' 94' ' ' LYS . 4.3 mm? -64.35 -41.25 96.84 Favored 'General case' 0 N--CA 1.491 1.622 0 O-C-N 121.099 -1.001 . . . . 0.0 109.105 179.554 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -62.78 -36.35 82.82 Favored 'General case' 0 N--CA 1.49 1.527 0 O-C-N 121.382 -0.823 . . . . 0.0 109.531 -179.831 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 56' ' ' LYS . . . . . . . . . . . . . 30.3 mmtm -62.27 -45.56 92.74 Favored 'General case' 0 N--CA 1.492 1.649 0 O-C-N 121.385 -0.822 . . . . 0.0 109.934 -179.963 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 58.5 tt0 -68.87 -41.78 77.92 Favored 'General case' 0 N--CA 1.49 1.554 0 O-C-N 121.242 -0.911 . . . . 0.0 109.625 -179.86 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 58' ' ' VAL . . . . . 0.478 ' CG1' ' OE1' ' A' ' 87' ' ' GLU . 66.8 t -64.09 -45.71 95.77 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.455 0 O-C-N 121.308 -0.87 . . . . 0.0 109.607 179.883 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 59' ' ' TYR . . . . . 0.44 ' O ' ' O ' ' A' ' 60' ' ' ALA . 62.9 t80 -126.89 136.22 52.02 Favored 'General case' 0 N--CA 1.5 2.032 0 O-C-N 121.494 -0.754 . . . . 0.0 109.586 -179.46 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 60' ' ' ALA . . . . . 0.44 ' O ' ' O ' ' A' ' 59' ' ' TYR . . . -48.25 -102.99 0.0 OUTLIER 'General case' 0 N--CA 1.494 1.741 0 O-C-N 121.693 -0.63 . . . . 0.0 110.867 -179.286 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 61' ' ' ASN . . . . . . . . . . . . . 83.2 m-20 -85.51 86.9 7.34 Favored 'General case' 0 N--CA 1.492 1.637 0 O-C-N 121.266 -0.896 . . . . 0.0 109.439 -179.119 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 62' ' ' VAL . . . . . . . . . . . . . 14.7 p -81.72 136.74 22.44 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.585 0 O-C-N 121.333 -0.855 . . . . 0.0 109.687 -179.927 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 96.8 mt-10 -108.45 137.09 46.99 Favored 'General case' 0 N--CA 1.5 2.05 0 O-C-N 121.407 -0.808 . . . . 0.0 108.95 179.842 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 64' ' ' TYR . . . . . 0.47 ' OH ' HD13 ' A' ' 52' ' ' ILE . 48.6 p90 -152.56 164.11 38.27 Favored 'General case' 0 N--CA 1.49 1.565 0 O-C-N 121.226 -0.921 . . . . 0.0 109.511 -179.615 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 79.7 mm-40 -138.81 154.34 48.46 Favored 'General case' 0 N--CA 1.497 1.895 0 N-CA-C 108.756 -0.831 . . . . 0.0 108.756 179.793 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 66' ' ' VAL . . . . . . . . . . . . . 2.7 p -125.75 129.07 72.61 Favored 'Isoleucine or valine' 0 N--CA 1.499 1.989 0 N-CA-C 109.088 -0.708 . . . . 0.0 109.088 -179.735 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -88.03 119.32 70.38 Favored Pre-proline 0 N--CA 1.494 1.76 0 O-C-N 121.378 -0.826 . . . . 0.0 109.014 -179.972 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 68' ' ' PRO . . . . . . . . . . . . . 84.8 Cg_exo -47.74 136.91 21.66 Favored 'Trans proline' 0 N--CA 1.499 1.847 0 C-N-CA 121.824 1.683 . . . . 0.0 112.916 179.687 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 69' ' ' VAL . . . . . . . . . . . . . 3.1 t -133.08 162.19 40.37 Favored 'Isoleucine or valine' 0 N--CA 1.503 2.182 0 O-C-N 121.601 -0.687 . . . . 0.0 109.935 -179.847 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 70' ' ' ALA . . . . . 0.821 ' HB3' ' HB2' ' A' ' 73' ' ' ALA . . . -62.22 145.68 52.9 Favored 'General case' 0 N--CA 1.496 1.844 0 O-C-N 121.378 -0.826 . . . . 0.0 110.087 -179.734 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 90.3 m-20 -70.01 -29.96 67.15 Favored 'General case' 0 N--CA 1.491 1.591 0 O-C-N 121.429 -0.795 . . . . 0.0 109.68 179.502 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 72' ' ' ASN . . . . . . . . . . . . . 98.6 m-20 -94.21 6.07 49.79 Favored 'General case' 0 N--CA 1.491 1.614 0 O-C-N 121.596 -0.69 . . . . 0.0 109.188 -179.882 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 73' ' ' ALA . . . . . 0.821 ' HB2' ' HB3' ' A' ' 70' ' ' ALA . . . -87.92 155.08 20.03 Favored 'General case' 0 N--CA 1.491 1.614 0 N-CA-C 108.644 -0.873 . . . . 0.0 108.644 179.583 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 74' ' ' THR . . . . . 0.634 ' O ' ' OG1' ' A' ' 74' ' ' THR . 0.0 OUTLIER -77.82 16.97 0.61 Allowed 'General case' 0 C--N 1.293 -1.881 0 CA-C-O 117.574 -1.203 . . . . 0.0 112.801 -179.808 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -158.81 165.85 33.29 Favored 'General case' 0 N--CA 1.523 3.179 0 C-N-CA 113.187 -3.405 . . . . 0.0 119.864 -175.045 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 76' ' ' LEU . . . . . 0.489 ' C ' HD23 ' A' ' 76' ' ' LEU . 7.5 tt -139.03 131.7 28.94 Favored 'General case' 0 C--N 1.297 -1.68 0 CA-C-N 109.348 -3.569 . . . . 0.0 104.952 -178.802 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 77' ' ' HIS . . . . . 0.488 ' N ' HD23 ' A' ' 76' ' ' LEU . 82.9 t60 -133.76 135.09 43.69 Favored 'General case' 0 N--CA 1.506 2.332 0 O-C-N 120.476 -1.39 . . . . 0.0 107.411 179.54 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -141.19 167.65 21.67 Favored 'General case' 0 N--CA 1.496 1.845 0 O-C-N 121.223 -0.923 . . . . 0.0 109.558 -178.989 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 79' ' ' ARG . . . . . 0.412 HH21 HG11 ' A' ' 31' ' ' VAL . 84.3 mtp180 -123.31 148.79 45.61 Favored 'General case' 0 N--CA 1.498 1.949 0 N-CA-C 108.625 -0.879 . . . . 0.0 108.625 179.827 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 80' ' ' PHE . . . . . . . . . . . . . 62.6 m-85 -130.06 150.27 51.4 Favored 'General case' 0 N--CA 1.5 2.042 0 N-CA-C 109.131 -0.692 . . . . 0.0 109.131 -179.565 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 35.6 ttpt -106.83 119.51 39.54 Favored 'General case' 0 N--CA 1.496 1.848 0 O-C-N 121.429 -0.794 . . . . 0.0 109.319 -179.975 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 82' ' ' PHE . . . . . . . . . . . . . 56.2 m-85 -128.65 153.23 47.5 Favored 'General case' 0 N--CA 1.501 2.078 0 O-C-N 121.606 -0.684 . . . . 0.0 109.299 -179.982 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 83' ' ' GLU . . . . . 0.431 ' O ' ' OD2' ' A' ' 30' ' ' ASP . 27.2 mm-40 -64.84 -41.96 95.3 Favored 'General case' 0 C--N 1.299 -1.594 0 O-C-N 121.51 -0.744 . . . . 0.0 109.854 -179.13 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 84' ' ' VAL . . . . . . . . . . . . . 2.9 m -136.34 160.78 37.91 Favored 'Isoleucine or valine' 0 N--CA 1.501 2.082 0 O-C-N 121.354 -0.841 . . . . 0.0 110.424 -179.145 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 85' ' ' SER . . . . . 0.522 ' O ' ' N ' ' A' ' 88' ' ' LYS . 11.6 t -63.75 -41.06 98.08 Favored 'General case' 0 N--CA 1.491 1.6 0 O-C-N 121.597 -0.689 . . . . 0.0 110.24 179.553 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 86' ' ' ALA . . . . . . . . . . . . . . . -40.75 -36.19 0.58 Allowed 'General case' 0 N--CA 1.5 2.04 0 O-C-N 121.621 -0.675 . . . . 0.0 110.02 -179.005 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 87' ' ' GLU . . . . . 0.478 ' OE1' ' CG1' ' A' ' 58' ' ' VAL . 70.3 mm-40 -65.71 -37.7 87.15 Favored 'General case' 0 C--N 1.301 -1.5 0 O-C-N 121.353 -0.842 . . . . 0.0 109.077 179.249 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 88' ' ' LYS . . . . . 0.522 ' N ' ' O ' ' A' ' 85' ' ' SER . 28.2 tptp -63.65 -46.38 85.92 Favored 'General case' 0 C--N 1.303 -1.428 0 O-C-N 121.26 -0.9 . . . . 0.0 109.398 179.875 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 89' ' ' LEU . . . . . 0.537 HD12 ' N ' ' A' ' 89' ' ' LEU . 10.8 mp -61.56 -46.95 87.72 Favored 'General case' 0 C--N 1.302 -1.48 0 O-C-N 121.319 -0.863 . . . . 0.0 109.465 -179.301 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 90' ' ' ILE . . . . . . . . . . . . . 96.8 mt -68.18 -44.2 84.37 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.522 0 O-C-N 121.212 -0.93 . . . . 0.0 109.668 179.81 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 91' ' ' PHE . . . . . . . . . . . . . 88.8 t80 -61.39 -46.48 90.01 Favored 'General case' 0 N--CA 1.491 1.599 0 O-C-N 121.395 -0.815 . . . . 0.0 109.54 -179.722 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 92' ' ' GLU . . . . . . . . . . . . . 84.0 tt0 -66.11 -40.02 90.4 Favored 'General case' 0 C--N 1.303 -1.441 0 O-C-N 121.272 -0.893 . . . . 0.0 109.151 179.98 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 93' ' ' LEU . . . . . . . . . . . . . 8.2 tp -62.93 -48.71 77.76 Favored 'General case' 0 N--CA 1.488 1.471 0 O-C-N 121.397 -0.814 . . . . 0.0 109.343 -179.701 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 94' ' ' LYS . . . . . 0.654 ' NZ ' HD12 ' A' ' 54' ' ' LEU . 17.3 ttpp -70.17 -45.36 66.87 Favored 'General case' 0 N--CA 1.491 1.609 0 O-C-N 121.475 -0.766 . . . . 0.0 109.827 179.74 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 95' ' ' THR . . . . . 0.461 ' CG2' ' CZ ' ' A' ' 51' ' ' TYR . 92.2 m -62.11 -44.26 97.04 Favored 'General case' 0 C--N 1.301 -1.523 0 O-C-N 121.558 -0.714 . . . . 0.0 109.419 -179.825 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 96' ' ' ARG . . . . . . . . . . . . . 71.1 ttp85 -57.99 -42.44 85.13 Favored 'General case' 0 N--CA 1.489 1.497 0 O-C-N 121.389 -0.819 . . . . 0.0 109.161 179.803 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 97' ' ' ALA . . . . . 0.469 ' O ' ' N ' ' A' ' 101' ' ' LEU . . . -56.39 -46.29 80.18 Favored 'General case' 0 C--N 1.301 -1.507 0 O-C-N 121.379 -0.826 . . . . 0.0 108.86 179.733 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 98' ' ' LEU . . . . . . . . . . . . . 97.8 mt -63.97 -40.18 95.82 Favored 'General case' 0 N--CA 1.489 1.5 0 O-C-N 121.487 -0.758 . . . . 0.0 109.187 179.518 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 99' ' ' ALA . . . . . . . . . . . . . . . -56.0 -49.73 72.83 Favored 'General case' 0 N--CA 1.491 1.584 0 O-C-N 121.517 -0.739 . . . . 0.0 109.777 -179.452 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 100' ' ' ARG . . . . . . . . . . . . . 25.2 mmt85 -92.36 -59.84 1.98 Allowed 'General case' 0 N--CA 1.494 1.745 0 O-C-N 121.281 -0.887 . . . . 0.0 109.478 -179.887 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 101' ' ' LEU . . . . . 0.469 ' N ' ' O ' ' A' ' 97' ' ' ALA . 54.9 tp -176.98 144.55 0.45 Allowed 'General case' 0 N--CA 1.493 1.72 0 O-C-N 121.575 -0.703 . . . . 0.0 109.49 179.882 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 102' ' ' GLU . . . . . 0.413 ' O ' ' O ' ' A' ' 103' ' ' HIS . 37.9 tp10 -82.46 -115.47 0.02 OUTLIER 'General case' 0 N--CA 1.491 1.594 0 O-C-N 121.409 -0.807 . . . . 0.0 109.44 -179.971 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 103' ' ' HIS . . . . . 0.413 ' O ' ' O ' ' A' ' 102' ' ' GLU . 99.2 m-70 41.16 -163.47 0.01 OUTLIER 'General case' 0 N--CA 1.498 1.94 0 O-C-N 121.447 -0.783 . . . . 0.0 110.636 -179.894 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 104' ' ' HIS . . . . . . . . . . . . . 98.9 m-70 -95.58 138.1 33.72 Favored 'General case' 0 N--CA 1.494 1.758 0 O-C-N 121.425 -0.797 . . . . 0.0 109.625 -179.378 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 105' ' ' HIS . . . . . . . . . . . . . 6.0 p80 -85.85 122.6 30.14 Favored 'General case' 0 N--CA 1.492 1.649 0 O-C-N 121.287 -0.883 . . . . 0.0 109.25 -179.68 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 106' ' ' HIS . . . . . . . . . . . . . 29.5 t-80 -125.55 119.37 27.98 Favored 'General case' 0 N--CA 1.501 2.118 0 O-C-N 121.396 -0.815 . . . . 0.0 109.281 179.923 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 107' ' ' HIS . . . . . 0.529 ' O ' ' CG ' ' A' ' 108' ' ' HIS . 74.8 t60 -150.53 142.79 24.21 Favored 'General case' 0 N--CA 1.494 1.76 0 O-C-N 121.02 -1.05 . . . . 0.0 109.342 179.908 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 108' ' ' HIS . . . . . 0.529 ' CG ' ' O ' ' A' ' 107' ' ' HIS . 75.4 m80 . . . . . 0 N--CA 1.49 1.557 0 CA-C-O 118.095 -0.955 . . . . 0.0 109.299 179.79 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 97.0 mmm . . . . . 0 N--CA 1.489 1.495 0 CA-C-O 121.614 0.721 . . . . 0.0 109.432 . . . . . . . . . 0 0 . 1 . 015 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 20.0 m -76.93 -17.15 59.1 Favored 'General case' 0 N--CA 1.489 1.509 0 O-C-N 121.498 -0.751 . . . . 0.0 109.289 -179.641 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 3' ' ' ASN . . . . . . . . . . . . . 93.1 m-20 -63.51 -40.55 97.35 Favored 'General case' 0 N--CA 1.49 1.543 0 O-C-N 121.432 -0.793 . . . . 0.0 109.481 179.906 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 99.4 mm-40 -51.32 -85.11 0.0 OUTLIER 'General case' 0 N--CA 1.489 1.499 0 O-C-N 121.476 -0.765 . . . . 0.0 109.99 -179.471 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 60.4 m 44.28 80.28 0.04 OUTLIER 'General case' 0 N--CA 1.491 1.585 0 O-C-N 121.513 -0.742 . . . . 0.0 109.626 -179.407 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 98.9 m -137.66 148.98 46.19 Favored 'General case' 0 N--CA 1.494 1.73 0 O-C-N 121.535 -0.728 . . . . 0.0 109.706 -179.868 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 7' ' ' VAL . . . . . . . . . . . . . 98.1 t -97.65 134.17 36.76 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.722 0 O-C-N 121.332 -0.855 . . . . 0.0 110.078 -179.325 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 82.1 tt0 -56.37 140.74 44.42 Favored 'General case' 0 N--CA 1.49 1.529 0 CA-C-O 121.757 0.789 . . . . 0.0 110.669 -179.433 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 9' ' ' ASN . . . . . 0.573 ' O ' ' N ' ' A' ' 11' ' ' VAL . 95.2 m-20 43.79 -117.53 0.52 Allowed 'General case' 0 N--CA 1.492 1.664 0 O-C-N 121.677 -0.64 . . . . 0.0 110.361 179.493 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 10' ' ' GLU . . . . . 0.482 ' HG3' ' H ' ' A' ' 12' ' ' CYS . 33.1 tp10 59.58 -73.03 0.03 OUTLIER 'General case' 0 N--CA 1.492 1.635 0 CA-C-O 121.324 0.583 . . . . 0.0 109.491 -179.603 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 11' ' ' VAL . . . . . 0.573 ' N ' ' O ' ' A' ' 9' ' ' ASN . 2.0 t 52.11 9.47 0.04 OUTLIER 'Isoleucine or valine' 0 N--CA 1.49 1.565 0 O-C-N 121.605 -0.684 . . . . 0.0 109.182 -179.226 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 12' ' ' CYS . . . . . 0.482 ' H ' ' HG3' ' A' ' 10' ' ' GLU . 50.5 t 39.32 91.46 0.01 OUTLIER 'General case' 0 N--CA 1.493 1.715 0 CA-C-O 121.715 0.769 . . . . 0.0 110.495 -179.908 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 79.1 mm-40 55.11 79.56 0.15 Allowed 'General case' 0 N--CA 1.491 1.61 0 CA-C-O 121.658 0.742 . . . . 0.0 109.677 -179.873 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -66.91 138.66 57.46 Favored 'General case' 0 N--CA 1.489 1.487 0 CA-C-O 121.552 0.691 . . . . 0.0 110.25 -179.47 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 15' ' ' CYS . . . . . 0.456 ' O ' ' N ' ' A' ' 17' ' ' CYS . 10.5 t -145.0 135.83 24.63 Favored 'General case' 0 N--CA 1.49 1.536 0 O-C-N 121.414 -0.804 . . . . 0.0 109.483 179.389 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 48.18 -94.33 0.01 OUTLIER Glycine 0 N--CA 1.49 2.246 0 N-CA-C 110.18 -1.168 . . . . 0.0 110.18 179.329 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 17' ' ' CYS . . . . . 0.456 ' N ' ' O ' ' A' ' 15' ' ' CYS . 8.9 t 63.9 122.21 0.02 OUTLIER 'General case' 0 N--CA 1.49 1.544 0 O-C-N 121.732 -0.863 . . . . 0.0 110.315 -179.534 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -82.44 -5.75 58.87 Favored 'General case' 0 N--CA 1.488 1.468 0 N-CA-C 108.99 -0.744 . . . . 0.0 108.99 179.728 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 90.44 174.73 44.74 Favored Glycine 0 N--CA 1.492 2.408 0 N-CA-C 110.707 -0.957 . . . . 0.0 110.707 179.033 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 80.1 mm-40 -54.54 -79.94 0.02 OUTLIER 'General case' 0 N--CA 1.49 1.534 0 O-C-N 121.73 -0.865 . . . . 0.0 110.083 -179.794 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 21' ' ' ILE . . . . . . . . . . . . . 87.3 mt -102.98 129.28 54.94 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.81 0 O-C-N 121.488 -0.757 . . . . 0.0 110.433 -178.914 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . -80.89 96.7 1.71 Allowed Glycine 0 N--CA 1.487 2.09 0 N-CA-C 109.837 -1.305 . . . . 0.0 109.837 -179.986 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 23' ' ' PHE . . . . . . . . . . . . . 86.9 t80 -101.73 -3.5 28.05 Favored 'General case' 0 N--CA 1.492 1.657 0 O-C-N 121.544 -0.974 . . . . 0.0 108.42 179.227 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 40.7 pt -81.31 -15.71 12.4 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.523 0 N-CA-C 109.103 -0.703 . . . . 0.0 109.103 179.86 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 25' ' ' ILE . . . . . . . . . . . . . 96.1 mt -61.66 88.52 0.04 OUTLIER 'Isoleucine or valine' 0 C--N 1.303 -1.423 0 C-N-CA 119.943 -0.703 . . . . 0.0 110.064 -178.526 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 61.3 ttp180 -111.11 -95.1 0.43 Allowed 'General case' 0 N--CA 1.49 1.536 0 O-C-N 121.678 -0.639 . . . . 0.0 109.39 179.678 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 27' ' ' GLU . . . . . 0.425 ' H ' ' HG3' ' A' ' 27' ' ' GLU . 3.1 pp20? -89.85 148.36 23.23 Favored 'General case' 0 N--CA 1.488 1.458 0 O-C-N 121.481 -0.762 . . . . 0.0 110.563 -179.041 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . 168.33 144.59 4.24 Favored Glycine 0 N--CA 1.486 1.971 0 N-CA-C 109.985 -1.246 . . . . 0.0 109.985 179.198 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 90.5 m-20 -68.99 -17.2 63.89 Favored 'General case' 0 N--CA 1.489 1.493 0 O-C-N 121.554 -0.968 . . . . 0.0 108.998 179.444 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 30' ' ' ASP . . . . . 0.533 ' OD2' ' NZ ' ' A' ' 81' ' ' LYS . 25.9 p-10 -93.75 11.67 28.32 Favored 'General case' 0 N--CA 1.492 1.658 0 O-C-N 121.584 -0.698 . . . . 0.0 109.373 -179.853 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 53.1 t -116.7 135.28 57.54 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.845 0 CA-C-O 121.499 0.666 . . . . 0.0 109.647 -179.381 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -109.01 156.21 20.01 Favored 'General case' 0 N--CA 1.492 1.637 0 N-CA-C 109.191 -0.67 . . . . 0.0 109.191 179.92 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 99.4 mt-10 -107.1 128.15 54.13 Favored 'General case' 0 N--CA 1.496 1.825 0 O-C-N 121.551 -0.718 . . . . 0.0 110.113 -179.111 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 34' ' ' VAL . . . . . . . . . . . . . 53.2 t -123.45 135.17 64.17 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.693 0 O-C-N 121.618 -0.677 . . . . 0.0 109.343 -179.864 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 28.1 p -132.33 142.35 49.31 Favored 'General case' 0 N--CA 1.495 1.781 0 O-C-N 121.518 -0.739 . . . . 0.0 109.273 179.608 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 36' ' ' LEU . . . . . 0.457 HD21 ' CE2' ' A' ' 51' ' ' TYR . 85.6 mt -125.43 148.9 48.63 Favored 'General case' 0 N--CA 1.496 1.854 0 O-C-N 121.651 -0.656 . . . . 0.0 109.283 179.854 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 37' ' ' PHE . . . . . . . . . . . . . 91.9 m-85 -127.07 144.94 50.9 Favored 'General case' 0 N--CA 1.493 1.686 0 O-C-N 121.757 -0.59 . . . . 0.0 109.588 -179.746 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . 164.86 -156.14 27.93 Favored Glycine 0 N--CA 1.485 1.913 0 N-CA-C 109.926 -1.27 . . . . 0.0 109.926 179.92 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 9.8 m -80.4 -141.53 0.04 OUTLIER 'General case' 0 N--CA 1.49 1.546 0 O-C-N 121.547 -0.972 . . . . 0.0 110.655 -179.325 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 40' ' ' ASP . . . . . 0.407 ' CG ' ' H ' ' A' ' 41' ' ' LYS . 44.9 t0 -54.31 179.0 0.02 OUTLIER 'General case' 0 N--CA 1.488 1.471 0 CA-C-O 121.773 0.797 . . . . 0.0 110.59 -179.008 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 41' ' ' LYS . . . . . 0.407 ' H ' ' CG ' ' A' ' 40' ' ' ASP . 26.9 ttmt -61.28 -39.84 91.91 Favored 'General case' 0 N--CA 1.49 1.566 0 O-C-N 121.702 -0.624 . . . . 0.0 110.378 -179.394 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -47.08 -49.78 21.09 Favored 'General case' 0 N--CA 1.494 1.76 0 O-C-N 121.248 -0.908 . . . . 0.0 110.289 -178.788 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 43' ' ' HIS . . . . . . . . . . . . . 6.0 t60 -61.64 -41.98 98.26 Favored 'General case' 0 N--CA 1.49 1.573 0 O-C-N 121.346 -0.846 . . . . 0.0 109.564 -179.353 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 54.8 mt -63.96 -39.03 93.21 Favored 'General case' 0 N--CA 1.49 1.554 0 O-C-N 121.415 -0.803 . . . . 0.0 109.623 -179.861 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 96.6 mt-10 -58.22 -41.23 83.6 Favored 'General case' 0 N--CA 1.489 1.488 0 O-C-N 121.319 -0.863 . . . . 0.0 109.428 -179.743 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . -62.43 -43.41 99.08 Favored Glycine 0 N--CA 1.489 2.189 0 N-CA-C 109.244 -1.542 . . . . 0.0 109.244 179.972 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 68.6 mttm -65.28 -39.82 93.09 Favored 'General case' 0 N--CA 1.489 1.506 0 O-C-N 121.364 -1.08 . . . . 0.0 109.285 179.466 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 53.5 tp -62.02 -40.37 95.47 Favored 'General case' 0 N--CA 1.489 1.519 0 O-C-N 121.477 -0.764 . . . . 0.0 109.604 -179.545 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 49' ' ' ALA . . . . . . . . . . . . . . . -57.25 -40.84 78.45 Favored 'General case' 0 N--CA 1.49 1.535 0 O-C-N 121.346 -0.846 . . . . 0.0 109.505 -179.156 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 75.4 mt-10 -68.64 -37.41 79.68 Favored 'General case' 0 N--CA 1.489 1.505 0 O-C-N 121.515 -0.741 . . . . 0.0 109.443 179.828 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 51' ' ' TYR . . . . . 0.457 ' CE2' HD21 ' A' ' 36' ' ' LEU . 3.7 m-85 -61.78 -43.69 98.35 Favored 'General case' 0 N--CA 1.491 1.587 0 O-C-N 121.656 -0.652 . . . . 0.0 109.533 -179.34 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 52' ' ' ILE . . . . . . . . . . . . . 93.3 mt -63.71 -42.96 97.77 Favored 'Isoleucine or valine' 0 C--N 1.302 -1.46 0 N-CA-C 108.892 -0.781 . . . . 0.0 108.892 -179.904 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 25.2 m -49.75 -55.31 14.47 Favored 'General case' 0 N--CA 1.49 1.552 0 O-C-N 121.368 -0.832 . . . . 0.0 109.747 -179.529 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 54' ' ' LEU . . . . . 0.483 HD22 ' N ' ' A' ' 54' ' ' LEU . 4.0 mm? -65.17 -38.48 90.67 Favored 'General case' 0 N--CA 1.489 1.512 0 O-C-N 121.438 -0.789 . . . . 0.0 109.101 179.725 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -55.78 -46.82 77.88 Favored 'General case' 0 N--CA 1.488 1.429 0 O-C-N 121.487 -0.758 . . . . 0.0 109.391 -179.517 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 56' ' ' LYS . . . . . . . . . . . . . 66.0 mttm -63.65 -41.3 98.23 Favored 'General case' 0 C--N 1.303 -1.455 0 O-C-N 121.575 -0.703 . . . . 0.0 109.816 179.922 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 98.8 mm-40 -63.12 -47.21 83.75 Favored 'General case' 0 N--CA 1.487 1.417 0 O-C-N 121.448 -0.783 . . . . 0.0 109.607 -179.618 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 58' ' ' VAL . . . . . . . . . . . . . 75.1 t -66.13 -45.16 91.04 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.452 0 O-C-N 121.363 -0.836 . . . . 0.0 109.801 -179.916 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 59' ' ' TYR . . . . . . . . . . . . . 83.4 t80 -140.64 119.83 12.9 Favored 'General case' 0 N--CA 1.496 1.85 0 O-C-N 121.381 -0.825 . . . . 0.0 109.924 -179.528 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -71.66 154.66 41.23 Favored 'General case' 0 N--CA 1.491 1.608 0 O-C-N 121.629 -0.669 . . . . 0.0 110.939 -179.679 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 61' ' ' ASN . . . . . . . . . . . . . 10.4 m120 60.23 35.96 20.89 Favored 'General case' 0 N--CA 1.493 1.68 0 CA-C-O 121.465 0.65 . . . . 0.0 109.286 179.828 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 62' ' ' VAL . . . . . . . . . . . . . 12.4 p -71.89 137.88 22.73 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.491 0 O-C-N 121.548 -0.72 . . . . 0.0 109.912 -179.995 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 84.5 tt0 -113.01 146.04 39.8 Favored 'General case' 0 N--CA 1.492 1.675 0 CA-C-O 121.488 0.661 . . . . 0.0 109.397 -179.768 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 64' ' ' TYR . . . . . . . . . . . . . 53.3 p90 -150.89 162.94 39.82 Favored 'General case' 0 N--CA 1.487 1.413 0 O-C-N 121.295 -0.878 . . . . 0.0 110.047 179.964 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 65' ' ' GLU . . . . . 0.485 ' CD ' ' N ' ' A' ' 66' ' ' VAL . 9.6 tm-20 -142.6 148.8 38.08 Favored 'General case' 0 N--CA 1.489 1.523 0 N-CA-C 108.949 -0.76 . . . . 0.0 108.949 179.5 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 66' ' ' VAL . . . . . 0.485 ' N ' ' CD ' ' A' ' 65' ' ' GLU . 54.5 t -116.41 131.0 70.27 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.55 0 CA-C-O 121.741 0.782 . . . . 0.0 109.846 -179.652 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -84.76 156.65 61.33 Favored Pre-proline 0 C--N 1.306 -1.294 0 N-CA-C 108.811 -0.811 . . . . 0.0 108.811 179.526 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 68' ' ' PRO . . . . . . . . . . . . . 96.6 Cg_exo -43.03 138.72 3.94 Favored 'Trans proline' 0 N--CA 1.493 1.484 0 C-N-CA 122.588 2.192 . . . . 0.0 112.801 179.626 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 69' ' ' VAL . . . . . 0.496 ' C ' ' H ' ' A' ' 71' ' ' ASP . 67.2 t -124.42 134.06 67.71 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.735 0 CA-C-O 121.569 0.699 . . . . 0.0 109.828 -179.448 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 70' ' ' ALA . . . . . 0.655 ' O ' ' N ' ' A' ' 72' ' ' ASN . . . -73.2 35.89 0.08 Allowed 'General case' 0 N--CA 1.487 1.408 0 O-C-N 121.606 -0.684 . . . . 0.0 109.556 179.828 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 71' ' ' ASP . . . . . 0.496 ' H ' ' C ' ' A' ' 69' ' ' VAL . 97.9 m-20 53.39 -73.45 0.01 OUTLIER 'General case' 0 N--CA 1.496 1.827 0 CA-C-O 121.59 0.709 . . . . 0.0 110.059 179.76 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 72' ' ' ASN . . . . . 0.655 ' N ' ' O ' ' A' ' 70' ' ' ALA . 51.7 t30 -86.96 18.41 3.56 Favored 'General case' 0 C--N 1.299 -1.618 0 N-CA-C 108.136 -1.061 . . . . 0.0 108.136 179.492 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 73' ' ' ALA . . . . . 0.518 ' C ' ' H ' ' A' ' 75' ' ' GLU . . . -52.78 -6.96 0.06 Allowed 'General case' 0 N--CA 1.492 1.673 0 N-CA-C 109.274 -0.639 . . . . 0.0 109.274 -179.986 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 74' ' ' THR . . . . . 0.544 HG23 ' O ' ' A' ' 72' ' ' ASN . 6.1 p 61.96 -4.65 0.18 Allowed 'General case' 0 N--CA 1.492 1.674 0 O-C-N 121.625 -0.672 . . . . 0.0 109.624 -179.866 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 75' ' ' GLU . . . . . 0.518 ' H ' ' C ' ' A' ' 73' ' ' ALA . 22.4 pt-20 -149.08 150.44 32.76 Favored 'General case' 0 N--CA 1.49 1.534 0 O-C-N 121.161 -0.962 . . . . 0.0 109.41 179.404 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 6.2 tt -122.72 129.44 51.78 Favored 'General case' 0 N--CA 1.493 1.704 0 CA-C-O 121.566 0.698 . . . . 0.0 109.49 179.647 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 77' ' ' HIS . . . . . . . . . . . . . 97.7 m-70 -97.87 130.7 44.75 Favored 'General case' 0 N--CA 1.488 1.462 0 O-C-N 121.562 -0.711 . . . . 0.0 109.651 -179.658 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -146.64 153.88 40.82 Favored 'General case' 0 N--CA 1.489 1.498 0 O-C-N 121.37 -0.831 . . . . 0.0 109.582 179.939 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 99.6 mtt180 -129.78 148.02 51.61 Favored 'General case' 0 N--CA 1.491 1.582 0 N-CA-C 109.249 -0.648 . . . . 0.0 109.249 -179.949 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 80' ' ' PHE . . . . . . . . . . . . . 30.1 m-85 -126.12 149.92 48.6 Favored 'General case' 0 N--CA 1.493 1.722 0 O-C-N 121.629 -0.669 . . . . 0.0 109.419 -179.777 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 81' ' ' LYS . . . . . 0.533 ' NZ ' ' OD2' ' A' ' 30' ' ' ASP . 63.9 tttp -105.93 124.04 48.94 Favored 'General case' 0 N--CA 1.491 1.58 0 O-C-N 121.548 -0.72 . . . . 0.0 109.323 -179.969 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 82' ' ' PHE . . . . . 0.405 ' CD1' ' OE2' ' A' ' 87' ' ' GLU . 62.2 m-85 -124.95 144.52 50.31 Favored 'General case' 0 N--CA 1.493 1.675 0 CA-C-O 121.594 0.711 . . . . 0.0 109.56 -179.876 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 83.9 tt0 -67.03 -29.22 68.98 Favored 'General case' 0 N--CA 1.488 1.429 0 O-C-N 121.61 -0.681 . . . . 0.0 109.8 -179.627 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 84' ' ' VAL . . . . . 0.435 HG23 ' H ' ' A' ' 87' ' ' GLU . 35.0 m -131.51 150.37 34.08 Favored 'Isoleucine or valine' 0 N--CA 1.499 2.015 0 CA-C-O 121.832 0.825 . . . . 0.0 110.37 -179.483 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 36.9 m -72.6 -32.29 65.85 Favored 'General case' 0 N--CA 1.49 1.528 0 CA-C-O 121.451 0.643 . . . . 0.0 109.586 179.939 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 86' ' ' ALA . . . . . . . . . . . . . . . -54.36 -34.98 62.27 Favored 'General case' 0 N--CA 1.489 1.514 0 O-C-N 121.299 -0.875 . . . . 0.0 108.79 -179.669 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 87' ' ' GLU . . . . . 0.435 ' H ' HG23 ' A' ' 84' ' ' VAL . 80.4 tt0 -65.33 -32.17 73.69 Favored 'General case' 0 C--N 1.303 -1.437 0 N-CA-C 109.096 -0.705 . . . . 0.0 109.096 179.765 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 88' ' ' LYS . . . . . . . . . . . . . 88.8 tttt -63.2 -44.33 95.67 Favored 'General case' 0 N--CA 1.49 1.551 0 O-C-N 121.373 -0.829 . . . . 0.0 109.39 179.975 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 93.9 mt -62.05 -49.27 76.67 Favored 'General case' 0 N--CA 1.491 1.607 0 O-C-N 121.39 -0.818 . . . . 0.0 110.145 -179.217 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 90' ' ' ILE . . . . . 0.535 ' N ' HD12 ' A' ' 90' ' ' ILE . 1.4 mp -70.32 -42.11 78.65 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.582 0 O-C-N 121.366 -0.834 . . . . 0.0 109.403 -179.971 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 91' ' ' PHE . . . . . . . . . . . . . 70.3 t80 -57.45 -45.85 84.27 Favored 'General case' 0 C--N 1.303 -1.445 0 O-C-N 121.406 -0.809 . . . . 0.0 108.886 -179.137 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 92' ' ' GLU . . . . . . . . . . . . . 98.1 mt-10 -68.23 -33.58 74.66 Favored 'General case' 0 C--N 1.301 -1.506 0 N-CA-C 109.116 -0.698 . . . . 0.0 109.116 179.263 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 93' ' ' LEU . . . . . . . . . . . . . 59.0 tp -62.82 -43.19 99.46 Favored 'General case' 0 N--CA 1.488 1.459 0 O-C-N 121.496 -0.753 . . . . 0.0 109.401 -179.736 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 94' ' ' LYS . . . . . . . . . . . . . 67.2 mmtt -65.25 -42.5 93.27 Favored 'General case' 0 N--CA 1.487 1.407 0 O-C-N 121.468 -0.77 . . . . 0.0 109.735 -179.581 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 18.0 p -66.11 -43.06 88.28 Favored 'General case' 0 N--CA 1.488 1.454 0 O-C-N 121.253 -0.904 . . . . 0.0 109.497 -179.732 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 96' ' ' ARG . . . . . . . . . . . . . 17.3 tpp180 -62.61 -44.76 95.49 Favored 'General case' 0 N--CA 1.487 1.388 0 O-C-N 121.305 -0.872 . . . . 0.0 109.396 -179.81 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 97' ' ' ALA . . . . . . . . . . . . . . . -62.81 -40.05 96.18 Favored 'General case' 0 N--CA 1.488 1.434 0 N-CA-C 108.778 -0.823 . . . . 0.0 108.778 -179.835 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 98' ' ' LEU . . . . . . . . . . . . . 6.5 tt -63.6 -43.39 97.06 Favored 'General case' 0 C--N 1.301 -1.535 0 CA-C-O 121.683 0.754 . . . . 0.0 109.027 179.558 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 99' ' ' ALA . . . . . . . . . . . . . . . -66.31 -36.17 82.25 Favored 'General case' 0 N--CA 1.489 1.511 0 O-C-N 121.775 -0.578 . . . . 0.0 109.594 -179.793 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 100' ' ' ARG . . . . . 0.541 ' O ' ' N ' ' A' ' 102' ' ' GLU . 99.8 mtt180 -78.3 -8.81 58.84 Favored 'General case' 0 N--CA 1.486 1.373 0 O-C-N 121.536 -0.728 . . . . 0.0 109.18 -179.626 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 101' ' ' LEU . . . . . . . . . . . . . 88.8 mt 42.55 -90.13 0.01 OUTLIER 'General case' 0 N--CA 1.492 1.656 0 CA-C-O 121.512 0.672 . . . . 0.0 110.589 179.625 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 102' ' ' GLU . . . . . 0.541 ' N ' ' O ' ' A' ' 100' ' ' ARG . 79.8 mm-40 -53.49 142.91 20.88 Favored 'General case' 0 N--CA 1.487 1.385 0 CA-C-O 121.837 0.827 . . . . 0.0 110.657 -178.698 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 103' ' ' HIS . . . . . . . . . . . . . 99.1 m-70 -76.09 145.29 40.16 Favored 'General case' 0 N--CA 1.487 1.395 0 CA-C-O 121.57 0.7 . . . . 0.0 110.777 -179.248 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 104' ' ' HIS . . . . . . . . . . . . . 77.3 m-70 60.99 85.17 0.12 Allowed 'General case' 0 N--CA 1.49 1.569 0 CA-C-O 121.527 0.679 . . . . 0.0 110.0 179.559 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 105' ' ' HIS . . . . . . . . . . . . . 71.6 t60 -74.23 -7.8 53.99 Favored 'General case' 0 N--CA 1.487 1.423 0 N-CA-C 108.899 -0.778 . . . . 0.0 108.899 179.553 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 106' ' ' HIS . . . . . . . . . . . . . 94.9 m-70 -71.87 136.35 46.92 Favored 'General case' 0 N--CA 1.487 1.424 0 O-C-N 121.495 -0.753 . . . . 0.0 109.973 -179.451 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 107' ' ' HIS . . . . . 0.484 ' O ' ' ND1' ' A' ' 108' ' ' HIS . 78.8 m80 -86.77 122.32 30.5 Favored 'General case' 0 N--CA 1.488 1.472 0 O-C-N 121.555 -0.716 . . . . 0.0 109.938 -179.613 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 108' ' ' HIS . . . . . 0.484 ' ND1' ' O ' ' A' ' 107' ' ' HIS . 61.3 m80 . . . . . 0 N--CA 1.487 1.412 0 CA-C-O 118.008 -0.996 . . . . 0.0 108.895 179.755 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 1' ' ' MET . . . . . 0.539 ' O ' ' N ' ' A' ' 3' ' ' ASN . 2.6 mpt? . . . . . 0 N--CA 1.491 1.62 0 N-CA-C 109.772 -0.455 . . . . 0.0 109.772 . . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 2' ' ' SER . . . . . 0.425 ' C ' ' O ' ' A' ' 1' ' ' MET . 30.5 t 35.19 -88.75 0.01 OUTLIER 'General case' 0 N--CA 1.501 2.092 0 CA-C-O 121.157 0.503 . . . . 0.0 110.849 -179.7 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 3' ' ' ASN . . . . . 0.539 ' N ' ' O ' ' A' ' 1' ' ' MET . 37.5 t30 41.95 -110.92 0.14 Allowed 'General case' 0 N--CA 1.492 1.637 0 O-C-N 121.48 -0.762 . . . . 0.0 110.56 179.953 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 4' ' ' GLN . . . . . 0.455 ' N ' ' CG ' ' A' ' 3' ' ' ASN . 95.3 mt-30 -82.35 -88.56 0.09 Allowed 'General case' 0 N--CA 1.488 1.429 0 O-C-N 121.391 -0.818 . . . . 0.0 110.191 -179.263 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 31.3 m -65.28 133.65 51.91 Favored 'General case' 0 N--CA 1.49 1.555 0 O-C-N 121.336 -0.852 . . . . 0.0 110.641 -178.835 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 13.1 p -148.05 43.09 1.05 Allowed 'General case' 0 N--CA 1.488 1.474 0 N-CA-C 108.706 -0.849 . . . . 0.0 108.706 179.331 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 7' ' ' VAL . . . . . . . . . . . . . 53.9 t -107.64 129.88 60.88 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.941 0 O-C-N 121.544 -0.722 . . . . 0.0 109.142 -179.937 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 8' ' ' GLU . . . . . 0.471 ' O ' ' CB ' ' A' ' 9' ' ' ASN . 18.9 pt-20 -173.61 139.0 0.7 Allowed 'General case' 0 N--CA 1.487 1.414 0 N-CA-C 108.723 -0.843 . . . . 0.0 108.723 179.597 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 9' ' ' ASN . . . . . 0.471 ' CB ' ' O ' ' A' ' 8' ' ' GLU . 33.3 t30 77.7 -45.52 0.44 Allowed 'General case' 0 N--CA 1.494 1.772 0 N-CA-C 109.144 -0.687 . . . . 0.0 109.144 -179.377 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 10' ' ' GLU . . . . . 0.539 ' O ' ' N ' ' A' ' 12' ' ' CYS . 17.0 mp0 -72.34 147.9 45.85 Favored 'General case' 0 C--N 1.303 -1.42 0 O-C-N 121.361 -0.837 . . . . 0.0 110.307 -179.208 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 12.8 t 60.54 -68.94 0.09 OUTLIER 'Isoleucine or valine' 0 N--CA 1.494 1.771 0 CA-C-O 121.186 0.517 . . . . 0.0 109.947 -179.979 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 12' ' ' CYS . . . . . 0.539 ' N ' ' O ' ' A' ' 10' ' ' GLU . 12.8 t -68.75 136.08 52.26 Favored 'General case' 0 N--CA 1.489 1.511 0 O-C-N 121.111 -0.993 . . . . 0.0 110.36 -179.296 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 96.3 mt-10 -52.85 142.46 19.09 Favored 'General case' 0 N--CA 1.496 1.863 0 CA-C-O 121.584 0.706 . . . . 0.0 111.439 -179.169 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 14' ' ' ALA . . . . . 0.44 ' HB2' ' OD1' ' A' ' 9' ' ' ASN . . . -86.24 -74.01 0.43 Allowed 'General case' 0 N--CA 1.491 1.592 0 O-C-N 121.751 -0.593 . . . . 0.0 109.55 179.456 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 74.2 m -82.55 145.71 29.6 Favored 'General case' 0 N--CA 1.491 1.619 0 O-C-N 121.224 -0.923 . . . . 0.0 110.482 -179.068 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . -63.44 167.86 22.85 Favored Glycine 0 N--CA 1.491 2.342 0 N-CA-C 111.197 -0.761 . . . . 0.0 111.197 -179.107 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 38.4 t -72.52 135.9 45.76 Favored 'General case' 0 N--CA 1.489 1.499 0 O-C-N 121.666 -0.902 . . . . 0.0 110.348 -179.59 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -65.66 145.69 55.72 Favored 'General case' 0 N--CA 1.491 1.622 0 CA-C-O 121.541 0.686 . . . . 0.0 111.067 -179.218 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 83.36 19.37 62.47 Favored Glycine 0 N--CA 1.491 2.336 0 N-CA-C 109.193 -1.563 . . . . 0.0 109.193 179.797 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 20' ' ' GLU . . . . . 0.413 ' HG3' ' H ' ' A' ' 22' ' ' GLY . 50.8 tp10 -68.51 125.06 25.29 Favored 'General case' 0 N--CA 1.488 1.429 0 O-C-N 121.282 -1.128 . . . . 0.0 110.217 -179.211 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 21' ' ' ILE . . . . . . . . . . . . . 33.4 pt -96.14 -7.56 9.6 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.64 0 O-C-N 121.63 -0.669 . . . . 0.0 109.345 179.324 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 22' ' ' GLY . . . . . 0.413 ' H ' ' HG3' ' A' ' 20' ' ' GLU . . . 118.08 164.52 13.13 Favored Glycine 0 N--CA 1.499 2.882 0 N-CA-C 109.936 -1.266 . . . . 0.0 109.936 179.541 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 23' ' ' PHE . . . . . . . . . . . . . 77.1 t80 -113.35 136.08 53.15 Favored 'General case' 0 N--CA 1.497 1.888 0 O-C-N 121.772 -0.84 . . . . 0.0 109.841 -179.824 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 4.0 pt -78.44 151.43 5.21 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.492 0 CA-C-O 121.687 0.756 . . . . 0.0 110.617 -179.522 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 25' ' ' ILE . . . . . . . . . . . . . 96.7 mt 56.91 93.79 0.04 OUTLIER 'Isoleucine or valine' 0 N--CA 1.488 1.461 0 CA-C-O 121.452 0.644 . . . . 0.0 110.169 179.659 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 22.2 mmm180 -77.16 153.25 34.36 Favored 'General case' 0 N--CA 1.489 1.522 0 CA-C-O 121.644 0.735 . . . . 0.0 109.933 -179.683 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 60.0 mp0 -61.54 142.57 56.98 Favored 'General case' 0 N--CA 1.49 1.539 0 O-C-N 121.397 -0.814 . . . . 0.0 110.547 -178.981 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . -176.79 -170.25 39.07 Favored Glycine 0 N--CA 1.489 2.23 0 N-CA-C 110.05 -1.22 . . . . 0.0 110.05 179.837 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 29' ' ' ASP . . . . . 0.544 ' OD1' ' N ' ' A' ' 30' ' ' ASP . 49.6 p-10 -67.51 -31.4 71.49 Favored 'General case' 0 N--CA 1.494 1.765 0 O-C-N 121.454 -1.027 . . . . 0.0 110.315 -179.64 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 30' ' ' ASP . . . . . 0.544 ' N ' ' OD1' ' A' ' 29' ' ' ASP . 90.7 m-20 -82.14 2.59 30.72 Favored 'General case' 0 C--N 1.302 -1.46 0 O-C-N 121.019 -1.05 . . . . 0.0 109.651 -179.401 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 51.1 t -119.92 133.85 65.33 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.958 0 O-C-N 121.616 -0.678 . . . . 0.0 109.29 -179.828 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -126.65 149.45 49.51 Favored 'General case' 0 N--CA 1.494 1.766 0 CA-C-O 121.505 0.669 . . . . 0.0 109.603 -179.646 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 17.3 pt-20 -91.54 140.14 30.03 Favored 'General case' 0 N--CA 1.49 1.548 0 O-C-N 121.565 -0.709 . . . . 0.0 109.929 -179.577 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 34' ' ' VAL . . . . . 0.46 HG21 ' CD1' ' A' ' 80' ' ' PHE . 48.4 t -130.16 135.42 60.91 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.793 0 N-CA-C 108.566 -0.901 . . . . 0.0 108.566 179.293 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 44.8 t -134.96 142.71 46.55 Favored 'General case' 0 N--CA 1.493 1.709 0 N-CA-C 109.196 -0.668 . . . . 0.0 109.196 179.877 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 36' ' ' LEU . . . . . 0.53 HD21 ' CE2' ' A' ' 51' ' ' TYR . 76.7 mt -119.72 156.75 29.93 Favored 'General case' 0 N--CA 1.498 1.963 0 N-CA-C 109.256 -0.646 . . . . 0.0 109.256 -179.743 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 37' ' ' PHE . . . . . . . . . . . . . 92.4 m-85 -119.48 138.82 52.9 Favored 'General case' 0 N--CA 1.494 1.772 0 N-CA-C 109.445 -0.576 . . . . 0.0 109.445 -179.582 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 38' ' ' GLY . . . . . 0.52 ' N ' HD21 ' A' ' 44' ' ' LEU . . . -178.14 -175.62 45.43 Favored Glycine 0 N--CA 1.486 2.028 0 N-CA-C 109.781 -1.328 . . . . 0.0 109.781 -179.908 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 39' ' ' SER . . . . . 0.514 ' OG ' ' N ' ' A' ' 40' ' ' ASP . 93.7 p -98.93 -77.39 0.52 Allowed 'General case' 0 N--CA 1.494 1.739 0 O-C-N 121.643 -0.916 . . . . 0.0 109.637 179.89 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 40' ' ' ASP . . . . . 0.543 ' OD1' ' N ' ' A' ' 41' ' ' LYS . 58.3 t0 -80.59 156.44 26.43 Favored 'General case' 0 N--CA 1.49 1.558 0 O-C-N 121.322 -0.861 . . . . 0.0 110.015 -179.169 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 41' ' ' LYS . . . . . 0.543 ' N ' ' OD1' ' A' ' 40' ' ' ASP . 4.5 tmtt? -62.26 -42.13 99.06 Favored 'General case' 0 N--CA 1.488 1.44 0 O-C-N 121.316 -0.865 . . . . 0.0 109.757 -179.306 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -55.7 -41.19 73.42 Favored 'General case' 0 N--CA 1.492 1.628 0 O-C-N 120.984 -1.072 . . . . 0.0 110.291 -179.038 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 43' ' ' HIS . . . . . . . . . . . . . 82.0 t60 -61.24 -42.39 98.53 Favored 'General case' 0 C--N 1.301 -1.536 0 O-C-N 121.135 -0.978 . . . . 0.0 109.537 -179.78 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 44' ' ' LEU . . . . . 0.52 HD21 ' N ' ' A' ' 38' ' ' GLY . 84.0 mt -63.4 -40.06 96.19 Favored 'General case' 0 N--CA 1.49 1.534 0 O-C-N 121.346 -0.846 . . . . 0.0 109.838 -179.775 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 96.5 mt-10 -60.83 -37.22 81.29 Favored 'General case' 0 C--N 1.301 -1.516 0 O-C-N 121.197 -0.94 . . . . 0.0 109.139 179.874 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . -62.16 -42.87 99.73 Favored Glycine 0 N--CA 1.489 2.202 0 N-CA-C 109.341 -1.504 . . . . 0.0 109.341 179.855 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 54.9 mtpt -65.48 -36.61 84.39 Favored 'General case' 0 N--CA 1.488 1.454 0 O-C-N 121.312 -1.111 . . . . 0.0 109.577 179.421 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 57.5 tp -60.89 -40.41 92.94 Favored 'General case' 0 N--CA 1.489 1.485 0 O-C-N 121.497 -0.752 . . . . 0.0 109.593 -179.109 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 49' ' ' ALA . . . . . . . . . . . . . . . -56.11 -42.41 76.8 Favored 'General case' 0 C--N 1.302 -1.491 0 O-C-N 121.178 -0.951 . . . . 0.0 109.433 -179.352 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 97.3 mt-10 -66.48 -39.13 88.59 Favored 'General case' 0 C--N 1.302 -1.488 0 O-C-N 121.467 -0.771 . . . . 0.0 109.512 179.834 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 51' ' ' TYR . . . . . 0.53 ' CE2' HD21 ' A' ' 36' ' ' LEU . 4.3 m-85 -62.2 -40.77 97.19 Favored 'General case' 0 N--CA 1.491 1.598 0 O-C-N 121.519 -0.738 . . . . 0.0 109.638 -179.527 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 52' ' ' ILE . . . . . . . . . . . . . 96.8 mt -63.27 -42.61 97.04 Favored 'Isoleucine or valine' 0 C--N 1.298 -1.641 0 O-C-N 121.364 -0.835 . . . . 0.0 109.402 -179.671 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 66.6 m -57.82 -49.99 74.77 Favored 'General case' 0 N--CA 1.491 1.586 0 O-C-N 121.18 -0.95 . . . . 0.0 110.642 -179.022 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 54' ' ' LEU . . . . . 0.448 HD22 ' N ' ' A' ' 54' ' ' LEU . 4.2 mm? -66.05 -41.16 91.2 Favored 'General case' 0 N--CA 1.493 1.683 0 O-C-N 121.05 -1.031 . . . . 0.0 109.495 179.732 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -64.25 -39.14 93.34 Favored 'General case' 0 C--N 1.301 -1.516 0 O-C-N 121.46 -0.775 . . . . 0.0 109.476 -179.512 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 56' ' ' LYS . . . . . . . . . . . . . 88.8 tttt -64.05 -43.98 93.87 Favored 'General case' 0 C--N 1.304 -1.4 0 O-C-N 121.418 -0.801 . . . . 0.0 110.076 -179.478 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 15.5 mm100 -66.54 -41.64 88.41 Favored 'General case' 0 N--CA 1.489 1.497 0 O-C-N 121.236 -0.915 . . . . 0.0 109.635 -179.624 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 58' ' ' VAL . . . . . 0.469 ' CG1' ' OE1' ' A' ' 87' ' ' GLU . 74.7 t -64.92 -45.3 95.21 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.507 0 O-C-N 121.424 -0.797 . . . . 0.0 110.626 -179.27 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 59' ' ' TYR . . . . . . . . . . . . . 83.5 t80 -127.86 129.93 47.74 Favored 'General case' 0 N--CA 1.499 2.0 0 O-C-N 121.499 -0.751 . . . . 0.0 110.111 -178.898 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 60' ' ' ALA . . . . . 0.441 ' O ' ' CG ' ' A' ' 61' ' ' ASN . . . -68.51 154.99 40.81 Favored 'General case' 0 N--CA 1.489 1.478 0 O-C-N 121.59 -0.693 . . . . 0.0 110.234 -179.787 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 61' ' ' ASN . . . . . 0.441 ' CG ' ' O ' ' A' ' 60' ' ' ALA . 12.9 p30 45.4 58.31 4.27 Favored 'General case' 0 N--CA 1.493 1.724 0 CA-C-O 121.749 0.785 . . . . 0.0 109.347 -179.744 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 62' ' ' VAL . . . . . . . . . . . . . 14.7 p -74.09 136.5 25.15 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.458 0 CA-C-O 121.48 0.657 . . . . 0.0 110.211 -179.508 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 96.9 mt-10 -124.44 140.05 53.31 Favored 'General case' 0 N--CA 1.492 1.661 0 N-CA-C 109.248 -0.649 . . . . 0.0 109.248 179.826 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 64' ' ' TYR . . . . . . . . . . . . . 50.7 p90 -149.93 161.79 41.62 Favored 'General case' 0 C--N 1.303 -1.444 0 O-C-N 121.447 -0.783 . . . . 0.0 109.132 -179.854 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 49.4 tp10 -142.57 147.03 35.22 Favored 'General case' 0 N--CA 1.491 1.599 0 N-CA-C 108.66 -0.867 . . . . 0.0 108.66 179.694 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 66' ' ' VAL . . . . . . . . . . . . . 75.5 t -117.45 128.39 74.72 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.699 0 O-C-N 121.763 -0.586 . . . . 0.0 109.563 -179.85 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 67' ' ' ALA . . . . . 0.466 ' HB1' ' HD2' ' A' ' 68' ' ' PRO . . . -81.84 168.29 25.14 Favored Pre-proline 0 N--CA 1.489 1.487 0 O-C-N 121.533 -0.729 . . . . 0.0 109.158 -179.878 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 68' ' ' PRO . . . . . 0.466 ' HD2' ' HB1' ' A' ' 67' ' ' ALA . 51.1 Cg_exo -53.36 131.7 44.7 Favored 'Trans proline' 0 N--CA 1.497 1.717 0 C-N-CA 122.198 1.932 . . . . 0.0 112.537 179.588 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 69' ' ' VAL . . . . . . . . . . . . . 54.4 t -133.75 136.68 53.8 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.872 0 O-C-N 121.613 -0.679 . . . . 0.0 109.632 179.58 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -67.83 150.64 48.34 Favored 'General case' 0 N--CA 1.49 1.534 0 O-C-N 121.54 -0.725 . . . . 0.0 110.489 -179.694 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 96.8 m-20 -63.08 -37.16 86.1 Favored 'General case' 0 N--CA 1.492 1.669 0 O-C-N 121.426 -0.796 . . . . 0.0 109.979 179.904 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 72' ' ' ASN . . . . . . . . . . . . . 20.2 t-20 -86.64 9.33 18.97 Favored 'General case' 0 N--CA 1.493 1.677 0 O-C-N 121.296 -0.877 . . . . 0.0 108.891 -179.916 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -63.24 142.92 58.2 Favored 'General case' 0 N--CA 1.489 1.505 0 O-C-N 121.412 -0.805 . . . . 0.0 110.157 -179.465 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 74' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -105.84 5.54 30.83 Favored 'General case' 0 N--CA 1.493 1.686 0 N-CA-C 108.405 -0.961 . . . . 0.0 108.405 179.245 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 96.8 mt-10 -141.96 160.49 40.1 Favored 'General case' 0 N--CA 1.496 1.835 0 O-C-N 121.402 -0.811 . . . . 0.0 109.141 179.372 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 6.6 tp -129.1 134.09 47.93 Favored 'General case' 0 N--CA 1.496 1.868 0 O-C-N 121.669 -0.645 . . . . 0.0 109.349 179.912 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 77' ' ' HIS . . . . . . . . . . . . . 77.7 m80 -104.94 124.07 48.85 Favored 'General case' 0 N--CA 1.494 1.726 0 CA-C-O 121.425 0.631 . . . . 0.0 109.587 179.688 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -150.66 162.17 41.2 Favored 'General case' 0 N--CA 1.488 1.469 0 O-C-N 121.492 -0.755 . . . . 0.0 109.019 -179.995 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 84.4 mtt85 -128.89 149.54 50.73 Favored 'General case' 0 N--CA 1.493 1.711 0 N-CA-C 109.114 -0.698 . . . . 0.0 109.114 179.872 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 80' ' ' PHE . . . . . 0.46 ' CD1' HG21 ' A' ' 34' ' ' VAL . 34.4 m-85 -128.14 152.1 48.43 Favored 'General case' 0 N--CA 1.494 1.734 0 O-C-N 121.665 -0.647 . . . . 0.0 109.452 -179.821 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 65.7 tttm -107.81 140.21 41.24 Favored 'General case' 0 N--CA 1.492 1.653 0 CA-C-O 121.324 0.583 . . . . 0.0 109.924 -179.373 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 82' ' ' PHE . . . . . . . . . . . . . 82.7 m-85 -141.67 -164.6 1.81 Allowed 'General case' 0 N--CA 1.492 1.67 0 O-C-N 121.52 -0.738 . . . . 0.0 109.404 179.896 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 83.0 tt0 -100.46 -50.56 3.87 Favored 'General case' 0 N--CA 1.492 1.632 0 O-C-N 121.607 -0.683 . . . . 0.0 109.285 179.806 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 84' ' ' VAL . . . . . . . . . . . . . 2.5 m -134.72 164.88 32.82 Favored 'Isoleucine or valine' 0 N--CA 1.499 2.001 0 O-C-N 121.451 -0.781 . . . . 0.0 110.311 -179.534 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 38.1 t -61.87 -19.05 62.21 Favored 'General case' 0 N--CA 1.489 1.523 0 O-C-N 121.755 -0.591 . . . . 0.0 109.61 -179.908 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 86' ' ' ALA . . . . . . . . . . . . . . . -61.45 -37.21 82.73 Favored 'General case' 0 N--CA 1.489 1.487 0 O-C-N 121.241 -0.912 . . . . 0.0 109.618 -179.899 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 87' ' ' GLU . . . . . 0.469 ' OE1' ' CG1' ' A' ' 58' ' ' VAL . 79.6 mm-40 -66.61 -34.99 79.11 Favored 'General case' 0 N--CA 1.49 1.556 0 O-C-N 121.315 -0.865 . . . . 0.0 109.386 -179.916 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 88' ' ' LYS . . . . . . . . . . . . . 88.7 tttt -62.85 -46.48 87.71 Favored 'General case' 0 N--CA 1.49 1.552 0 O-C-N 121.328 -0.858 . . . . 0.0 109.628 -179.791 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 87.1 mt -63.26 -44.38 95.3 Favored 'General case' 0 N--CA 1.488 1.468 0 O-C-N 121.346 -0.846 . . . . 0.0 109.409 -179.669 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 90' ' ' ILE . . . . . . . . . . . . . 97.0 mt -66.55 -45.15 89.47 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.461 0 O-C-N 121.34 -0.85 . . . . 0.0 109.791 -179.954 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 91' ' ' PHE . . . . . . . . . . . . . 86.2 t80 -64.4 -43.41 94.53 Favored 'General case' 0 N--CA 1.489 1.484 0 O-C-N 121.477 -0.764 . . . . 0.0 109.78 -179.919 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 92' ' ' GLU . . . . . . . . . . . . . 47.6 tp10 -59.21 -39.24 82.04 Favored 'General case' 0 N--CA 1.488 1.46 0 O-C-N 121.409 -0.807 . . . . 0.0 108.887 -179.36 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 93' ' ' LEU . . . . . 0.411 ' HA ' ' HE ' ' A' ' 96' ' ' ARG . 5.5 tt -62.96 -43.56 98.47 Favored 'General case' 0 C--N 1.301 -1.529 0 O-C-N 121.434 -0.792 . . . . 0.0 109.633 179.928 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 94' ' ' LYS . . . . . . . . . . . . . 99.2 mttt -64.68 -40.83 96.07 Favored 'General case' 0 N--CA 1.489 1.482 0 O-C-N 121.529 -0.732 . . . . 0.0 109.428 -179.795 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 95' ' ' THR . . . . . 0.506 ' CG2' ' CE2' ' A' ' 51' ' ' TYR . 21.1 p -64.84 -42.97 94.49 Favored 'General case' 0 N--CA 1.49 1.534 0 O-C-N 121.317 -0.864 . . . . 0.0 109.304 -179.914 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 96' ' ' ARG . . . . . 0.411 ' HE ' ' HA ' ' A' ' 93' ' ' LEU . 89.4 mtm180 -63.81 -38.69 92.03 Favored 'General case' 0 N--CA 1.488 1.441 0 O-C-N 121.467 -0.771 . . . . 0.0 109.136 179.483 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 97' ' ' ALA . . . . . . . . . . . . . . . -65.97 -44.72 84.13 Favored 'General case' 0 N--CA 1.488 1.473 0 O-C-N 121.369 -0.832 . . . . 0.0 109.686 -179.931 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 98' ' ' LEU . . . . . . . . . . . . . 83.5 mt -64.78 -43.31 93.65 Favored 'General case' 0 N--CA 1.49 1.556 0 O-C-N 121.245 -0.91 . . . . 0.0 109.41 -179.985 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 99' ' ' ALA . . . . . . . . . . . . . . . -70.95 -51.75 23.97 Favored 'General case' 0 C--N 1.302 -1.482 0 O-C-N 121.411 -0.805 . . . . 0.0 109.975 -179.623 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 100' ' ' ARG . . . . . . . . . . . . . 46.1 mmm-85 -68.03 -39.25 83.14 Favored 'General case' 0 C--N 1.302 -1.476 0 O-C-N 121.44 -0.787 . . . . 0.0 109.535 -179.33 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 101' ' ' LEU . . . . . . . . . . . . . 12.6 tp 41.67 58.58 2.72 Favored 'General case' 0 N--CA 1.491 1.612 0 O-C-N 121.653 -0.655 . . . . 0.0 109.921 -179.71 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 102' ' ' GLU . . . . . . . . . . . . . 80.6 mm-40 -105.95 87.23 2.53 Favored 'General case' 0 N--CA 1.498 1.93 0 O-C-N 121.497 -0.752 . . . . 0.0 109.345 179.989 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 103' ' ' HIS . . . . . 0.54 ' CG ' ' N ' ' A' ' 104' ' ' HIS . 11.7 t-160 -86.03 -107.54 0.05 Allowed 'General case' 0 N--CA 1.49 1.571 0 O-C-N 121.501 -0.749 . . . . 0.0 109.412 179.926 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 104' ' ' HIS . . . . . 0.54 ' N ' ' CG ' ' A' ' 103' ' ' HIS . 51.2 p-80 -86.58 12.78 9.72 Favored 'General case' 0 N--CA 1.487 1.379 0 N-CA-C 108.717 -0.845 . . . . 0.0 108.717 179.641 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 105' ' ' HIS . . . . . . . . . . . . . 79.3 m80 -59.09 -41.22 87.54 Favored 'General case' 0 C--N 1.305 -1.361 0 N-CA-C 108.588 -0.893 . . . . 0.0 108.588 179.577 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 106' ' ' HIS . . . . . . . . . . . . . 51.9 t-80 43.4 43.2 4.22 Favored 'General case' 0 N--CA 1.491 1.621 0 CA-C-O 121.524 0.678 . . . . 0.0 109.466 -179.786 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 107' ' ' HIS . . . . . . . . . . . . . 84.0 t60 -141.81 137.31 31.41 Favored 'General case' 0 N--CA 1.491 1.622 0 O-C-N 121.415 -0.803 . . . . 0.0 109.38 -179.929 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 108' ' ' HIS . . . . . 0.439 ' O ' ' CG ' ' A' ' 108' ' ' HIS . 86.0 t60 . . . . . 0 N--CA 1.488 1.468 0 CA-C-O 117.882 -1.056 . . . . 0.0 110.159 -179.647 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 1' ' ' MET . . . . . 0.6 ' N ' ' SD ' ' A' ' 1' ' ' MET . 0.0 OUTLIER . . . . . 0 N--CA 1.49 1.572 0 N-CA-C 108.713 -0.847 . . . . 0.0 108.713 . . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 22.0 m -149.76 150.67 32.39 Favored 'General case' 0 N--CA 1.489 1.502 0 O-C-N 121.284 -0.885 . . . . 0.0 109.51 179.715 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 3' ' ' ASN . . . . . . . . . . . . . 57.4 t-20 -89.08 108.57 19.67 Favored 'General case' 0 N--CA 1.49 1.555 0 O-C-N 121.406 -0.809 . . . . 0.0 109.603 -179.716 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 5.3 tp-100 -158.24 -38.26 0.07 Allowed 'General case' 0 N--CA 1.49 1.533 0 N-CA-C 108.654 -0.869 . . . . 0.0 108.654 179.677 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 4.0 p -93.63 -6.06 47.31 Favored 'General case' 0 N--CA 1.493 1.681 0 N-CA-C 108.854 -0.795 . . . . 0.0 108.854 179.866 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 90.5 m -65.12 -37.7 88.31 Favored 'General case' 0 N--CA 1.488 1.453 0 O-C-N 121.502 -0.749 . . . . 0.0 109.032 179.634 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 7' ' ' VAL . . . . . . . . . . . . . 33.8 m -76.09 138.97 19.7 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.569 0 O-C-N 121.569 -0.707 . . . . 0.0 110.262 -179.268 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 17.6 pt-20 -60.99 142.19 56.75 Favored 'General case' 0 N--CA 1.491 1.595 0 CA-C-O 121.66 0.743 . . . . 0.0 110.716 -179.337 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 9' ' ' ASN . . . . . 0.528 ' CG ' ' H ' ' A' ' 10' ' ' GLU . 11.9 p-10 -85.51 -101.25 0.06 Allowed 'General case' 0 N--CA 1.49 1.557 0 O-C-N 121.596 -0.69 . . . . 0.0 110.321 -179.873 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 10' ' ' GLU . . . . . 0.528 ' H ' ' CG ' ' A' ' 9' ' ' ASN . 79.7 mm-40 -62.98 148.39 47.77 Favored 'General case' 0 N--CA 1.489 1.476 0 O-C-N 121.426 -0.796 . . . . 0.0 110.688 -178.719 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 64.1 t -94.77 128.1 46.24 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.553 0 O-C-N 121.615 -0.678 . . . . 0.0 109.353 -179.845 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 25.0 p -166.81 145.55 5.29 Favored 'General case' 0 N--CA 1.488 1.457 0 O-C-N 121.418 -0.801 . . . . 0.0 109.291 179.553 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 13' ' ' GLU . . . . . 0.555 ' N ' ' OE1' ' A' ' 13' ' ' GLU . 56.7 mp0 -92.27 122.54 34.84 Favored 'General case' 0 N--CA 1.49 1.573 0 O-C-N 121.37 -0.831 . . . . 0.0 109.846 -179.369 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -68.26 141.55 55.86 Favored 'General case' 0 N--CA 1.489 1.504 0 O-C-N 121.58 -0.7 . . . . 0.0 110.266 -179.583 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 71.6 m -146.95 -62.1 0.29 Allowed 'General case' 0 N--CA 1.491 1.587 0 O-C-N 121.562 -0.712 . . . . 0.0 109.178 179.715 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . -70.44 142.48 35.57 Favored Glycine 0 N--CA 1.491 2.307 0 N-CA-C 110.893 -0.883 . . . . 0.0 110.893 -179.192 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 1.6 p -67.54 -35.52 79.22 Favored 'General case' 0 N--CA 1.491 1.581 0 O-C-N 121.545 -0.974 . . . . 0.0 109.333 179.388 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -60.86 142.41 56.24 Favored 'General case' 0 N--CA 1.489 1.488 0 O-C-N 121.406 -0.809 . . . . 0.0 110.481 -178.876 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -84.1 2.63 87.45 Favored Glycine 0 N--CA 1.49 2.235 0 N-CA-C 109.232 -1.547 . . . . 0.0 109.232 179.759 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 79.0 mm-40 -56.36 132.78 51.98 Favored 'General case' 0 N--CA 1.49 1.558 0 O-C-N 121.349 -1.089 . . . . 0.0 109.953 -179.291 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 21' ' ' ILE . . . . . . . . . . . . . 91.0 mt -104.96 129.09 58.15 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.632 0 O-C-N 121.697 -0.627 . . . . 0.0 109.833 -179.896 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . -178.33 168.77 40.15 Favored Glycine 0 N--CA 1.485 1.916 0 N-CA-C 109.645 -1.382 . . . . 0.0 109.645 179.834 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 23' ' ' PHE . . . . . 0.423 ' O ' ' CD1' ' A' ' 23' ' ' PHE . 52.5 p90 -113.05 133.71 54.86 Favored 'General case' 0 N--CA 1.492 1.656 0 O-C-N 121.74 -0.859 . . . . 0.0 109.219 179.828 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 24' ' ' ILE . . . . . 0.44 HG23 ' N ' ' A' ' 25' ' ' ILE . 19.4 tt -130.32 -36.53 0.62 Allowed 'Isoleucine or valine' 0 N--CA 1.494 1.768 0 N-CA-C 108.761 -0.829 . . . . 0.0 108.761 179.715 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 25' ' ' ILE . . . . . 0.486 HG22 ' N ' ' A' ' 26' ' ' ARG . 94.1 mt 56.38 158.13 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.492 1.652 0 CA-C-O 121.503 0.668 . . . . 0.0 110.359 179.861 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 26' ' ' ARG . . . . . 0.486 ' N ' HG22 ' A' ' 25' ' ' ILE . 85.1 mtp180 -88.99 136.87 32.78 Favored 'General case' 0 N--CA 1.492 1.649 0 O-C-N 121.404 -0.81 . . . . 0.0 110.011 -179.178 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 96.4 mt-10 -80.59 144.67 32.22 Favored 'General case' 0 N--CA 1.49 1.554 0 O-C-N 121.542 -0.724 . . . . 0.0 110.741 -179.386 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . 173.03 -177.05 45.69 Favored Glycine 0 N--CA 1.486 2.032 0 N-CA-C 109.586 -1.405 . . . . 0.0 109.586 179.39 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 98.1 m-20 -72.02 -8.79 56.56 Favored 'General case' 0 C--N 1.304 -1.391 0 O-C-N 121.53 -0.982 . . . . 0.0 108.959 179.598 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 31.6 p30 -85.98 1.09 51.49 Favored 'General case' 0 N--CA 1.49 1.537 0 N-CA-C 108.774 -0.824 . . . . 0.0 108.774 179.789 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 53.5 t -126.02 133.7 68.31 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.864 0 N-CA-C 109.27 -0.641 . . . . 0.0 109.27 179.802 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -138.33 151.19 47.32 Favored 'General case' 0 N--CA 1.492 1.665 0 O-C-N 121.469 -0.769 . . . . 0.0 109.573 179.897 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 15.4 pt-20 -94.21 145.91 24.38 Favored 'General case' 0 N--CA 1.492 1.671 0 O-C-N 121.528 -0.733 . . . . 0.0 109.961 -179.552 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 34' ' ' VAL . . . . . . . . . . . . . 92.7 t -119.36 127.57 75.85 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.789 0 N-CA-C 108.64 -0.874 . . . . 0.0 108.64 179.893 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 26.1 t -117.36 128.0 54.61 Favored 'General case' 0 N--CA 1.494 1.736 0 N-CA-C 109.103 -0.703 . . . . 0.0 109.103 -179.829 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 36' ' ' LEU . . . . . 0.562 HD13 ' CZ ' ' A' ' 51' ' ' TYR . 55.1 tp -124.98 142.66 51.34 Favored 'General case' 0 N--CA 1.497 1.922 0 CA-C-O 121.381 0.61 . . . . 0.0 109.614 -179.996 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 37' ' ' PHE . . . . . . . . . . . . . 92.8 m-85 -104.69 147.01 28.14 Favored 'General case' 0 N--CA 1.493 1.723 0 O-C-N 121.685 -0.634 . . . . 0.0 109.818 179.992 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . -172.9 179.31 44.43 Favored Glycine 0 N--CA 1.488 2.128 0 N-CA-C 109.759 -1.336 . . . . 0.0 109.759 179.748 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 19.0 t -78.52 -99.27 0.02 OUTLIER 'General case' 0 N--CA 1.49 1.562 0 O-C-N 121.476 -1.014 . . . . 0.0 110.05 -179.809 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 40' ' ' ASP . . . . . . . . . . . . . 55.7 p-10 -85.59 175.44 8.78 Favored 'General case' 0 N--CA 1.49 1.573 0 O-C-N 121.424 -0.798 . . . . 0.0 110.453 -179.114 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 88.8 tttt -63.32 -41.96 98.95 Favored 'General case' 0 N--CA 1.491 1.581 0 O-C-N 121.528 -0.733 . . . . 0.0 109.196 179.905 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -53.5 -43.13 68.0 Favored 'General case' 0 N--CA 1.49 1.543 0 O-C-N 121.602 -0.686 . . . . 0.0 109.542 -179.65 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 43' ' ' HIS . . . . . . . . . . . . . 28.8 t-80 -63.21 -44.0 96.57 Favored 'General case' 0 N--CA 1.489 1.509 0 O-C-N 121.468 -0.77 . . . . 0.0 109.306 -179.851 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 84.5 mt -63.6 -39.87 95.48 Favored 'General case' 0 N--CA 1.491 1.575 0 O-C-N 121.52 -0.737 . . . . 0.0 109.306 179.982 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 97.1 mt-10 -59.65 -37.87 79.9 Favored 'General case' 0 N--CA 1.488 1.45 0 O-C-N 121.346 -0.846 . . . . 0.0 109.689 -179.782 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . -64.22 -52.01 47.82 Favored Glycine 0 N--CA 1.492 2.41 0 N-CA-C 109.588 -1.405 . . . . 0.0 109.588 -179.445 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 97.3 mttt -67.04 -32.61 73.92 Favored 'General case' 0 N--CA 1.49 1.54 0 O-C-N 121.395 -1.062 . . . . 0.0 109.376 179.299 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 48' ' ' LEU . . . . . 0.483 HD13 ' CD2' ' A' ' 76' ' ' LEU . 52.6 tp -58.07 -40.74 81.8 Favored 'General case' 0 C--N 1.301 -1.53 0 O-C-N 121.569 -0.707 . . . . 0.0 109.286 -179.341 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 49' ' ' ALA . . . . . . . . . . . . . . . -59.74 -39.43 84.71 Favored 'General case' 0 N--CA 1.488 1.468 0 O-C-N 121.395 -0.816 . . . . 0.0 109.442 -179.597 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 97.8 mt-10 -70.17 -39.21 75.41 Favored 'General case' 0 N--CA 1.49 1.565 0 O-C-N 121.452 -0.78 . . . . 0.0 109.616 179.797 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 51' ' ' TYR . . . . . 0.562 ' CZ ' HD13 ' A' ' 36' ' ' LEU . 4.4 m-85 -61.71 -48.61 79.99 Favored 'General case' 0 N--CA 1.492 1.627 0 O-C-N 121.361 -0.837 . . . . 0.0 109.547 -179.514 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 52' ' ' ILE . . . . . . . . . . . . . 95.4 mt -65.61 -44.45 93.71 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.444 0 O-C-N 121.346 -0.846 . . . . 0.0 109.359 -179.664 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 66.2 m -63.03 -42.07 99.69 Favored 'General case' 0 N--CA 1.488 1.465 0 O-C-N 121.557 -0.715 . . . . 0.0 109.637 -179.705 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 54' ' ' LEU . . . . . . . . . . . . . 56.0 tp -63.59 -42.25 98.28 Favored 'General case' 0 N--CA 1.489 1.48 0 O-C-N 121.497 -0.752 . . . . 0.0 109.329 -179.705 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -62.48 -41.4 98.76 Favored 'General case' 0 N--CA 1.489 1.505 0 O-C-N 121.523 -0.736 . . . . 0.0 109.477 -179.04 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 56' ' ' LYS . . . . . 0.479 ' O ' ' N ' ' A' ' 60' ' ' ALA . 97.8 mttt -64.93 -42.5 94.61 Favored 'General case' 0 C--N 1.302 -1.48 0 O-C-N 121.496 -0.752 . . . . 0.0 110.084 -179.797 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 58.4 tt0 -64.65 -42.03 95.71 Favored 'General case' 0 N--CA 1.49 1.534 0 O-C-N 121.118 -0.989 . . . . 0.0 109.314 -179.597 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 58' ' ' VAL . . . . . . . . . . . . . 71.6 t -68.46 -45.71 81.62 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.517 0 O-C-N 121.443 -0.785 . . . . 0.0 110.124 -179.834 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 59' ' ' TYR . . . . . 0.671 ' O ' ' HB3' ' A' ' 60' ' ' ALA . 53.8 t80 -110.39 -57.18 2.25 Favored 'General case' 0 N--CA 1.496 1.866 0 O-C-N 121.56 -0.713 . . . . 0.0 109.913 -178.818 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 60' ' ' ALA . . . . . 0.671 ' HB3' ' O ' ' A' ' 59' ' ' TYR . . . 82.98 145.22 0.07 Allowed 'General case' 0 N--CA 1.499 2.013 0 CA-C-O 121.27 0.557 . . . . 0.0 109.707 -179.757 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 61' ' ' ASN . . . . . . . . . . . . . 20.7 m-20 59.49 33.46 22.22 Favored 'General case' 0 N--CA 1.491 1.61 0 N-CA-C 108.534 -0.913 . . . . 0.0 108.534 -179.253 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 62' ' ' VAL . . . . . . . . . . . . . 9.9 p -90.97 152.82 3.29 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.655 0 O-C-N 121.577 -0.702 . . . . 0.0 110.343 -179.524 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 96.9 mt-10 -113.43 132.5 55.61 Favored 'General case' 0 N--CA 1.494 1.727 0 N-CA-C 108.892 -0.781 . . . . 0.0 108.892 179.556 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 64' ' ' TYR . . . . . . . . . . . . . 52.4 p90 -142.83 162.22 36.04 Favored 'General case' 0 N--CA 1.489 1.516 0 O-C-N 121.432 -0.792 . . . . 0.0 109.428 -179.58 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 79.6 mm-40 -138.53 157.72 45.63 Favored 'General case' 0 N--CA 1.49 1.526 0 O-C-N 121.53 -0.731 . . . . 0.0 109.041 -179.946 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 66' ' ' VAL . . . . . . . . . . . . . 3.3 p -125.5 132.47 70.92 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.696 0 CA-C-O 121.648 0.737 . . . . 0.0 109.478 -179.6 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 67' ' ' ALA . . . . . 0.542 ' HB1' ' HD2' ' A' ' 68' ' ' PRO . . . -86.27 170.5 12.48 Favored Pre-proline 0 N--CA 1.489 1.501 0 O-C-N 121.527 -0.733 . . . . 0.0 109.381 -179.719 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 68' ' ' PRO . . . . . 0.542 ' HD2' ' HB1' ' A' ' 67' ' ' ALA . 37.1 Cg_exo -54.73 132.38 51.35 Favored 'Trans proline' 0 N--CA 1.494 1.534 0 C-N-CA 122.171 1.914 . . . . 0.0 112.209 179.776 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 69' ' ' VAL . . . . . 0.446 HG21 HD12 ' A' ' 76' ' ' LEU . 55.0 t -130.51 133.29 63.89 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.792 0 CA-C-O 121.479 0.657 . . . . 0.0 109.599 179.664 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -74.07 156.0 37.9 Favored 'General case' 0 N--CA 1.487 1.425 0 CA-C-O 121.635 0.731 . . . . 0.0 110.529 -179.711 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 92.2 m-20 -62.47 -39.78 94.53 Favored 'General case' 0 N--CA 1.492 1.628 0 O-C-N 121.545 -0.722 . . . . 0.0 109.92 -179.94 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 72' ' ' ASN . . . . . . . . . . . . . 90.9 m-20 -95.38 16.14 17.62 Favored 'General case' 0 N--CA 1.495 1.79 0 O-C-N 121.345 -0.847 . . . . 0.0 109.404 -179.396 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -59.06 143.47 48.4 Favored 'General case' 0 N--CA 1.491 1.624 0 O-C-N 121.364 -0.835 . . . . 0.0 110.311 -179.321 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 74' ' ' THR . . . . . . . . . . . . . 61.2 p -105.44 -1.0 25.5 Favored 'General case' 0 N--CA 1.494 1.735 0 N-CA-C 108.876 -0.787 . . . . 0.0 108.876 179.708 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 95.9 mt-10 -138.99 158.34 44.38 Favored 'General case' 0 N--CA 1.493 1.703 0 O-C-N 121.475 -0.766 . . . . 0.0 109.596 -179.734 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 76' ' ' LEU . . . . . 0.483 ' CD2' HD13 ' A' ' 48' ' ' LEU . 6.2 tp -124.78 133.49 53.12 Favored 'General case' 0 N--CA 1.492 1.632 0 O-C-N 121.641 -0.662 . . . . 0.0 109.419 -179.912 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 77' ' ' HIS . . . . . . . . . . . . . 80.8 m80 -112.13 121.12 44.07 Favored 'General case' 0 N--CA 1.491 1.623 0 N-CA-C 109.085 -0.709 . . . . 0.0 109.085 179.556 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -147.1 160.69 42.11 Favored 'General case' 0 N--CA 1.489 1.522 0 O-C-N 121.239 -0.913 . . . . 0.0 109.12 -179.977 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 95.6 mtt180 -126.63 141.97 51.69 Favored 'General case' 0 N--CA 1.494 1.767 0 CA-C-O 121.593 0.711 . . . . 0.0 109.966 -179.715 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 80' ' ' PHE . . . . . . . . . . . . . 42.9 m-85 -128.66 148.53 50.82 Favored 'General case' 0 N--CA 1.493 1.676 0 N-CA-C 109.041 -0.725 . . . . 0.0 109.041 179.819 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 88.3 tttt -104.54 117.07 33.25 Favored 'General case' 0 N--CA 1.492 1.66 0 O-C-N 121.591 -0.693 . . . . 0.0 109.443 -179.757 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 82' ' ' PHE . . . . . . . . . . . . . 65.0 m-85 -112.68 141.78 46.06 Favored 'General case' 0 N--CA 1.494 1.748 0 CA-C-O 121.55 0.691 . . . . 0.0 109.854 -179.889 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 1.4 tm-20 -66.42 -34.19 77.39 Favored 'General case' 0 N--CA 1.488 1.444 0 N-CA-C 109.042 -0.725 . . . . 0.0 109.042 179.484 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 84' ' ' VAL . . . . . 0.448 HG23 ' H ' ' A' ' 87' ' ' GLU . 31.5 m -135.07 161.3 40.21 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.734 0 CA-C-O 121.607 0.717 . . . . 0.0 109.724 -179.784 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 25.0 m -75.67 -20.55 58.35 Favored 'General case' 0 N--CA 1.491 1.576 0 O-C-N 121.586 -0.696 . . . . 0.0 109.61 -179.903 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 86' ' ' ALA . . . . . . . . . . . . . . . -62.09 -39.38 92.25 Favored 'General case' 0 N--CA 1.494 1.726 0 O-C-N 121.333 -0.854 . . . . 0.0 109.633 -179.468 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 87' ' ' GLU . . . . . 0.448 ' H ' HG23 ' A' ' 84' ' ' VAL . 72.8 mm-40 -67.96 -32.28 72.6 Favored 'General case' 0 C--N 1.299 -1.594 0 O-C-N 121.604 -0.685 . . . . 0.0 109.163 -179.814 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 88' ' ' LYS . . . . . . . . . . . . . 4.6 tmtt? -64.36 -49.83 70.09 Favored 'General case' 0 N--CA 1.49 1.539 0 O-C-N 121.288 -0.882 . . . . 0.0 109.069 -179.712 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 17.9 mt -63.64 -44.84 92.68 Favored 'General case' 0 N--CA 1.489 1.519 0 O-C-N 121.276 -0.89 . . . . 0.0 109.662 -179.68 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 90' ' ' ILE . . . . . . . . . . . . . 97.3 mt -66.41 -43.89 90.93 Favored 'Isoleucine or valine' 0 C--N 1.301 -1.521 0 O-C-N 121.579 -0.701 . . . . 0.0 109.425 -179.745 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 91' ' ' PHE . . . . . 0.41 ' O ' HG23 ' A' ' 95' ' ' THR . 81.9 t80 -61.55 -44.93 96.14 Favored 'General case' 0 N--CA 1.49 1.572 0 O-C-N 121.574 -0.704 . . . . 0.0 109.441 -179.588 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 92' ' ' GLU . . . . . . . . . . . . . 80.5 tt0 -62.13 -46.1 90.5 Favored 'General case' 0 N--CA 1.49 1.573 0 O-C-N 121.524 -0.735 . . . . 0.0 109.583 -179.627 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 93' ' ' LEU . . . . . . . . . . . . . 85.3 mt -63.67 -43.44 96.7 Favored 'General case' 0 N--CA 1.491 1.613 0 O-C-N 121.341 -0.849 . . . . 0.0 109.831 -179.537 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 94' ' ' LYS . . . . . . . . . . . . . 55.7 mtpt -65.05 -40.96 95.49 Favored 'General case' 0 C--N 1.302 -1.457 0 O-C-N 121.328 -0.857 . . . . 0.0 109.691 179.863 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 95' ' ' THR . . . . . 0.41 HG23 ' O ' ' A' ' 91' ' ' PHE . 20.6 p -65.27 -35.79 82.1 Favored 'General case' 0 N--CA 1.488 1.471 0 O-C-N 121.385 -0.822 . . . . 0.0 109.493 -179.743 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 96' ' ' ARG . . . . . . . . . . . . . 24.4 mmt180 -63.46 -42.37 98.61 Favored 'General case' 0 C--N 1.3 -1.562 0 O-C-N 121.436 -0.79 . . . . 0.0 109.4 179.638 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 97' ' ' ALA . . . . . . . . . . . . . . . -67.42 -38.46 84.61 Favored 'General case' 0 C--N 1.3 -1.568 0 O-C-N 121.472 -0.767 . . . . 0.0 108.942 179.539 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 98' ' ' LEU . . . . . 0.501 HD13 ' O ' ' A' ' 98' ' ' LEU . 0.2 OUTLIER -63.4 -45.84 89.16 Favored 'General case' 0 C--N 1.304 -1.396 0 CA-C-O 121.805 0.812 . . . . 0.0 109.067 -179.446 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 99' ' ' ALA . . . . . . . . . . . . . . . -67.27 -37.21 83.1 Favored 'General case' 0 C--N 1.304 -1.409 0 O-C-N 121.497 -0.752 . . . . 0.0 109.644 -179.747 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 100' ' ' ARG . . . . . . . . . . . . . 83.9 mtp180 -80.82 -5.84 57.78 Favored 'General case' 0 N--CA 1.489 1.509 0 O-C-N 121.476 -0.765 . . . . 0.0 109.276 -179.639 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 101' ' ' LEU . . . . . . . . . . . . . 83.9 mt 44.43 75.92 0.09 Allowed 'General case' 0 N--CA 1.493 1.716 0 CA-C-O 121.939 0.876 . . . . 0.0 109.681 -179.659 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 102' ' ' GLU . . . . . . . . . . . . . 80.4 mm-40 -63.14 146.69 52.77 Favored 'General case' 0 N--CA 1.486 1.367 0 CA-C-O 121.575 0.703 . . . . 0.0 110.07 -179.626 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 103' ' ' HIS . . . . . . . . . . . . . 98.6 m-70 -90.56 101.99 14.73 Favored 'General case' 0 N--CA 1.488 1.471 0 O-C-N 121.571 -0.705 . . . . 0.0 109.405 -179.794 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 104' ' ' HIS . . . . . . . . . . . . . 53.9 p-80 -98.78 -12.16 21.15 Favored 'General case' 0 N--CA 1.495 1.806 0 CA-C-O 121.573 0.701 . . . . 0.0 109.118 -179.894 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 105' ' ' HIS . . . . . . . . . . . . . 99.6 m-70 50.52 -178.94 0.02 OUTLIER 'General case' 0 N--CA 1.492 1.661 0 CA-C-O 121.938 0.875 . . . . 0.0 111.416 179.419 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 106' ' ' HIS . . . . . . . . . . . . . 55.3 t-80 46.56 89.89 0.02 OUTLIER 'General case' 0 N--CA 1.488 1.434 0 CA-C-O 121.209 0.528 . . . . 0.0 109.82 -179.834 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 107' ' ' HIS . . . . . . . . . . . . . 63.8 t-80 -120.08 125.04 47.29 Favored 'General case' 0 N--CA 1.496 1.832 0 CA-C-O 121.641 0.734 . . . . 0.0 109.859 179.932 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 108' ' ' HIS . . . . . 0.496 ' CG ' ' O ' ' A' ' 108' ' ' HIS . 43.6 t-80 . . . . . 0 N--CA 1.49 1.541 0 CA-C-O 117.984 -1.008 . . . . 0.0 110.065 179.661 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 87.2 mmm . . . . . 0 N--CA 1.488 1.466 0 N-CA-C 108.927 -0.768 . . . . 0.0 108.927 . . . . . . . . . 0 0 . 1 . 018 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 66.6 m -135.0 144.69 47.51 Favored 'General case' 0 N--CA 1.494 1.771 0 O-C-N 121.424 -0.797 . . . . 0.0 109.634 179.847 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 3' ' ' ASN . . . . . 0.545 ' OD1' ' N ' ' A' ' 4' ' ' GLN . 38.4 p-10 -66.92 -40.36 87.63 Favored 'General case' 0 N--CA 1.49 1.572 0 O-C-N 121.533 -0.729 . . . . 0.0 110.195 -179.832 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 4' ' ' GLN . . . . . 0.545 ' N ' ' OD1' ' A' ' 3' ' ' ASN . 41.4 tt0 -107.61 151.77 25.18 Favored 'General case' 0 N--CA 1.495 1.782 0 O-C-N 121.495 -0.753 . . . . 0.0 109.992 -179.339 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 5' ' ' THR . . . . . 0.52 ' O ' ' N ' ' A' ' 7' ' ' VAL . 73.0 p -99.75 3.03 44.71 Favored 'General case' 0 N--CA 1.494 1.729 0 N-CA-C 109.124 -0.695 . . . . 0.0 109.124 179.784 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 6' ' ' CYS . . . . . 0.471 ' H ' ' HG2' ' A' ' 4' ' ' GLN . 26.6 p -58.87 80.81 0.01 OUTLIER 'General case' 0 N--CA 1.49 1.551 0 O-C-N 121.326 -0.858 . . . . 0.0 109.816 -179.636 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 7' ' ' VAL . . . . . 0.52 ' N ' ' O ' ' A' ' 5' ' ' THR . 7.1 p -95.8 -14.54 7.87 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.703 0 O-C-N 121.414 -0.804 . . . . 0.0 108.842 179.473 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 8' ' ' GLU . . . . . 0.404 ' CG ' ' H ' ' A' ' 9' ' ' ASN . 23.0 tp10 39.0 -131.64 0.2 Allowed 'General case' 0 N--CA 1.497 1.909 0 CA-C-O 121.684 0.754 . . . . 0.0 110.906 179.642 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 9' ' ' ASN . . . . . 0.404 ' H ' ' CG ' ' A' ' 8' ' ' GLU . 19.4 t-20 -89.77 108.34 19.64 Favored 'General case' 0 N--CA 1.486 1.356 0 O-C-N 121.343 -0.848 . . . . 0.0 109.718 -178.956 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 80.1 tt0 -162.88 121.8 2.14 Favored 'General case' 0 N--CA 1.488 1.451 0 O-C-N 121.328 -0.857 . . . . 0.0 109.17 179.788 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 11' ' ' VAL . . . . . 0.403 ' O ' HG23 ' A' ' 11' ' ' VAL . 33.7 m -85.5 129.18 38.35 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.687 0 O-C-N 121.487 -0.758 . . . . 0.0 109.597 -179.357 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 5.1 m -89.3 131.22 35.5 Favored 'General case' 0 N--CA 1.489 1.491 0 O-C-N 121.383 -0.823 . . . . 0.0 109.907 -179.2 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 48.1 tp10 -159.51 108.63 1.84 Allowed 'General case' 0 C--N 1.305 -1.351 0 O-C-N 121.325 -0.859 . . . . 0.0 108.939 179.044 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 14' ' ' ALA . . . . . 0.556 ' O ' ' N ' ' A' ' 16' ' ' GLY . . . -178.38 0.03 0.01 OUTLIER 'General case' 0 C--N 1.302 -1.465 0 N-CA-C 108.054 -1.091 . . . . 0.0 108.054 179.765 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 15' ' ' CYS . . . . . 0.42 ' H ' ' H ' ' A' ' 14' ' ' ALA . 67.4 m 51.05 -84.69 0.01 OUTLIER 'General case' 0 N--CA 1.495 1.807 0 CA-C-O 121.416 0.627 . . . . 0.0 110.096 179.847 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 16' ' ' GLY . . . . . 0.556 ' N ' ' O ' ' A' ' 14' ' ' ALA . . . -159.84 -146.79 4.69 Favored Glycine 0 N--CA 1.485 1.951 0 N-CA-C 109.826 -1.309 . . . . 0.0 109.826 -179.483 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 13.8 p -76.6 146.78 38.04 Favored 'General case' 0 N--CA 1.49 1.556 0 O-C-N 121.472 -1.017 . . . . 0.0 110.532 -179.332 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -63.38 144.64 56.79 Favored 'General case' 0 N--CA 1.49 1.57 0 CA-C-O 121.67 0.748 . . . . 0.0 110.565 -179.275 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -154.33 -131.43 1.52 Allowed Glycine 0 N--CA 1.492 2.403 0 N-CA-C 109.689 -1.364 . . . . 0.0 109.689 -179.863 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 17.4 pt-20 -82.44 -5.26 58.57 Favored 'General case' 0 N--CA 1.491 1.583 0 O-C-N 121.546 -0.973 . . . . 0.0 109.586 -179.878 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 21' ' ' ILE . . . . . . . . . . . . . 35.2 mm -66.32 -42.82 91.38 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.568 0 O-C-N 121.232 -0.917 . . . . 0.0 109.463 179.859 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . -149.1 -151.94 5.6 Favored Glycine 0 N--CA 1.493 2.488 0 C-N-CA 119.847 -1.168 . . . . 0.0 110.346 -179.24 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 23' ' ' PHE . . . . . . . . . . . . . 92.2 m-85 -77.35 140.36 39.95 Favored 'General case' 0 N--CA 1.49 1.554 0 O-C-N 121.294 -1.121 . . . . 0.0 110.332 -179.309 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 40.8 pt -87.58 -14.88 9.75 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.61 0 O-C-N 121.529 -0.732 . . . . 0.0 109.64 179.766 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 25' ' ' ILE . . . . . . . . . . . . . 96.6 mt -77.84 -69.97 0.38 Allowed 'Isoleucine or valine' 0 N--CA 1.487 1.41 0 O-C-N 121.276 -0.89 . . . . 0.0 110.232 -179.086 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 72.4 ttt180 43.7 78.83 0.05 OUTLIER 'General case' 0 N--CA 1.498 1.953 0 CA-C-O 121.938 0.875 . . . . 0.0 110.042 -179.374 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 76.6 tt0 53.91 61.01 3.27 Favored 'General case' 0 N--CA 1.49 1.569 0 CA-C-O 121.693 0.759 . . . . 0.0 109.325 179.877 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . -95.18 110.65 4.06 Favored Glycine 0 N--CA 1.494 2.523 0 N-CA-C 109.682 -1.367 . . . . 0.0 109.682 179.941 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 29' ' ' ASP . . . . . 0.435 ' O ' ' O ' ' A' ' 30' ' ' ASP . 44.7 t0 40.29 71.55 0.18 Allowed 'General case' 0 N--CA 1.496 1.835 0 O-C-N 121.741 -0.858 . . . . 0.0 110.685 179.873 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 30' ' ' ASP . . . . . 0.435 ' O ' ' O ' ' A' ' 29' ' ' ASP . 26.2 t0 55.8 117.87 0.01 OUTLIER 'General case' 0 N--CA 1.495 1.792 0 CA-C-O 121.713 0.768 . . . . 0.0 110.716 179.503 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 31' ' ' VAL . . . . . 0.441 HG12 ' N ' ' A' ' 32' ' ' ALA . 20.4 t -125.69 160.98 31.42 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.768 0 O-C-N 121.601 -0.687 . . . . 0.0 109.728 -179.97 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 32' ' ' ALA . . . . . 0.608 ' CB ' ' HZ2' ' A' ' 88' ' ' LYS . . . -128.64 148.61 50.82 Favored 'General case' 0 N--CA 1.495 1.822 0 O-C-N 121.567 -0.708 . . . . 0.0 110.088 -179.555 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 81.1 tt0 -104.24 135.57 45.47 Favored 'General case' 0 N--CA 1.491 1.589 0 O-C-N 121.62 -0.675 . . . . 0.0 109.404 -179.894 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 34' ' ' VAL . . . . . . . . . . . . . 56.0 t -124.98 130.7 73.18 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.816 0 O-C-N 121.617 -0.677 . . . . 0.0 109.188 179.765 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 72.4 m -133.28 121.7 22.81 Favored 'General case' 0 N--CA 1.491 1.588 0 N-CA-C 109.006 -0.739 . . . . 0.0 109.006 179.527 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 50.3 tp -122.03 137.65 54.73 Favored 'General case' 0 N--CA 1.496 1.833 0 CA-C-O 121.416 0.627 . . . . 0.0 109.36 -179.986 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 37' ' ' PHE . . . . . . . . . . . . . 97.0 m-85 -102.92 148.02 26.19 Favored 'General case' 0 N--CA 1.492 1.65 0 O-C-N 121.51 -0.744 . . . . 0.0 109.443 -179.863 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . -170.05 -172.14 36.25 Favored Glycine 0 N--CA 1.49 2.251 0 N-CA-C 109.923 -1.271 . . . . 0.0 109.923 -179.78 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 39' ' ' SER . . . . . 0.505 ' OG ' ' N ' ' A' ' 40' ' ' ASP . 91.9 p -106.55 -82.71 0.54 Allowed 'General case' 0 N--CA 1.497 1.885 0 O-C-N 121.331 -1.1 . . . . 0.0 109.942 -179.774 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 40' ' ' ASP . . . . . 0.505 ' N ' ' OG ' ' A' ' 39' ' ' SER . 30.6 t70 -83.9 161.18 20.93 Favored 'General case' 0 N--CA 1.492 1.639 0 O-C-N 121.248 -0.907 . . . . 0.0 110.773 -179.018 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 65.7 tttm -64.72 -37.05 86.27 Favored 'General case' 0 N--CA 1.492 1.63 0 O-C-N 121.512 -0.742 . . . . 0.0 109.969 179.59 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -56.36 -40.52 74.65 Favored 'General case' 0 N--CA 1.492 1.646 0 O-C-N 121.284 -0.885 . . . . 0.0 110.016 -179.202 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 43' ' ' HIS . . . . . . . . . . . . . 68.2 m80 -66.63 -41.36 88.42 Favored 'General case' 0 N--CA 1.49 1.56 0 O-C-N 121.208 -0.932 . . . . 0.0 109.686 -179.921 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 89.0 mt -63.95 -41.56 97.56 Favored 'General case' 0 N--CA 1.494 1.774 0 O-C-N 121.308 -0.87 . . . . 0.0 109.556 179.944 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 80.6 mm-40 -61.47 -42.06 98.2 Favored 'General case' 0 C--N 1.302 -1.492 0 O-C-N 121.347 -0.845 . . . . 0.0 109.432 -179.696 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . -63.05 -50.76 60.68 Favored Glycine 0 N--CA 1.492 2.414 0 N-CA-C 109.691 -1.363 . . . . 0.0 109.691 -179.655 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 64.7 mttp -65.64 -35.98 82.36 Favored 'General case' 0 N--CA 1.492 1.665 0 O-C-N 121.348 -1.09 . . . . 0.0 109.415 179.545 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 48' ' ' LEU . . . . . 0.501 HD13 ' CD2' ' A' ' 76' ' ' LEU . 53.8 tp -59.6 -38.68 81.88 Favored 'General case' 0 N--CA 1.493 1.714 0 O-C-N 121.538 -0.726 . . . . 0.0 109.498 -179.259 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 49' ' ' ALA . . . . . . . . . . . . . . . -53.15 -32.59 48.44 Favored 'General case' 0 N--CA 1.49 1.556 0 O-C-N 121.177 -0.952 . . . . 0.0 109.789 -179.434 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 73.6 mm-40 -65.31 -40.11 93.33 Favored 'General case' 0 N--CA 1.492 1.645 0 O-C-N 121.203 -0.936 . . . . 0.0 109.423 -179.882 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 51' ' ' TYR . . . . . 0.494 ' CE2' ' CG2' ' A' ' 95' ' ' THR . 31.6 m-85 -62.92 -41.68 99.54 Favored 'General case' 0 N--CA 1.49 1.573 0 O-C-N 121.326 -0.859 . . . . 0.0 109.931 -179.758 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 52' ' ' ILE . . . . . 0.473 HD12 ' CZ ' ' A' ' 64' ' ' TYR . 34.6 mm -63.98 -44.95 98.01 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.641 0 O-C-N 121.14 -0.975 . . . . 0.0 109.482 -179.35 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 76.1 p -65.81 -44.61 85.11 Favored 'General case' 0 N--CA 1.491 1.611 0 O-C-N 121.166 -0.959 . . . . 0.0 110.153 -179.706 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 54' ' ' LEU . . . . . . . . . . . . . 85.2 mt -65.43 -42.23 92.68 Favored 'General case' 0 N--CA 1.493 1.703 0 O-C-N 121.24 -0.913 . . . . 0.0 109.943 -179.636 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -61.16 -49.76 75.92 Favored 'General case' 0 N--CA 1.492 1.648 0 O-C-N 121.408 -0.808 . . . . 0.0 110.702 -178.893 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 56' ' ' LYS . . . . . . . . . . . . . 98.5 mttt -65.11 -43.87 90.58 Favored 'General case' 0 N--CA 1.492 1.627 0 O-C-N 121.188 -0.945 . . . . 0.0 110.056 -179.361 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 59.2 tt0 -65.94 -47.21 75.43 Favored 'General case' 0 N--CA 1.491 1.597 0 O-C-N 121.334 -0.854 . . . . 0.0 109.328 -179.9 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 58' ' ' VAL . . . . . . . . . . . . . 54.6 t -64.97 -45.42 94.73 Favored 'Isoleucine or valine' 0 C--N 1.302 -1.492 0 O-C-N 121.45 -0.781 . . . . 0.0 109.94 -179.926 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 59' ' ' TYR . . . . . . . . . . . . . 54.9 t80 -131.91 124.04 28.66 Favored 'General case' 0 N--CA 1.498 1.964 0 O-C-N 121.365 -0.834 . . . . 0.0 110.042 -179.204 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 60' ' ' ALA . . . . . 0.42 ' O ' ' OD1' ' A' ' 61' ' ' ASN . . . -66.43 148.38 51.96 Favored 'General case' 0 N--CA 1.491 1.59 0 O-C-N 121.688 -0.633 . . . . 0.0 110.902 -179.601 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 61' ' ' ASN . . . . . 0.42 ' OD1' ' O ' ' A' ' 60' ' ' ALA . 7.6 p-10 44.61 52.65 7.59 Favored 'General case' 0 N--CA 1.496 1.829 0 CA-C-O 121.717 0.77 . . . . 0.0 109.425 179.722 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 62' ' ' VAL . . . . . . . . . . . . . 15.0 p -79.09 140.22 17.18 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.499 0 O-C-N 121.635 -0.666 . . . . 0.0 109.911 -179.776 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 96.7 mt-10 -110.1 132.47 54.13 Favored 'General case' 0 N--CA 1.494 1.756 0 CA-C-O 121.58 0.705 . . . . 0.0 109.563 -179.57 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 64' ' ' TYR . . . . . 0.473 ' CZ ' HD12 ' A' ' 52' ' ' ILE . 53.0 p90 -147.99 164.53 33.49 Favored 'General case' 0 N--CA 1.489 1.476 0 O-C-N 121.378 -0.826 . . . . 0.0 109.52 -179.847 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 95.7 mt-10 -139.31 151.95 46.83 Favored 'General case' 0 N--CA 1.492 1.626 0 O-C-N 121.451 -0.781 . . . . 0.0 109.273 179.893 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 66' ' ' VAL . . . . . . . . . . . . . 3.1 p -123.91 130.55 73.84 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.768 0 CA-C-O 121.537 0.684 . . . . 0.0 109.657 -179.493 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 67' ' ' ALA . . . . . 0.609 ' HB1' ' HD2' ' A' ' 68' ' ' PRO . . . -76.7 172.35 9.87 Favored Pre-proline 0 C--N 1.303 -1.448 0 O-C-N 121.683 -0.636 . . . . 0.0 109.68 -179.85 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 68' ' ' PRO . . . . . 0.609 ' HD2' ' HB1' ' A' ' 67' ' ' ALA . 52.5 Cg_exo -54.8 139.07 77.85 Favored 'Trans proline' 0 N--CA 1.498 1.781 0 C-N-CA 122.57 2.18 . . . . 0.0 112.427 179.934 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 69' ' ' VAL . . . . . . . . . . . . . 60.1 t -128.96 132.32 67.46 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.924 0 O-C-N 121.593 -0.692 . . . . 0.0 109.572 179.702 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -87.02 163.49 17.02 Favored 'General case' 0 N--CA 1.489 1.503 0 O-C-N 121.413 -0.804 . . . . 0.0 109.881 -179.968 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 75.4 m-20 -63.25 -40.86 98.6 Favored 'General case' 0 N--CA 1.491 1.59 0 O-C-N 121.385 -0.822 . . . . 0.0 109.543 -179.917 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 72' ' ' ASN . . . . . . . . . . . . . 98.8 m-20 -99.31 19.35 15.62 Favored 'General case' 0 N--CA 1.493 1.71 0 O-C-N 121.423 -0.798 . . . . 0.0 109.372 -179.289 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -54.18 139.35 35.89 Favored 'General case' 0 N--CA 1.491 1.614 0 O-C-N 121.252 -0.905 . . . . 0.0 110.05 -179.279 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 74' ' ' THR . . . . . . . . . . . . . 81.6 p -107.78 -0.98 21.33 Favored 'General case' 0 N--CA 1.494 1.735 0 N-CA-C 108.879 -0.786 . . . . 0.0 108.879 179.6 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 17.3 pt-20 -141.99 160.04 41.02 Favored 'General case' 0 N--CA 1.495 1.813 0 O-C-N 121.208 -0.933 . . . . 0.0 109.34 179.327 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 76' ' ' LEU . . . . . 0.501 ' CD2' HD13 ' A' ' 48' ' ' LEU . 6.6 tp -130.02 130.43 44.96 Favored 'General case' 0 N--CA 1.492 1.657 0 N-CA-C 109.054 -0.721 . . . . 0.0 109.054 179.617 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 77' ' ' HIS . . . . . . . . . . . . . 59.0 t-80 -114.53 113.71 24.79 Favored 'General case' 0 N--CA 1.493 1.676 0 N-CA-C 109.043 -0.725 . . . . 0.0 109.043 179.912 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -135.95 159.37 41.88 Favored 'General case' 0 N--CA 1.493 1.698 0 O-C-N 121.427 -0.796 . . . . 0.0 109.328 -179.778 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 15.9 tpp180 -127.86 141.2 51.62 Favored 'General case' 0 N--CA 1.492 1.641 0 N-CA-C 109.243 -0.651 . . . . 0.0 109.243 -179.764 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 80' ' ' PHE . . . . . . . . . . . . . 52.8 m-85 -126.08 146.62 49.85 Favored 'General case' 0 N--CA 1.494 1.728 0 CA-C-O 121.448 0.642 . . . . 0.0 109.414 -179.883 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 3.3 ttmp? -109.35 127.58 54.44 Favored 'General case' 0 N--CA 1.49 1.53 0 O-C-N 121.753 -0.592 . . . . 0.0 109.551 -179.772 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 82' ' ' PHE . . . . . . . . . . . . . 70.5 m-85 -125.02 147.03 49.15 Favored 'General case' 0 N--CA 1.491 1.616 0 CA-C-O 121.531 0.681 . . . . 0.0 109.607 -179.75 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 83.9 tt0 -67.45 -37.14 82.51 Favored 'General case' 0 C--N 1.302 -1.498 0 O-C-N 121.525 -0.734 . . . . 0.0 109.738 -179.909 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 84' ' ' VAL . . . . . . . . . . . . . 30.1 m -137.02 162.5 34.12 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.876 0 O-C-N 121.258 -0.901 . . . . 0.0 110.467 -179.306 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 74.9 p -69.97 -16.05 63.13 Favored 'General case' 0 N--CA 1.49 1.555 0 O-C-N 121.783 -0.573 . . . . 0.0 110.036 179.747 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 86' ' ' ALA . . . . . . . . . . . . . . . -62.78 -40.85 98.57 Favored 'General case' 0 N--CA 1.495 1.825 0 O-C-N 121.108 -0.995 . . . . 0.0 109.735 -179.623 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 87' ' ' GLU . . . . . 0.53 ' OE1' ' N ' ' A' ' 87' ' ' GLU . 4.9 mp0 -70.2 -30.48 67.6 Favored 'General case' 0 N--CA 1.491 1.624 0 O-C-N 121.411 -0.806 . . . . 0.0 108.848 179.883 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 88' ' ' LYS . . . . . 0.608 ' HZ2' ' CB ' ' A' ' 32' ' ' ALA . 64.6 tttp -62.62 -47.49 83.53 Favored 'General case' 0 C--N 1.3 -1.567 0 O-C-N 121.221 -0.924 . . . . 0.0 109.314 -179.956 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 48.3 tp -64.71 -47.45 78.25 Favored 'General case' 0 N--CA 1.49 1.55 0 O-C-N 121.312 -0.867 . . . . 0.0 109.857 -179.38 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 90' ' ' ILE . . . . . . . . . . . . . 97.0 mt -66.58 -45.07 89.54 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.734 0 O-C-N 121.236 -0.915 . . . . 0.0 109.674 -179.533 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 91' ' ' PHE . . . . . . . . . . . . . 91.2 t80 -64.45 -45.35 87.83 Favored 'General case' 0 N--CA 1.491 1.588 0 O-C-N 121.581 -0.7 . . . . 0.0 110.021 -179.587 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 92' ' ' GLU . . . . . . . . . . . . . 47.1 tp10 -66.25 -37.37 85.34 Favored 'General case' 0 N--CA 1.49 1.544 0 O-C-N 121.334 -0.854 . . . . 0.0 109.63 -179.225 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 93' ' ' LEU . . . . . . . . . . . . . 6.2 tt -62.73 -44.26 96.66 Favored 'General case' 0 C--N 1.3 -1.561 0 O-C-N 121.219 -0.925 . . . . 0.0 109.819 -179.582 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 94' ' ' LYS . . . . . . . . . . . . . 68.0 mttm -65.29 -42.88 92.67 Favored 'General case' 0 N--CA 1.491 1.588 0 O-C-N 121.334 -0.853 . . . . 0.0 110.238 -179.633 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 95' ' ' THR . . . . . 0.494 ' CG2' ' CE2' ' A' ' 51' ' ' TYR . 19.7 p -65.2 -44.23 89.03 Favored 'General case' 0 N--CA 1.492 1.657 0 O-C-N 121.39 -0.819 . . . . 0.0 110.367 -179.048 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 96' ' ' ARG . . . . . 0.45 HH21 ' NH1' ' A' ' 100' ' ' ARG . 83.3 mtp180 -64.4 -39.53 94.03 Favored 'General case' 0 N--CA 1.491 1.597 0 O-C-N 121.176 -0.953 . . . . 0.0 109.659 -179.796 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 97' ' ' ALA . . . . . . . . . . . . . . . -61.65 -49.23 77.36 Favored 'General case' 0 N--CA 1.49 1.545 0 O-C-N 121.291 -0.88 . . . . 0.0 109.911 -179.687 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 98' ' ' LEU . . . . . . . . . . . . . 93.8 mt -65.48 -42.82 91.78 Favored 'General case' 0 N--CA 1.493 1.684 0 O-C-N 121.324 -0.86 . . . . 0.0 109.623 -179.831 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 99' ' ' ALA . . . . . . . . . . . . . . . -66.55 -37.53 85.17 Favored 'General case' 0 N--CA 1.491 1.576 0 O-C-N 121.416 -0.802 . . . . 0.0 109.673 -179.697 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 100' ' ' ARG . . . . . 0.45 ' NH1' HH21 ' A' ' 96' ' ' ARG . 96.6 mtt180 -90.96 1.89 56.68 Favored 'General case' 0 N--CA 1.492 1.63 0 N-CA-C 108.691 -0.855 . . . . 0.0 108.691 -179.769 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 101' ' ' LEU . . . . . . . . . . . . . 85.4 mt 58.29 179.98 0.07 Allowed 'General case' 0 N--CA 1.497 1.921 0 CA-C-O 121.733 0.777 . . . . 0.0 111.022 179.431 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 102' ' ' GLU . . . . . . . . . . . . . 12.7 pt-20 -172.21 134.84 0.73 Allowed 'General case' 0 N--CA 1.488 1.462 0 O-C-N 121.533 -0.729 . . . . 0.0 109.613 -179.908 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 103' ' ' HIS . . . . . . . . . . . . . 80.5 t60 -69.05 130.16 41.97 Favored 'General case' 0 N--CA 1.489 1.514 0 O-C-N 121.536 -0.728 . . . . 0.0 110.298 -179.051 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 104' ' ' HIS . . . . . . . . . . . . . 81.8 t60 -148.86 138.54 21.95 Favored 'General case' 0 N--CA 1.49 1.572 0 O-C-N 121.214 -0.929 . . . . 0.0 109.606 179.681 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 105' ' ' HIS . . . . . . . . . . . . . 80.5 m80 -87.47 120.09 28.42 Favored 'General case' 0 N--CA 1.489 1.48 0 O-C-N 121.395 -0.816 . . . . 0.0 109.786 -179.783 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 106' ' ' HIS . . . . . . . . . . . . . 85.1 t60 -66.16 -40.63 90.68 Favored 'General case' 0 N--CA 1.488 1.439 0 O-C-N 121.462 -0.774 . . . . 0.0 109.39 179.751 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 107' ' ' HIS . . . . . . . . . . . . . 81.9 t60 45.1 87.48 0.02 OUTLIER 'General case' 0 N--CA 1.492 1.631 0 CA-C-O 121.727 0.775 . . . . 0.0 109.883 -179.625 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 108' ' ' HIS . . . . . . . . . . . . . 58.9 t-80 . . . . . 0 N--CA 1.489 1.51 0 CA-C-O 117.998 -1.001 . . . . 0.0 109.959 -179.96 . . . . . . . . 0 0 . 1 . 019 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 85.0 mmm . . . . . 0 N--CA 1.489 1.476 0 N-CA-C 109.143 -0.688 . . . . 0.0 109.143 . . . . . . . . . 0 0 . 1 . 019 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 19.5 m -71.09 146.15 49.42 Favored 'General case' 0 N--CA 1.492 1.633 0 O-C-N 121.443 -0.786 . . . . 0.0 110.142 -179.804 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 3' ' ' ASN . . . . . . . . . . . . . 25.2 t-20 -92.29 107.08 18.95 Favored 'General case' 0 N--CA 1.492 1.625 0 O-C-N 121.422 -0.799 . . . . 0.0 109.831 -179.745 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 99.6 mm-40 -84.86 -81.26 0.19 Allowed 'General case' 0 N--CA 1.49 1.571 0 O-C-N 121.525 -0.735 . . . . 0.0 109.777 179.946 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 68.9 p -82.64 163.22 21.55 Favored 'General case' 0 N--CA 1.494 1.745 0 O-C-N 121.409 -0.807 . . . . 0.0 110.606 -179.102 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 8.1 t -83.52 114.96 21.86 Favored 'General case' 0 N--CA 1.49 1.535 0 CA-C-O 121.808 0.813 . . . . 0.0 109.844 -179.763 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 7' ' ' VAL . . . . . . . . . . . . . 70.9 t -66.73 -43.25 90.14 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.675 0 O-C-N 121.56 -0.712 . . . . 0.0 109.583 179.701 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 96.3 mt-10 -65.91 142.22 57.97 Favored 'General case' 0 N--CA 1.493 1.678 0 O-C-N 121.218 -0.926 . . . . 0.0 110.547 -179.032 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 52.1 p-10 -87.55 -3.35 58.99 Favored 'General case' 0 N--CA 1.49 1.568 0 O-C-N 121.421 -0.8 . . . . 0.0 109.271 179.863 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 52.8 tp10 -87.22 119.01 27.01 Favored 'General case' 0 N--CA 1.49 1.571 0 O-C-N 121.244 -0.91 . . . . 0.0 109.593 -179.821 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 9.0 p -153.3 -21.57 0.06 OUTLIER 'Isoleucine or valine' 0 N--CA 1.49 1.555 0 N-CA-C 108.694 -0.854 . . . . 0.0 108.694 179.728 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 35.1 m -89.98 107.73 19.29 Favored 'General case' 0 N--CA 1.494 1.761 0 O-C-N 121.38 -0.825 . . . . 0.0 109.777 -179.68 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 43.7 tt0 -174.07 -42.22 0.01 OUTLIER 'General case' 0 N--CA 1.49 1.571 0 N-CA-C 108.594 -0.891 . . . . 0.0 108.594 179.98 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 14' ' ' ALA . . . . . 0.555 ' O ' ' N ' ' A' ' 16' ' ' GLY . . . -176.7 147.48 0.63 Allowed 'General case' 0 N--CA 1.493 1.696 0 O-C-N 121.185 -0.947 . . . . 0.0 110.012 179.723 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 63.2 m 44.61 -88.1 0.01 OUTLIER 'General case' 0 N--CA 1.496 1.831 0 CA-C-O 121.426 0.631 . . . . 0.0 110.054 -179.715 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 16' ' ' GLY . . . . . 0.555 ' N ' ' O ' ' A' ' 14' ' ' ALA . . . 81.17 16.31 74.72 Favored Glycine 0 N--CA 1.492 2.402 0 N-CA-C 109.833 -1.307 . . . . 0.0 109.833 -179.917 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 1.2 p -65.42 -35.57 81.33 Favored 'General case' 0 N--CA 1.493 1.706 0 O-C-N 121.218 -1.166 . . . . 0.0 109.473 179.828 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . 52.03 16.92 0.59 Allowed 'General case' 0 N--CA 1.493 1.72 0 O-C-N 121.349 -0.844 . . . . 0.0 109.729 -179.588 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -177.1 139.53 4.44 Favored Glycine 0 N--CA 1.492 2.401 0 C-N-CA 119.937 -1.125 . . . . 0.0 110.393 179.608 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 79.6 tt0 58.32 101.5 0.02 OUTLIER 'General case' 0 N--CA 1.499 1.983 0 O-C-N 121.666 -0.902 . . . . 0.0 110.505 179.654 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 21' ' ' ILE . . . . . 0.408 HG23 ' O ' ' A' ' 21' ' ' ILE . 9.3 tp -89.28 130.99 37.71 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.501 0 O-C-N 121.243 -0.91 . . . . 0.0 110.412 -179.648 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 176.86 -172.76 45.72 Favored Glycine 0 N--CA 1.489 2.209 0 N-CA-C 109.962 -1.255 . . . . 0.0 109.962 179.467 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 23' ' ' PHE . . . . . . . . . . . . . 65.2 m-85 -110.54 132.19 54.4 Favored 'General case' 0 N--CA 1.498 1.957 0 O-C-N 121.508 -0.995 . . . . 0.0 109.469 -179.978 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 35.3 mm -66.23 -43.29 91.88 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.628 0 O-C-N 121.525 -0.734 . . . . 0.0 109.758 -179.751 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 25' ' ' ILE . . . . . 0.415 HG22 ' N ' ' A' ' 26' ' ' ARG . 90.0 mt -92.87 -91.85 0.08 OUTLIER 'Isoleucine or valine' 0 N--CA 1.497 1.916 0 O-C-N 120.894 -1.129 . . . . 0.0 110.277 -179.507 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 26' ' ' ARG . . . . . 0.415 ' N ' HG22 ' A' ' 25' ' ' ILE . 79.0 ttt-85 46.27 81.22 0.04 OUTLIER 'General case' 0 N--CA 1.49 1.554 0 CA-C-O 121.8 0.81 . . . . 0.0 109.774 -179.118 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 79.4 mm-40 -139.73 -164.35 1.67 Allowed 'General case' 0 N--CA 1.493 1.715 0 O-C-N 121.489 -0.757 . . . . 0.0 109.574 179.92 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . -154.56 -39.72 0.02 OUTLIER Glycine 0 N--CA 1.49 2.28 0 N-CA-C 109.133 -1.587 . . . . 0.0 109.133 -179.663 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 59.0 t0 -63.71 -50.76 67.91 Favored 'General case' 0 N--CA 1.496 1.874 0 O-C-N 121.349 -1.089 . . . . 0.0 110.233 -179.936 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 88.4 m-20 -98.8 1.12 45.61 Favored 'General case' 0 N--CA 1.497 1.9 0 O-C-N 121.016 -1.053 . . . . 0.0 109.03 179.725 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 52.0 t -124.61 134.77 65.9 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.934 0 O-C-N 121.482 -0.761 . . . . 0.0 109.324 -179.946 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -110.14 154.93 22.62 Favored 'General case' 0 N--CA 1.495 1.805 0 CA-C-O 121.695 0.76 . . . . 0.0 109.515 -179.946 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 95.8 mt-10 -87.68 126.48 34.99 Favored 'General case' 0 N--CA 1.489 1.518 0 CA-C-O 121.585 0.707 . . . . 0.0 109.653 -179.621 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 34' ' ' VAL . . . . . . . . . . . . . 53.7 t -124.99 134.99 65.52 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.712 0 CA-C-O 121.748 0.785 . . . . 0.0 109.198 -179.626 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 6.0 p -134.81 140.49 45.91 Favored 'General case' 0 N--CA 1.491 1.58 0 N-CA-C 108.89 -0.781 . . . . 0.0 108.89 179.878 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 36' ' ' LEU . . . . . 0.64 HD13 ' N ' ' A' ' 37' ' ' PHE . 0.2 OUTLIER -121.0 124.04 43.89 Favored 'General case' 0 N--CA 1.494 1.761 0 CA-C-O 121.709 0.766 . . . . 0.0 109.131 -179.662 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 37' ' ' PHE . . . . . 0.64 ' N ' HD13 ' A' ' 36' ' ' LEU . 92.5 m-85 -99.79 146.02 27.05 Favored 'General case' 0 N--CA 1.492 1.656 0 O-C-N 121.506 -0.746 . . . . 0.0 109.777 179.872 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . -178.84 -169.31 39.3 Favored Glycine 0 N--CA 1.489 2.171 0 N-CA-C 109.837 -1.305 . . . . 0.0 109.837 -179.975 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 39' ' ' SER . . . . . 0.494 ' OG ' ' N ' ' A' ' 40' ' ' ASP . 3.0 t -82.23 -99.37 0.04 OUTLIER 'General case' 0 N--CA 1.491 1.606 0 O-C-N 121.634 -0.921 . . . . 0.0 109.91 -179.939 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 40' ' ' ASP . . . . . 0.494 ' N ' ' OG ' ' A' ' 39' ' ' SER . 97.4 m-20 -83.6 178.03 8.15 Favored 'General case' 0 N--CA 1.495 1.811 0 O-C-N 121.165 -0.959 . . . . 0.0 110.696 -179.464 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 87.9 tttt -63.62 -33.14 74.95 Favored 'General case' 0 N--CA 1.493 1.676 0 CA-C-O 121.404 0.621 . . . . 0.0 110.092 -179.795 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -60.53 -38.59 84.94 Favored 'General case' 0 N--CA 1.492 1.663 0 O-C-N 121.161 -0.962 . . . . 0.0 109.725 -179.533 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 43' ' ' HIS . . . . . . . . . . . . . 83.6 m-70 -68.43 -37.38 80.23 Favored 'General case' 0 N--CA 1.492 1.671 0 O-C-N 121.313 -0.867 . . . . 0.0 109.931 179.868 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 97.0 mt -63.61 -42.23 98.23 Favored 'General case' 0 N--CA 1.493 1.724 0 O-C-N 121.514 -0.741 . . . . 0.0 110.27 -178.953 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 98.0 mt-10 -69.69 -38.53 77.03 Favored 'General case' 0 C--N 1.299 -1.607 0 O-C-N 121.205 -0.934 . . . . 0.0 109.637 -179.852 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 46' ' ' GLY . . . . . 0.441 ' O ' ' OE1' ' A' ' 50' ' ' GLU . . . -62.78 -40.85 99.73 Favored Glycine 0 N--CA 1.493 2.435 0 N-CA-C 110.178 -1.169 . . . . 0.0 110.178 -179.644 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 56.7 mtpt -81.29 -21.75 39.1 Favored 'General case' 0 N--CA 1.489 1.485 0 O-C-N 121.365 -1.08 . . . . 0.0 109.316 179.905 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 57.6 tp -65.89 -38.15 88.0 Favored 'General case' 0 N--CA 1.492 1.668 0 O-C-N 121.542 -0.724 . . . . 0.0 109.787 179.838 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 49' ' ' ALA . . . . . . . . . . . . . . . -56.96 -34.74 68.35 Favored 'General case' 0 N--CA 1.493 1.725 0 O-C-N 121.359 -0.838 . . . . 0.0 109.861 -179.179 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 50' ' ' GLU . . . . . 0.564 ' OE1' ' N ' ' A' ' 50' ' ' GLU . 51.8 mp0 -67.28 -40.78 86.19 Favored 'General case' 0 C--N 1.299 -1.609 0 O-C-N 121.348 -0.845 . . . . 0.0 109.549 -179.909 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 51' ' ' TYR . . . . . 0.416 ' CZ ' ' CD2' ' A' ' 36' ' ' LEU . 3.9 m-85 -60.24 -42.83 96.12 Favored 'General case' 0 N--CA 1.492 1.665 0 O-C-N 121.407 -0.808 . . . . 0.0 109.821 -179.642 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 52' ' ' ILE . . . . . . . . . . . . . 95.7 mt -64.13 -42.67 96.3 Favored 'Isoleucine or valine' 0 C--N 1.298 -1.653 0 O-C-N 121.361 -0.837 . . . . 0.0 109.613 -179.676 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 48.4 m -52.92 -51.74 60.23 Favored 'General case' 0 N--CA 1.493 1.695 0 O-C-N 121.364 -0.835 . . . . 0.0 110.012 -178.951 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 54' ' ' LEU . . . . . 0.48 HD12 ' HD3' ' A' ' 94' ' ' LYS . 4.2 mm? -65.31 -40.74 94.14 Favored 'General case' 0 N--CA 1.493 1.713 0 O-C-N 121.255 -0.903 . . . . 0.0 110.076 179.807 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -64.73 -38.37 90.77 Favored 'General case' 0 C--N 1.3 -1.563 0 O-C-N 121.373 -0.83 . . . . 0.0 110.08 -179.336 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 56' ' ' LYS . . . . . . . . . . . . . 45.4 tttp -63.77 -42.74 97.72 Favored 'General case' 0 N--CA 1.489 1.521 0 O-C-N 121.283 -0.886 . . . . 0.0 109.68 -179.683 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 77.0 mt-30 -65.75 -43.71 88.13 Favored 'General case' 0 N--CA 1.494 1.745 0 O-C-N 121.37 -0.831 . . . . 0.0 109.687 -179.765 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 58' ' ' VAL . . . . . . . . . . . . . 79.7 t -65.33 -44.74 94.7 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.675 0 O-C-N 121.383 -0.823 . . . . 0.0 109.518 -179.948 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 59' ' ' TYR . . . . . 0.425 ' O ' ' O ' ' A' ' 60' ' ' ALA . 62.6 t80 -126.66 133.14 51.04 Favored 'General case' 0 N--CA 1.497 1.902 0 CA-C-O 121.866 0.841 . . . . 0.0 109.406 -179.793 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 60' ' ' ALA . . . . . 0.425 ' O ' ' O ' ' A' ' 59' ' ' TYR . . . -44.43 -100.01 0.0 OUTLIER 'General case' 0 N--CA 1.493 1.679 0 CA-C-O 121.645 0.736 . . . . 0.0 111.129 -179.229 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 61' ' ' ASN . . . . . . . . . . . . . 96.1 m-20 -87.11 90.29 8.3 Favored 'General case' 0 N--CA 1.491 1.59 0 O-C-N 121.334 -0.854 . . . . 0.0 109.351 -179.051 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 62' ' ' VAL . . . . . . . . . . . . . 11.0 p -80.15 136.68 22.93 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.552 0 O-C-N 121.571 -0.706 . . . . 0.0 109.768 -179.978 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 84.8 tt0 -113.64 138.39 50.26 Favored 'General case' 0 N--CA 1.495 1.784 0 CA-C-O 121.623 0.725 . . . . 0.0 109.178 -179.854 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 64' ' ' TYR . . . . . . . . . . . . . 50.7 p90 -148.36 162.64 39.14 Favored 'General case' 0 N--CA 1.491 1.614 0 O-C-N 121.413 -0.804 . . . . 0.0 109.962 -179.499 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 49.3 tp10 -139.69 145.73 38.75 Favored 'General case' 0 N--CA 1.493 1.686 0 N-CA-C 108.789 -0.819 . . . . 0.0 108.789 179.623 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 66' ' ' VAL . . . . . . . . . . . . . 27.2 m -115.52 128.03 72.88 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.764 0 CA-C-O 121.768 0.795 . . . . 0.0 110.018 -179.26 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 67' ' ' ALA . . . . . 0.652 ' HB1' ' HD2' ' A' ' 68' ' ' PRO . . . -80.15 171.82 11.41 Favored Pre-proline 0 N--CA 1.488 1.446 0 N-CA-C 109.569 -0.53 . . . . 0.0 109.569 -179.85 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 68' ' ' PRO . . . . . 0.652 ' HD2' ' HB1' ' A' ' 67' ' ' ALA . 51.0 Cg_exo -51.68 129.5 30.11 Favored 'Trans proline' 0 N--CA 1.494 1.54 0 C-N-CA 122.428 2.085 . . . . 0.0 112.309 179.624 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 69' ' ' VAL . . . . . 0.406 HG21 HD12 ' A' ' 76' ' ' LEU . 51.0 t -131.51 134.1 61.05 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.794 0 CA-C-O 121.803 0.811 . . . . 0.0 109.899 179.911 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -73.01 153.07 41.05 Favored 'General case' 0 N--CA 1.49 1.541 0 CA-C-O 121.735 0.779 . . . . 0.0 110.335 -179.992 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 64.6 t0 -63.6 -36.1 82.7 Favored 'General case' 0 N--CA 1.49 1.563 0 CA-C-O 121.591 0.71 . . . . 0.0 109.322 179.308 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 72' ' ' ASN . . . . . . . . . . . . . 56.5 p30 -95.43 19.1 11.39 Favored 'General case' 0 N--CA 1.493 1.709 0 O-C-N 121.266 -0.897 . . . . 0.0 108.722 179.849 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -64.26 143.86 57.57 Favored 'General case' 0 N--CA 1.49 1.538 0 O-C-N 121.435 -0.791 . . . . 0.0 110.358 -179.715 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 74' ' ' THR . . . . . . . . . . . . . 6.3 p -106.18 -0.62 24.45 Favored 'General case' 0 N--CA 1.492 1.673 0 N-CA-C 108.589 -0.893 . . . . 0.0 108.589 179.268 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 80.9 tt0 -141.74 154.42 45.26 Favored 'General case' 0 N--CA 1.494 1.746 0 O-C-N 121.222 -0.924 . . . . 0.0 109.379 179.884 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 76' ' ' LEU . . . . . 0.406 HD12 HG21 ' A' ' 69' ' ' VAL . 6.7 tp -117.03 131.89 56.83 Favored 'General case' 0 N--CA 1.493 1.699 0 O-C-N 121.569 -0.707 . . . . 0.0 109.512 -179.814 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 77' ' ' HIS . . . . . . . . . . . . . 1.0 OUTLIER -105.66 108.33 19.79 Favored 'General case' 0 N--CA 1.493 1.703 0 N-CA-C 109.062 -0.718 . . . . 0.0 109.062 179.846 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -147.01 159.35 43.68 Favored 'General case' 0 N--CA 1.492 1.653 0 O-C-N 121.353 -0.842 . . . . 0.0 109.596 -179.413 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 89.7 mtm-85 -131.8 148.95 52.59 Favored 'General case' 0 N--CA 1.496 1.846 0 O-C-N 121.639 -0.663 . . . . 0.0 109.356 -179.917 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 80' ' ' PHE . . . . . . . . . . . . . 28.3 m-85 -121.61 147.43 45.86 Favored 'General case' 0 N--CA 1.5 2.049 0 CA-C-O 121.669 0.747 . . . . 0.0 109.599 -179.802 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 64.2 tttp -109.26 114.02 27.35 Favored 'General case' 0 N--CA 1.491 1.618 0 CA-C-O 121.732 0.777 . . . . 0.0 109.37 179.903 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 82' ' ' PHE . . . . . . . . . . . . . 82.7 m-85 -100.98 -109.25 0.22 Allowed 'General case' 0 N--CA 1.494 1.725 0 CA-C-O 121.635 0.731 . . . . 0.0 109.561 -179.973 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 47.3 tp10 -168.78 -37.96 0.02 OUTLIER 'General case' 0 N--CA 1.489 1.493 0 N-CA-C 108.539 -0.912 . . . . 0.0 108.539 179.926 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 84' ' ' VAL . . . . . 0.426 HG23 ' H ' ' A' ' 87' ' ' GLU . 27.3 m -133.77 161.94 40.24 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.909 0 O-C-N 121.471 -0.768 . . . . 0.0 109.63 -179.998 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 15.5 m -72.9 -19.63 61.24 Favored 'General case' 0 N--CA 1.491 1.597 0 O-C-N 121.464 -0.773 . . . . 0.0 109.274 179.825 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 86' ' ' ALA . . . . . . . . . . . . . . . -63.43 -39.52 94.7 Favored 'General case' 0 N--CA 1.492 1.634 0 O-C-N 121.215 -0.928 . . . . 0.0 109.714 -179.98 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 87' ' ' GLU . . . . . 0.426 ' H ' HG23 ' A' ' 84' ' ' VAL . 97.0 mt-10 -71.01 -32.26 69.01 Favored 'General case' 0 N--CA 1.493 1.691 0 O-C-N 121.334 -0.854 . . . . 0.0 109.37 179.731 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 88' ' ' LYS . . . . . . . . . . . . . 14.4 tmtt? -62.18 -48.01 81.97 Favored 'General case' 0 C--N 1.302 -1.49 0 O-C-N 121.33 -0.856 . . . . 0.0 110.013 -179.803 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 94.0 mt -64.97 -42.94 94.12 Favored 'General case' 0 N--CA 1.492 1.659 0 O-C-N 121.338 -0.851 . . . . 0.0 109.372 -179.68 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 90' ' ' ILE . . . . . . . . . . . . . 95.1 mt -65.36 -45.45 93.19 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.645 0 CA-C-O 121.737 0.779 . . . . 0.0 109.512 -179.91 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 91' ' ' PHE . . . . . . . . . . . . . 80.9 t80 -66.0 -44.07 85.9 Favored 'General case' 0 N--CA 1.49 1.568 0 CA-C-O 121.724 0.773 . . . . 0.0 109.845 -179.909 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 92' ' ' GLU . . . . . . . . . . . . . 48.4 tp10 -59.97 -38.7 83.28 Favored 'General case' 0 N--CA 1.491 1.61 0 O-C-N 121.445 -0.785 . . . . 0.0 109.469 -179.163 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 93' ' ' LEU . . . . . . . . . . . . . 5.5 tt -63.53 -44.35 94.48 Favored 'General case' 0 C--N 1.297 -1.679 0 O-C-N 121.38 -0.825 . . . . 0.0 109.865 179.974 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 94' ' ' LYS . . . . . 0.48 ' HD3' HD12 ' A' ' 54' ' ' LEU . 62.5 mttp -65.7 -41.64 92.13 Favored 'General case' 0 N--CA 1.492 1.674 0 O-C-N 121.433 -0.792 . . . . 0.0 109.77 -179.878 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 23.4 p -66.59 -38.6 87.38 Favored 'General case' 0 N--CA 1.493 1.688 0 O-C-N 121.315 -0.866 . . . . 0.0 109.653 -179.782 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 96' ' ' ARG . . . . . . . . . . . . . 25.1 mmt180 -65.14 -40.97 95.13 Favored 'General case' 0 N--CA 1.492 1.663 0 O-C-N 121.227 -0.921 . . . . 0.0 109.935 179.739 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 97' ' ' ALA . . . . . 0.496 ' O ' ' N ' ' A' ' 101' ' ' LEU . . . -63.39 -48.56 77.38 Favored 'General case' 0 C--N 1.3 -1.578 0 O-C-N 121.323 -0.861 . . . . 0.0 109.839 -179.688 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 98' ' ' LEU . . . . . . . . . . . . . 95.6 mt -64.89 -42.68 94.59 Favored 'General case' 0 N--CA 1.493 1.682 0 O-C-N 121.496 -0.752 . . . . 0.0 109.796 -179.845 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 99' ' ' ALA . . . . . . . . . . . . . . . -67.57 -40.04 84.88 Favored 'General case' 0 N--CA 1.492 1.654 0 O-C-N 121.313 -0.867 . . . . 0.0 109.859 -179.873 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 100' ' ' ARG . . . . . . . . . . . . . 85.9 mmt-85 -90.67 -6.46 54.49 Favored 'General case' 0 N--CA 1.495 1.786 0 CA-C-O 121.889 0.852 . . . . 0.0 109.067 -179.539 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 101' ' ' LEU . . . . . 0.496 ' N ' ' O ' ' A' ' 97' ' ' ALA . 5.9 tp 59.34 153.69 0.02 OUTLIER 'General case' 0 C--N 1.296 -1.726 0 CA-C-O 121.794 0.807 . . . . 0.0 110.604 179.507 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 102' ' ' GLU . . . . . 0.441 ' O ' ' O ' ' A' ' 101' ' ' LEU . 79.8 mm-40 -43.23 167.99 0.0 OUTLIER 'General case' 0 N--CA 1.49 1.54 0 CA-C-O 121.728 0.775 . . . . 0.0 110.357 179.979 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 103' ' ' HIS . . . . . . . . . . . . . 21.2 m170 58.77 13.37 2.66 Favored 'General case' 0 N--CA 1.491 1.594 0 N-CA-C 108.889 -0.782 . . . . 0.0 108.889 -179.491 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 104' ' ' HIS . . . . . . . . . . . . . 92.8 m-70 44.79 55.15 6.19 Favored 'General case' 0 N--CA 1.493 1.72 0 O-C-N 121.413 -0.804 . . . . 0.0 109.918 179.887 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 105' ' ' HIS . . . . . . . . . . . . . 86.3 t60 42.21 89.68 0.01 OUTLIER 'General case' 0 N--CA 1.494 1.77 0 CA-C-O 121.644 0.735 . . . . 0.0 110.035 179.732 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 106' ' ' HIS . . . . . . . . . . . . . 56.8 p-80 -69.04 139.12 54.89 Favored 'General case' 0 N--CA 1.489 1.488 0 CA-C-O 121.789 0.804 . . . . 0.0 110.301 -179.431 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 107' ' ' HIS . . . . . . . . . . . . . 80.3 m80 -77.32 140.72 40.06 Favored 'General case' 0 N--CA 1.489 1.48 0 CA-C-O 121.686 0.755 . . . . 0.0 110.228 -179.392 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 108' ' ' HIS . . . . . . . . . . . . . 86.4 t60 . . . . . 0 N--CA 1.492 1.639 0 CA-C-O 117.91 -1.043 . . . . 0.0 110.45 -179.645 . . . . . . . . 0 0 . 1 . 020 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 78.1 mtm . . . . . 0 N--CA 1.489 1.504 0 CA-C-O 121.588 0.708 . . . . 0.0 109.738 . . . . . . . . . 0 0 . 1 . 020 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 4.6 t 57.03 57.43 4.61 Favored 'General case' 0 N--CA 1.492 1.665 0 CA-C-O 121.869 0.842 . . . . 0.0 109.402 179.99 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 3' ' ' ASN . . . . . . . . . . . . . 92.5 m-20 -85.61 107.44 17.52 Favored 'General case' 0 N--CA 1.494 1.751 0 O-C-N 121.39 -0.819 . . . . 0.0 109.629 179.998 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 99.4 mm-40 -84.04 -122.47 0.03 OUTLIER 'General case' 0 N--CA 1.491 1.622 0 O-C-N 121.387 -0.821 . . . . 0.0 110.083 -179.683 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 5' ' ' THR . . . . . 0.404 ' O ' ' O ' ' A' ' 6' ' ' CYS . 80.3 m -97.77 -17.15 19.54 Favored 'General case' 0 N--CA 1.494 1.734 0 O-C-N 121.351 -0.843 . . . . 0.0 109.488 -179.765 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 6' ' ' CYS . . . . . 0.404 ' O ' ' O ' ' A' ' 5' ' ' THR . 5.1 m 60.86 121.51 0.01 OUTLIER 'General case' 0 N--CA 1.494 1.755 0 O-C-N 121.377 -0.827 . . . . 0.0 110.141 179.953 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 7' ' ' VAL . . . . . . . . . . . . . 2.1 p -100.19 131.08 48.37 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.832 0 CA-C-O 121.86 0.838 . . . . 0.0 109.977 -179.359 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 8' ' ' GLU . . . . . 0.505 ' O ' ' ND2' ' A' ' 9' ' ' ASN . 15.7 pt-20 -70.2 145.76 51.21 Favored 'General case' 0 N--CA 1.492 1.63 0 CA-C-O 121.734 0.778 . . . . 0.0 110.715 -179.413 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 9' ' ' ASN . . . . . 0.505 ' ND2' ' O ' ' A' ' 8' ' ' GLU . 0.8 OUTLIER 43.65 34.89 0.9 Allowed 'General case' 0 N--CA 1.492 1.648 0 CA-C-O 122.01 0.91 . . . . 0.0 109.049 -179.859 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 97.2 mt-10 43.14 -166.54 0.01 OUTLIER 'General case' 0 N--CA 1.489 1.504 0 CA-C-O 121.717 0.77 . . . . 0.0 110.438 -179.97 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 11' ' ' VAL . . . . . 0.433 ' O ' HG12 ' A' ' 11' ' ' VAL . 46.2 t -77.58 -1.87 4.21 Favored 'Isoleucine or valine' 0 C--N 1.299 -1.595 0 O-C-N 121.38 -0.825 . . . . 0.0 109.009 -179.854 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 42.2 t 46.17 40.61 7.59 Favored 'General case' 0 N--CA 1.493 1.725 0 CA-C-O 121.848 0.832 . . . . 0.0 109.498 179.93 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 13' ' ' GLU . . . . . 0.424 ' CD ' ' N ' ' A' ' 14' ' ' ALA . 12.8 tm-20 -64.08 139.77 58.8 Favored 'General case' 0 N--CA 1.489 1.495 0 O-C-N 121.436 -0.79 . . . . 0.0 110.012 -179.905 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 14' ' ' ALA . . . . . 0.424 ' N ' ' CD ' ' A' ' 13' ' ' GLU . . . -159.83 2.21 0.08 Allowed 'General case' 0 C--N 1.3 -1.573 0 N-CA-C 108.645 -0.872 . . . . 0.0 108.645 179.763 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 97.1 m -66.79 -39.1 87.67 Favored 'General case' 0 N--CA 1.496 1.831 0 O-C-N 121.281 -0.887 . . . . 0.0 109.468 179.876 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . -71.31 141.42 32.46 Favored Glycine 0 N--CA 1.493 2.467 0 N-CA-C 110.399 -1.08 . . . . 0.0 110.399 -179.337 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 76.2 m -129.21 153.77 47.43 Favored 'General case' 0 N--CA 1.496 1.87 0 O-C-N 121.454 -1.027 . . . . 0.0 110.257 -179.921 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . 59.6 146.99 0.01 OUTLIER 'General case' 0 N--CA 1.493 1.678 0 CA-C-O 121.646 0.736 . . . . 0.0 110.652 179.589 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 169.86 -161.63 34.93 Favored Glycine 0 N--CA 1.489 2.202 0 C-N-CA 119.947 -1.121 . . . . 0.0 110.556 -179.967 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 20' ' ' GLU . . . . . 0.517 ' OE1' ' N ' ' A' ' 22' ' ' GLY . 2.6 pp20? -52.47 145.18 11.92 Favored 'General case' 0 N--CA 1.493 1.717 0 O-C-N 121.698 -0.884 . . . . 0.0 110.935 -179.092 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 21' ' ' ILE . . . . . . . . . . . . . 90.7 mt -65.11 -42.94 95.67 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.56 0 CA-C-O 121.683 0.754 . . . . 0.0 109.194 179.635 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 22' ' ' GLY . . . . . 0.517 ' N ' ' OE1' ' A' ' 20' ' ' GLU . . . 83.57 -150.99 27.48 Favored Glycine 0 N--CA 1.486 2.005 0 N-CA-C 110.545 -1.022 . . . . 0.0 110.545 179.512 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 23' ' ' PHE . . . . . . . . . . . . . 93.0 m-85 -72.63 151.5 42.27 Favored 'General case' 0 C--N 1.299 -1.624 0 O-C-N 121.697 -0.884 . . . . 0.0 110.093 -179.282 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 97.1 mt -63.48 -42.63 96.91 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.55 0 CA-C-O 121.682 0.753 . . . . 0.0 109.672 179.819 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 25' ' ' ILE . . . . . . . . . . . . . 65.2 mt -63.43 -42.26 95.63 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.651 0 O-C-N 121.293 -0.88 . . . . 0.0 109.556 -179.487 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 26' ' ' ARG . . . . . 0.411 ' O ' ' O ' ' A' ' 27' ' ' GLU . 33.1 ttm180 61.48 59.41 1.88 Allowed 'General case' 0 C--N 1.304 -1.388 0 CA-C-O 121.813 0.816 . . . . 0.0 109.585 -179.909 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 27' ' ' GLU . . . . . 0.411 ' O ' ' O ' ' A' ' 26' ' ' ARG . 82.9 tt0 39.98 93.48 0.01 OUTLIER 'General case' 0 N--CA 1.495 1.798 0 CA-C-O 121.771 0.796 . . . . 0.0 110.374 179.711 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 28' ' ' GLY . . . . . 0.521 ' O ' ' N ' ' A' ' 30' ' ' ASP . . . -84.91 49.2 4.2 Favored Glycine 0 N--CA 1.492 2.38 0 N-CA-C 109.712 -1.355 . . . . 0.0 109.712 -179.818 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 4.0 p-10 41.85 21.91 0.01 OUTLIER 'General case' 0 N--CA 1.497 1.924 0 O-C-N 121.722 -0.869 . . . . 0.0 110.0 179.804 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 30' ' ' ASP . . . . . 0.521 ' N ' ' O ' ' A' ' 28' ' ' GLY . 51.1 p30 -159.83 43.83 0.22 Allowed 'General case' 0 C--N 1.301 -1.501 0 O-C-N 121.336 -0.853 . . . . 0.0 109.18 179.692 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 52.6 t -122.7 135.83 61.48 Favored 'Isoleucine or valine' 0 N--CA 1.502 2.142 0 O-C-N 121.403 -0.811 . . . . 0.0 109.775 -179.609 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -113.83 151.73 31.67 Favored 'General case' 0 N--CA 1.496 1.856 0 CA-C-O 121.42 0.629 . . . . 0.0 109.601 -179.967 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 40.3 tt0 -109.04 145.62 35.29 Favored 'General case' 0 N--CA 1.496 1.867 0 CA-C-O 121.499 0.666 . . . . 0.0 110.266 -179.312 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 34' ' ' VAL . . . . . . . . . . . . . 55.5 t -124.46 131.95 72.03 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.887 0 CA-C-O 121.487 0.661 . . . . 0.0 109.435 179.96 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 56.8 m -108.33 121.83 45.72 Favored 'General case' 0 N--CA 1.496 1.836 0 N-CA-C 109.264 -0.643 . . . . 0.0 109.264 179.542 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 36' ' ' LEU . . . . . 0.445 HD13 ' CZ ' ' A' ' 51' ' ' TYR . 49.5 tp -121.98 135.77 54.88 Favored 'General case' 0 N--CA 1.495 1.793 0 CA-C-O 121.595 0.712 . . . . 0.0 109.656 179.856 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 37' ' ' PHE . . . . . . . . . . . . . 86.1 t80 -113.17 138.12 50.43 Favored 'General case' 0 N--CA 1.494 1.73 0 CA-C-O 121.578 0.704 . . . . 0.0 109.69 -179.851 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 38' ' ' GLY . . . . . 0.45 ' N ' HD21 ' A' ' 44' ' ' LEU . . . -169.11 -170.51 33.79 Favored Glycine 0 N--CA 1.489 2.189 0 N-CA-C 110.15 -1.18 . . . . 0.0 110.15 -179.849 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 32.8 p -82.36 -108.9 0.03 OUTLIER 'General case' 0 N--CA 1.491 1.585 0 O-C-N 121.677 -0.896 . . . . 0.0 110.104 -179.69 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 40' ' ' ASP . . . . . . . . . . . . . 99.4 m-20 -81.05 175.13 10.94 Favored 'General case' 0 N--CA 1.493 1.72 0 O-C-N 121.192 -0.943 . . . . 0.0 110.698 -179.352 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 88.6 tttt -62.71 -41.98 99.42 Favored 'General case' 0 N--CA 1.491 1.624 0 CA-C-O 121.527 0.679 . . . . 0.0 109.966 -179.892 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -54.01 -46.29 71.73 Favored 'General case' 0 N--CA 1.492 1.662 0 O-C-N 121.394 -0.816 . . . . 0.0 109.796 -179.451 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 43' ' ' HIS . . . . . 0.669 ' CE1' ' HZ3' ' A' ' 47' ' ' LYS . 82.9 t60 -66.67 -42.65 86.24 Favored 'General case' 0 N--CA 1.493 1.682 0 O-C-N 121.283 -0.885 . . . . 0.0 109.72 179.829 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 44' ' ' LEU . . . . . 0.45 HD21 ' N ' ' A' ' 38' ' ' GLY . 37.0 mt -63.29 -41.26 98.97 Favored 'General case' 0 N--CA 1.496 1.851 0 O-C-N 121.333 -0.855 . . . . 0.0 109.877 -179.94 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 66.0 mm-40 -62.46 -38.23 88.97 Favored 'General case' 0 N--CA 1.49 1.565 0 O-C-N 121.439 -0.788 . . . . 0.0 109.623 -179.775 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . -59.3 -53.91 42.27 Favored Glycine 0 N--CA 1.494 2.504 0 N-CA-C 109.519 -1.432 . . . . 0.0 109.519 -179.884 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 47' ' ' LYS . . . . . 0.669 ' HZ3' ' CE1' ' A' ' 43' ' ' HIS . 47.6 mttp -66.47 -37.63 85.54 Favored 'General case' 0 N--CA 1.493 1.683 0 O-C-N 121.456 -1.026 . . . . 0.0 109.605 179.02 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 49.0 tp -51.84 -34.07 38.85 Favored 'General case' 0 N--CA 1.494 1.746 0 CA-C-O 121.657 0.742 . . . . 0.0 109.681 -179.373 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 49' ' ' ALA . . . . . . . . . . . . . . . -56.37 -34.46 66.67 Favored 'General case' 0 N--CA 1.491 1.612 0 O-C-N 121.354 -0.841 . . . . 0.0 109.635 -179.698 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 80.5 mm-40 -66.46 -43.16 86.26 Favored 'General case' 0 N--CA 1.495 1.79 0 O-C-N 121.259 -0.9 . . . . 0.0 109.974 -179.923 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 51' ' ' TYR . . . . . 0.445 ' CZ ' HD13 ' A' ' 36' ' ' LEU . 64.0 m-85 -64.1 -44.53 92.02 Favored 'General case' 0 N--CA 1.495 1.816 0 O-C-N 121.325 -0.859 . . . . 0.0 109.872 -179.727 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 52' ' ' ILE . . . . . . . . . . . . . 96.4 mt -65.18 -43.75 95.45 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.732 0 O-C-N 121.287 -0.883 . . . . 0.0 109.677 -179.987 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 60.9 m -61.86 -41.14 97.48 Favored 'General case' 0 N--CA 1.493 1.697 0 O-C-N 121.293 -0.879 . . . . 0.0 109.729 -179.844 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 54' ' ' LEU . . . . . . . . . . . . . 46.6 tp -63.79 -40.98 97.97 Favored 'General case' 0 N--CA 1.491 1.605 0 O-C-N 121.248 -0.907 . . . . 0.0 109.643 -179.988 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -60.12 -40.65 90.46 Favored 'General case' 0 N--CA 1.491 1.604 0 O-C-N 121.378 -0.826 . . . . 0.0 109.392 -179.355 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 56' ' ' LYS . . . . . . . . . . . . . 98.4 mttt -65.19 -41.52 94.48 Favored 'General case' 0 N--CA 1.491 1.582 0 O-C-N 121.456 -0.777 . . . . 0.0 109.551 179.587 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 67.5 tp60 -65.21 -46.33 81.12 Favored 'General case' 0 N--CA 1.493 1.709 0 O-C-N 121.32 -0.862 . . . . 0.0 109.919 -179.399 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 58' ' ' VAL . . . . . . . . . . . . . 88.0 t -65.23 -43.87 95.25 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.572 0 O-C-N 121.199 -0.938 . . . . 0.0 109.118 -179.979 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 59' ' ' TYR . . . . . . . . . . . . . 45.1 t80 -138.54 117.99 12.9 Favored 'General case' 0 N--CA 1.496 1.865 0 O-C-N 121.433 -0.792 . . . . 0.0 109.545 -179.806 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -69.39 149.11 48.73 Favored 'General case' 0 N--CA 1.492 1.64 0 CA-C-O 121.714 0.768 . . . . 0.0 110.625 -179.615 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 61' ' ' ASN . . . . . . . . . . . . . 8.8 t-20 60.09 39.35 19.76 Favored 'General case' 0 N--CA 1.491 1.613 0 CA-C-O 121.779 0.8 . . . . 0.0 109.472 179.806 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 62' ' ' VAL . . . . . . . . . . . . . 14.1 p -76.67 139.15 19.3 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.762 0 O-C-N 121.438 -0.789 . . . . 0.0 110.523 -179.967 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 96.0 mt-10 -106.05 136.09 46.34 Favored 'General case' 0 N--CA 1.497 1.891 0 CA-C-O 121.756 0.789 . . . . 0.0 109.594 179.944 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 64' ' ' TYR . . . . . . . . . . . . . 50.4 p90 -151.03 162.98 39.82 Favored 'General case' 0 N--CA 1.49 1.54 0 O-C-N 121.458 -0.776 . . . . 0.0 109.681 -179.478 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 79.8 mm-40 -139.5 152.45 46.97 Favored 'General case' 0 N--CA 1.495 1.78 0 O-C-N 121.408 -0.808 . . . . 0.0 109.643 179.853 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 66' ' ' VAL . . . . . . . . . . . . . 53.8 t -113.44 129.87 68.45 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.75 0 CA-C-O 121.718 0.771 . . . . 0.0 109.218 -179.679 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 67' ' ' ALA . . . . . 0.454 ' HB1' ' HD2' ' A' ' 68' ' ' PRO . . . -77.06 168.88 24.37 Favored Pre-proline 0 C--N 1.302 -1.486 0 O-C-N 121.727 -0.608 . . . . 0.0 109.766 -179.55 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 68' ' ' PRO . . . . . 0.454 ' HD2' ' HB1' ' A' ' 67' ' ' ALA . 27.8 Cg_exo -59.04 143.25 99.88 Favored 'Trans proline' 0 N--CA 1.493 1.483 0 C-N-CA 122.371 2.047 . . . . 0.0 112.354 179.557 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 69' ' ' VAL . . . . . 0.51 ' C ' ' H ' ' A' ' 71' ' ' ASP . 47.2 t -120.99 132.58 70.12 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.74 0 CA-C-O 121.676 0.751 . . . . 0.0 109.589 -179.856 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 70' ' ' ALA . . . . . 0.62 ' O ' ' N ' ' A' ' 72' ' ' ASN . . . -74.42 30.49 0.08 Allowed 'General case' 0 N--CA 1.491 1.602 0 O-C-N 121.576 -0.703 . . . . 0.0 109.453 179.861 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 71' ' ' ASP . . . . . 0.51 ' H ' ' C ' ' A' ' 69' ' ' VAL . 25.0 t0 55.6 -71.74 0.01 OUTLIER 'General case' 0 N--CA 1.493 1.7 0 CA-C-O 121.625 0.726 . . . . 0.0 110.728 179.658 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 72' ' ' ASN . . . . . 0.62 ' N ' ' O ' ' A' ' 70' ' ' ALA . 64.3 t30 -75.51 -2.15 27.58 Favored 'General case' 0 C--N 1.299 -1.628 0 O-C-N 121.299 -0.876 . . . . 0.0 109.429 -179.723 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -43.95 146.84 0.55 Allowed 'General case' 0 N--CA 1.496 1.843 0 O-C-N 121.306 -0.871 . . . . 0.0 110.125 179.974 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 74' ' ' THR . . . . . . . . . . . . . 5.0 p -96.74 0.15 49.09 Favored 'General case' 0 N--CA 1.492 1.658 0 O-C-N 121.385 -0.822 . . . . 0.0 108.965 -179.922 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 21.6 pt-20 -144.78 156.63 44.15 Favored 'General case' 0 N--CA 1.495 1.782 0 O-C-N 121.133 -0.979 . . . . 0.0 109.862 179.855 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 6.8 tt -126.4 133.26 51.33 Favored 'General case' 0 N--CA 1.492 1.644 0 CA-C-O 121.62 0.724 . . . . 0.0 109.267 -180.0 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 77' ' ' HIS . . . . . . . . . . . . . 73.8 m80 -105.76 129.37 53.97 Favored 'General case' 0 N--CA 1.495 1.819 0 O-C-N 121.626 -0.671 . . . . 0.0 109.639 -179.664 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -140.75 155.87 46.32 Favored 'General case' 0 N--CA 1.494 1.775 0 O-C-N 121.359 -0.838 . . . . 0.0 109.787 -179.774 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 95.7 mtt180 -128.04 147.16 50.51 Favored 'General case' 0 N--CA 1.497 1.876 0 CA-C-O 121.402 0.62 . . . . 0.0 109.83 -179.716 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 80' ' ' PHE . . . . . . . . . . . . . 83.8 m-85 -127.96 148.04 50.5 Favored 'General case' 0 N--CA 1.496 1.871 0 CA-C-O 121.451 0.643 . . . . 0.0 109.568 -179.851 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 63.4 tttp -111.37 127.35 55.63 Favored 'General case' 0 N--CA 1.494 1.739 0 N-CA-C 109.207 -0.664 . . . . 0.0 109.207 179.94 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 82' ' ' PHE . . . . . . . . . . . . . 78.0 m-85 -122.54 145.04 48.69 Favored 'General case' 0 N--CA 1.494 1.746 0 CA-C-O 121.875 0.845 . . . . 0.0 109.649 -179.782 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 32.4 mm-40 -69.46 -32.76 71.89 Favored 'General case' 0 C--N 1.299 -1.608 0 O-C-N 121.751 -0.593 . . . . 0.0 109.638 -179.815 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 84' ' ' VAL . . . . . . . . . . . . . 3.2 m -130.61 157.28 42.98 Favored 'Isoleucine or valine' 0 N--CA 1.499 1.999 0 CA-C-O 121.915 0.864 . . . . 0.0 110.397 -179.427 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 85' ' ' SER . . . . . 0.497 ' O ' ' N ' ' A' ' 88' ' ' LYS . 38.9 t -67.63 -40.2 84.65 Favored 'General case' 0 N--CA 1.492 1.626 0 CA-C-O 121.535 0.683 . . . . 0.0 110.213 179.645 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 86' ' ' ALA . . . . . 0.423 ' C ' ' O ' ' A' ' 85' ' ' SER . . . -40.85 -44.24 2.22 Favored 'General case' 0 N--CA 1.496 1.845 0 O-C-N 121.397 -0.815 . . . . 0.0 110.356 -179.042 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 98.2 mt-10 -66.03 -30.14 70.63 Favored 'General case' 0 C--N 1.299 -1.62 0 O-C-N 121.279 -0.888 . . . . 0.0 110.08 179.895 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 88' ' ' LYS . . . . . 0.497 ' N ' ' O ' ' A' ' 85' ' ' SER . 65.0 tttp -63.38 -46.8 84.8 Favored 'General case' 0 N--CA 1.494 1.727 0 O-C-N 121.068 -1.02 . . . . 0.0 110.062 -179.904 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 89' ' ' LEU . . . . . 0.511 HD22 ' N ' ' A' ' 89' ' ' LEU . 3.6 mm? -63.37 -47.58 81.49 Favored 'General case' 0 N--CA 1.493 1.723 0 O-C-N 121.23 -0.919 . . . . 0.0 110.128 -179.2 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 90' ' ' ILE . . . . . 0.499 ' N ' HD12 ' A' ' 90' ' ' ILE . 1.3 mp -69.19 -43.69 81.3 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.636 0 O-C-N 121.271 -0.893 . . . . 0.0 109.521 179.634 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 91' ' ' PHE . . . . . . . . . . . . . 62.2 t80 -60.37 -46.41 90.04 Favored 'General case' 0 C--N 1.298 -1.651 0 O-C-N 121.456 -0.778 . . . . 0.0 109.869 -179.116 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 92' ' ' GLU . . . . . 0.495 ' OE2' ' NZ ' ' A' ' 88' ' ' LYS . 97.1 mt-10 -67.74 -37.95 82.85 Favored 'General case' 0 N--CA 1.49 1.561 0 O-C-N 121.395 -0.816 . . . . 0.0 109.998 179.903 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 93' ' ' LEU . . . . . . . . . . . . . 6.4 tt -64.05 -46.82 82.71 Favored 'General case' 0 N--CA 1.49 1.575 0 O-C-N 121.129 -0.982 . . . . 0.0 110.156 -179.708 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 94' ' ' LYS . . . . . . . . . . . . . 96.1 mttt -66.91 -45.45 77.89 Favored 'General case' 0 N--CA 1.495 1.794 0 O-C-N 121.383 -0.823 . . . . 0.0 110.2 179.996 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 21.5 p -67.44 -41.47 84.71 Favored 'General case' 0 N--CA 1.492 1.665 0 O-C-N 121.23 -0.919 . . . . 0.0 109.61 -179.698 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 96' ' ' ARG . . . . . 0.435 ' CG ' ' O ' ' A' ' 92' ' ' GLU . 8.0 mmp_? -64.38 -43.81 93.3 Favored 'General case' 0 N--CA 1.49 1.565 0 O-C-N 121.221 -0.924 . . . . 0.0 109.698 179.825 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 97' ' ' ALA . . . . . . . . . . . . . . . -69.49 -40.15 77.22 Favored 'General case' 0 C--N 1.3 -1.55 0 CA-C-O 121.771 0.796 . . . . 0.0 109.204 179.767 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 98' ' ' LEU . . . . . . . . . . . . . 7.0 tt -64.72 -42.22 95.41 Favored 'General case' 0 C--N 1.302 -1.485 0 O-C-N 121.329 -0.857 . . . . 0.0 109.147 179.597 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 99' ' ' ALA . . . . . . . . . . . . . . . -64.15 -37.28 86.87 Favored 'General case' 0 N--CA 1.491 1.583 0 CA-C-O 121.723 0.773 . . . . 0.0 109.092 179.814 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 100' ' ' ARG . . . . . 0.417 ' O ' ' O ' ' A' ' 101' ' ' LEU . 89.3 mtm180 -80.99 -15.4 56.31 Favored 'General case' 0 N--CA 1.493 1.701 0 O-C-N 121.353 -0.842 . . . . 0.0 109.292 179.757 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 101' ' ' LEU . . . . . 0.437 ' O ' ' O ' ' A' ' 102' ' ' GLU . 83.0 mt 53.72 168.33 0.02 OUTLIER 'General case' 0 N--CA 1.495 1.779 0 CA-C-O 121.858 0.837 . . . . 0.0 110.738 179.735 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 102' ' ' GLU . . . . . 0.437 ' O ' ' O ' ' A' ' 101' ' ' LEU . 83.0 tt0 41.52 95.14 0.01 OUTLIER 'General case' 0 N--CA 1.491 1.591 0 CA-C-O 121.582 0.706 . . . . 0.0 110.186 -179.689 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 103' ' ' HIS . . . . . 0.457 ' ND1' ' O ' ' A' ' 103' ' ' HIS . 57.1 t-80 -137.39 27.57 2.82 Favored 'General case' 0 N--CA 1.493 1.68 0 N-CA-C 108.787 -0.82 . . . . 0.0 108.787 179.622 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 104' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -135.72 2.46 2.91 Favored 'General case' 0 N--CA 1.497 1.897 0 N-CA-C 108.692 -0.855 . . . . 0.0 108.692 179.658 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 105' ' ' HIS . . . . . . . . . . . . . 76.6 t60 -66.08 -41.71 90.36 Favored 'General case' 0 N--CA 1.494 1.743 0 O-C-N 121.406 -0.809 . . . . 0.0 109.141 179.331 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 106' ' ' HIS . . . . . . . . . . . . . 38.0 p-80 -150.82 143.1 24.21 Favored 'General case' 0 N--CA 1.493 1.69 0 O-C-N 121.211 -0.93 . . . . 0.0 109.962 -179.988 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 107' ' ' HIS . . . . . 0.445 ' O ' ' OXT' ' A' ' 108' ' ' HIS . 86.0 t60 -87.82 -57.08 3.07 Favored 'General case' 0 N--CA 1.492 1.661 0 O-C-N 121.537 -0.727 . . . . 0.0 109.131 179.69 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 108' ' ' HIS . . . . . 0.445 ' OXT' ' O ' ' A' ' 107' ' ' HIS . 36.9 m-70 . . . . . 0 N--CA 1.5 2.068 0 CA-C-O 117.922 -1.037 . . . . 0.0 110.815 179.577 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 83.3 m-20 . . . . . 0 N--CA 1.494 1.76 0 N-CA-C 109.005 -0.739 . . . . 0.0 109.005 . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild core ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 51.3 t -124.8 136.1 61.83 Favored 'Isoleucine or valine' 0 N--CA 1.499 2.016 0 CA-C-O 121.728 0.775 . . . . 0.0 109.712 179.886 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -123.9 148.1 47.12 Favored 'General case' 0 N--CA 1.496 1.861 0 CA-C-O 121.86 0.838 . . . . 0.0 109.913 -179.961 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 96.7 mt-10 -104.42 142.01 35.33 Favored 'General case' 0 N--CA 1.496 1.85 0 CA-C-O 121.737 0.78 . . . . 0.0 109.984 -179.702 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 34' ' ' VAL . . . . . . . . . . . . . 55.5 t -125.89 132.84 70.24 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.769 0 CA-C-O 121.638 0.732 . . . . 0.0 109.331 -179.967 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 45.5 t -126.24 110.73 13.76 Favored 'General case' 0 N--CA 1.494 1.761 0 CA-C-O 121.678 0.752 . . . . 0.0 109.61 179.778 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 36' ' ' LEU . . . . . 0.544 HD13 ' OH ' ' A' ' 51' ' ' TYR . 51.4 tp -121.98 146.64 46.96 Favored 'General case' 0 N--CA 1.497 1.886 0 CA-C-O 121.818 0.818 . . . . 0.0 109.512 179.827 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 37' ' ' PHE . . . . . . . . . . . . . 41.7 p90 -141.87 155.77 45.53 Favored 'General case' 0 N--CA 1.492 1.648 0 CA-C-O 121.781 0.801 . . . . 0.0 110.293 -179.714 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . -166.66 -155.41 8.94 Favored Glycine 0 N--CA 1.491 2.312 0 N-CA-C 110.482 -1.047 . . . . 0.0 110.482 -179.579 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 39' ' ' SER . . . . . 0.491 ' OG ' ' CG ' ' A' ' 43' ' ' HIS . 74.3 p -63.24 -41.88 99.13 Favored 'General case' 0 N--CA 1.496 1.862 0 O-C-N 122.027 -0.69 . . . . 0.0 110.129 -179.103 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 40' ' ' ASP . . . . . . . . . . . . . 53.3 p-10 -171.62 -168.18 0.58 Allowed 'General case' 0 N--CA 1.491 1.586 0 CA-C-O 121.788 0.804 . . . . 0.0 110.01 179.769 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 28.3 tptp -62.43 -45.55 92.59 Favored 'General case' 0 C--N 1.303 -1.452 0 O-C-N 121.727 -0.608 . . . . 0.0 110.09 -179.265 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -50.41 -51.57 45.23 Favored 'General case' 0 N--CA 1.494 1.773 0 O-C-N 121.68 -0.637 . . . . 0.0 110.533 -178.358 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 43' ' ' HIS . . . . . 0.491 ' CG ' ' OG ' ' A' ' 39' ' ' SER . 23.0 m-70 -67.01 -37.35 84.01 Favored 'General case' 0 N--CA 1.495 1.782 0 O-C-N 121.441 -0.787 . . . . 0.0 110.115 -179.242 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 18.0 mt -63.58 -40.3 96.6 Favored 'General case' 0 N--CA 1.493 1.702 0 O-C-N 121.358 -0.839 . . . . 0.0 109.427 -179.467 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 96.0 mt-10 -61.56 -42.21 98.5 Favored 'General case' 0 N--CA 1.489 1.511 0 N-CA-C 109.036 -0.727 . . . . 0.0 109.036 -179.857 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . -64.55 -48.08 77.04 Favored Glycine 0 N--CA 1.494 2.542 0 N-CA-C 109.584 -1.406 . . . . 0.0 109.584 179.931 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 63.0 mttp -66.97 -33.9 76.59 Favored 'General case' 0 N--CA 1.493 1.698 0 O-C-N 121.712 -0.876 . . . . 0.0 108.995 179.641 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 58.7 tp -59.46 -40.23 86.21 Favored 'General case' 0 C--N 1.303 -1.423 0 N-CA-C 109.503 -0.555 . . . . 0.0 109.503 -178.965 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 49' ' ' ALA . . . . . . . . . . . . . . . -55.97 -39.97 72.56 Favored 'General case' 0 N--CA 1.491 1.618 0 O-C-N 121.563 -0.71 . . . . 0.0 109.23 -179.468 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 97.8 mt-10 -68.33 -39.75 81.83 Favored 'General case' 0 N--CA 1.492 1.659 0 O-C-N 121.62 -0.675 . . . . 0.0 109.419 179.791 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 51' ' ' TYR . . . . . 0.576 ' CE2' ' CG2' ' A' ' 95' ' ' THR . 4.3 m-85 -59.13 -40.69 86.24 Favored 'General case' 0 N--CA 1.494 1.763 0 O-C-N 121.536 -0.727 . . . . 0.0 109.145 -179.432 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 52' ' ' ILE . . . . . 0.565 ' CG2' ' HZ2' ' A' ' 56' ' ' LYS . 95.5 mt -63.98 -42.52 96.01 Favored 'Isoleucine or valine' 0 C--N 1.301 -1.518 0 N-CA-C 109.134 -0.691 . . . . 0.0 109.134 -179.844 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 49.4 m -53.23 -45.99 68.94 Favored 'General case' 0 N--CA 1.493 1.695 0 O-C-N 121.714 -0.616 . . . . 0.0 109.463 -179.0 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 54' ' ' LEU . . . . . 0.407 ' N ' ' CD2' ' A' ' 54' ' ' LEU . 4.0 mm? -64.73 -39.81 94.26 Favored 'General case' 0 C--N 1.3 -1.556 0 O-C-N 121.763 -0.586 . . . . 0.0 109.453 179.168 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -59.13 -49.48 77.73 Favored 'General case' 0 N--CA 1.49 1.573 0 CA-C-O 121.202 0.525 . . . . 0.0 109.769 -179.019 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 56' ' ' LYS . . . . . 0.565 ' HZ2' ' CG2' ' A' ' 52' ' ' ILE . 62.2 mttp -64.6 -39.66 94.11 Favored 'General case' 0 N--CA 1.49 1.564 0 O-C-N 121.6 -0.688 . . . . 0.0 109.359 179.715 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 51.5 tt0 -62.15 -49.19 76.85 Favored 'General case' 0 N--CA 1.489 1.494 0 O-C-N 121.73 -0.606 . . . . 0.0 109.375 -179.433 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 58' ' ' VAL . . . . . . . . . . . . . 72.8 t -66.49 -44.45 90.34 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.587 0 O-C-N 121.761 -0.587 . . . . 0.0 109.795 -179.731 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 59' ' ' TYR . . . . . . . . . . . . . 51.3 t80 -135.75 125.19 24.96 Favored 'General case' 0 N--CA 1.498 1.946 0 CA-C-O 121.918 0.866 . . . . 0.0 110.024 -179.421 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -71.45 144.77 49.61 Favored 'General case' 0 N--CA 1.492 1.629 0 CA-C-O 121.57 0.7 . . . . 0.0 110.73 -179.588 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 61' ' ' ASN . . . . . . . . . . . . . 10.7 m120 57.29 37.44 28.18 Favored 'General case' 0 N--CA 1.493 1.702 0 CA-C-O 121.544 0.688 . . . . 0.0 109.156 179.603 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 62' ' ' VAL . . . . . . . . . . . . . 10.3 p -67.63 138.73 22.13 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.509 0 CA-C-O 121.709 0.766 . . . . 0.0 110.194 -179.643 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 97.3 mt-10 -108.91 142.74 39.09 Favored 'General case' 0 N--CA 1.495 1.813 0 CA-C-O 121.726 0.774 . . . . 0.0 109.671 -179.466 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 64' ' ' TYR . . . . . . . . . . . . . 49.9 p90 -151.22 161.91 41.86 Favored 'General case' 0 N--CA 1.492 1.639 0 CA-C-O 121.936 0.874 . . . . 0.0 110.486 -179.993 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 80.5 tt0 -144.24 145.55 32.12 Favored 'General case' 0 N--CA 1.493 1.721 0 CA-C-O 121.511 0.672 . . . . 0.0 109.426 179.959 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 66' ' ' VAL . . . . . . . . . . . . . 30.8 m -120.71 129.99 75.04 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.903 0 CA-C-O 121.999 0.904 . . . . 0.0 110.266 -179.646 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 67' ' ' ALA . . . . . 0.558 ' HB1' ' HD2' ' A' ' 68' ' ' PRO . . . -78.57 170.74 14.82 Favored Pre-proline 0 C--N 1.301 -1.501 0 CA-C-N 115.976 -0.556 . . . . 0.0 109.506 179.925 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 68' ' ' PRO . . . . . 0.558 ' HD2' ' HB1' ' A' ' 67' ' ' ALA . 46.7 Cg_exo -54.58 134.11 60.29 Favored 'Trans proline' 0 N--CA 1.496 1.621 0 C-N-CA 122.578 2.186 . . . . 0.0 113.276 179.752 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 69' ' ' VAL . . . . . . . . . . . . . 64.9 t -134.76 132.85 54.21 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.939 0 CA-C-O 121.661 0.743 . . . . 0.0 109.93 179.445 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -82.37 163.7 21.54 Favored 'General case' 0 N--CA 1.49 1.569 0 CA-C-O 121.619 0.723 . . . . 0.0 109.516 179.343 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 49.8 t0 -64.92 -40.69 95.44 Favored 'General case' 0 N--CA 1.489 1.486 0 O-C-N 121.721 -0.612 . . . . 0.0 109.645 -179.53 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 72' ' ' ASN . . . . . . . . . . . . . 95.0 m-20 -97.87 21.81 10.08 Favored 'General case' 0 N--CA 1.495 1.819 0 N-CA-C 108.97 -0.752 . . . . 0.0 108.97 -179.586 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 73' ' ' ALA . . . . . 0.462 ' C ' ' H ' ' A' ' 75' ' ' GLU . . . -62.36 -36.55 82.59 Favored 'General case' 0 N--CA 1.494 1.767 0 O-C-N 121.649 -0.657 . . . . 0.0 109.411 -179.826 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 74' ' ' THR . . . . . . . . . . . . . 2.0 m 67.78 -6.37 0.71 Allowed 'General case' 0 N--CA 1.491 1.606 0 N-CA-C 109.432 -0.581 . . . . 0.0 109.432 -179.965 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 75' ' ' GLU . . . . . 0.498 ' OE1' ' CE1' ' A' ' 77' ' ' HIS . 2.9 pp20? -137.85 145.98 42.88 Favored 'General case' 0 N--CA 1.495 1.82 0 CA-C-O 121.93 0.872 . . . . 0.0 110.336 -179.873 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 2.0 tp -121.06 128.92 53.08 Favored 'General case' 0 N--CA 1.49 1.56 0 CA-C-O 121.586 0.708 . . . . 0.0 109.451 -179.928 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 77' ' ' HIS . . . . . 0.498 ' CE1' ' OE1' ' A' ' 75' ' ' GLU . 30.6 m80 -106.09 114.48 28.65 Favored 'General case' 0 N--CA 1.495 1.788 0 CA-C-O 121.672 0.749 . . . . 0.0 109.213 179.913 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -135.07 154.62 51.63 Favored 'General case' 0 N--CA 1.495 1.78 0 CA-C-O 121.899 0.857 . . . . 0.0 110.227 -179.675 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 94.6 mtt-85 -129.46 146.22 51.33 Favored 'General case' 0 N--CA 1.496 1.829 0 CA-C-O 121.536 0.684 . . . . 0.0 109.585 -179.956 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 80' ' ' PHE . . . . . . . . . . . . . 67.9 m-85 -126.34 144.49 50.79 Favored 'General case' 0 N--CA 1.498 1.942 0 CA-C-O 121.803 0.811 . . . . 0.0 109.965 -179.876 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 21.6 ttpp -115.17 121.46 43.06 Favored 'General case' 0 N--CA 1.494 1.746 0 CA-C-O 121.719 0.771 . . . . 0.0 109.565 -179.792 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 82' ' ' PHE . . . . . . . . . . . . . 83.5 m-85 -115.32 -129.42 0.3 Allowed 'General case' 0 N--CA 1.496 1.859 0 CA-C-O 121.532 0.682 . . . . 0.0 109.613 -179.876 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 78.8 tt0 -140.46 -33.29 0.56 Allowed 'General case' 0 N--CA 1.493 1.71 0 N-CA-C 108.841 -0.8 . . . . 0.0 108.841 -179.54 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 84' ' ' VAL . . . . . . . . . . . . . 27.5 m -135.79 159.8 39.49 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.894 0 CA-C-O 121.891 0.853 . . . . 0.0 109.852 179.953 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 38.0 m -63.37 -34.92 78.76 Favored 'General case' 0 N--CA 1.49 1.536 0 CA-C-O 121.319 0.58 . . . . 0.0 109.907 -179.567 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 86' ' ' ALA . . . . . . . . . . . . . . . -50.22 -45.94 54.28 Favored 'General case' 0 N--CA 1.491 1.577 0 O-C-N 121.526 -0.734 . . . . 0.0 109.676 -178.911 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 87' ' ' GLU . . . . . 0.56 ' N ' ' OE1' ' A' ' 87' ' ' GLU . 0.0 OUTLIER -52.12 -37.81 55.46 Favored 'General case' 0 N--CA 1.493 1.695 0 O-C-N 121.56 -0.712 . . . . 0.0 109.654 -179.103 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 88' ' ' LYS . . . . . . . . . . . . . 88.7 tttt -64.13 -46.1 85.61 Favored 'General case' 0 N--CA 1.49 1.527 0 O-C-N 121.675 -0.64 . . . . 0.0 109.526 -179.609 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 89' ' ' LEU . . . . . 0.531 HD22 ' N ' ' A' ' 89' ' ' LEU . 4.0 mm? -63.94 -45.31 89.74 Favored 'General case' 0 N--CA 1.492 1.664 0 O-C-N 121.651 -0.655 . . . . 0.0 110.427 -179.252 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 90' ' ' ILE . . . . . . . . . . . . . 37.1 mm -70.2 -45.28 76.38 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.665 0 O-C-N 121.773 -0.58 . . . . 0.0 109.684 -179.641 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 91' ' ' PHE . . . . . . . . . . . . . 83.9 t80 -64.51 -45.33 87.69 Favored 'General case' 0 N--CA 1.492 1.66 0 O-C-N 121.648 -0.658 . . . . 0.0 109.896 179.84 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 92' ' ' GLU . . . . . . . . . . . . . 46.5 tp10 -66.48 -38.0 86.33 Favored 'General case' 0 N--CA 1.491 1.595 0 O-C-N 121.726 -0.609 . . . . 0.0 109.533 -178.949 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 93' ' ' LEU . . . . . . . . . . . . . 5.5 tt -62.68 -49.17 76.17 Favored 'General case' 0 C--N 1.303 -1.44 0 O-C-N 121.572 -0.705 . . . . 0.0 109.952 -179.301 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 94' ' ' LYS . . . . . . . . . . . . . 49.6 mtmt -69.67 -40.96 76.11 Favored 'General case' 0 N--CA 1.49 1.551 0 O-C-N 121.647 -0.658 . . . . 0.0 109.746 -179.87 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 95' ' ' THR . . . . . 0.576 ' CG2' ' CE2' ' A' ' 51' ' ' TYR . 98.9 m -61.61 -46.9 87.85 Favored 'General case' 0 N--CA 1.491 1.621 0 O-C-N 121.657 -0.652 . . . . 0.0 109.594 -178.917 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 96' ' ' ARG . . . . . . . . . . . . . 78.8 mtp85 -65.8 -40.36 91.83 Favored 'General case' 0 N--CA 1.492 1.669 0 O-C-N 121.687 -0.633 . . . . 0.0 109.338 179.67 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 97' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.489 1.484 0 N-CA-C 109.023 -0.732 . . . . 0.0 109.023 -179.813 . . . . . . . . 0 0 . 1 . 002 nuclear nobuild core ' A' A ' 30' ' ' ASP . . . . . 0.458 ' N ' ' OD1' ' A' ' 30' ' ' ASP . 29.3 p-10 . . . . . 0 N--CA 1.493 1.701 0 N-CA-C 108.945 -0.761 . . . . 0.0 108.945 . . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 31' ' ' VAL . . . . . 0.444 HG12 ' N ' ' A' ' 32' ' ' ALA . 17.2 t -117.21 161.24 16.14 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.97 0 O-C-N 121.551 -0.718 . . . . 0.0 109.658 -179.78 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 32' ' ' ALA . . . . . 0.444 ' N ' HG12 ' A' ' 31' ' ' VAL . . . -135.92 151.61 50.15 Favored 'General case' 0 N--CA 1.492 1.63 0 O-C-N 121.514 -0.741 . . . . 0.0 109.436 -179.652 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 33' ' ' GLU . . . . . 0.496 ' OE1' ' NE2' ' A' ' 77' ' ' HIS . 80.4 mm-40 -100.2 142.7 31.32 Favored 'General case' 0 N--CA 1.493 1.71 0 CA-C-O 121.877 0.846 . . . . 0.0 110.035 -179.597 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 34' ' ' VAL . . . . . . . . . . . . . 52.3 t -128.87 135.48 62.11 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.802 0 CA-C-O 121.629 0.728 . . . . 0.0 109.146 -179.915 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 79.8 p -142.4 120.87 12.43 Favored 'General case' 0 N--CA 1.492 1.638 0 O-C-N 121.258 -0.901 . . . . 0.0 109.05 179.779 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 51.0 tp -122.38 136.27 54.86 Favored 'General case' 0 N--CA 1.497 1.887 0 CA-C-O 121.449 0.642 . . . . 0.0 109.587 -179.9 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 37' ' ' PHE . . . . . . . . . . . . . 91.0 t80 -108.48 131.01 55.23 Favored 'General case' 0 N--CA 1.495 1.787 0 CA-C-O 121.61 0.719 . . . . 0.0 109.468 -179.997 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . -172.09 -159.18 17.9 Favored Glycine 0 N--CA 1.488 2.16 0 N-CA-C 109.951 -1.26 . . . . 0.0 109.951 -179.639 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 39' ' ' SER . . . . . 0.449 ' OG ' ' N ' ' A' ' 40' ' ' ASP . 39.7 t -75.78 -146.94 0.03 OUTLIER 'General case' 0 N--CA 1.494 1.771 0 O-C-N 121.645 -0.914 . . . . 0.0 111.042 -179.061 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 40' ' ' ASP . . . . . 0.449 ' N ' ' OG ' ' A' ' 39' ' ' SER . 97.9 m-20 -52.07 175.98 0.02 OUTLIER 'General case' 0 N--CA 1.493 1.706 0 CA-C-O 122.162 0.982 . . . . 0.0 111.24 -178.696 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 38.0 ttmt -62.29 -42.82 99.68 Favored 'General case' 0 N--CA 1.491 1.577 0 O-C-N 121.633 -0.667 . . . . 0.0 109.575 179.608 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -53.46 -44.7 69.13 Favored 'General case' 0 N--CA 1.492 1.63 0 O-C-N 121.337 -0.852 . . . . 0.0 109.569 -179.558 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 43' ' ' HIS . . . . . . . . . . . . . 86.6 t60 -63.17 -43.36 98.49 Favored 'General case' 0 N--CA 1.493 1.694 0 O-C-N 121.277 -0.89 . . . . 0.0 109.62 179.892 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 97.5 mt -64.43 -39.88 94.68 Favored 'General case' 0 N--CA 1.493 1.723 0 O-C-N 121.413 -0.804 . . . . 0.0 109.713 -179.871 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 96.1 mt-10 -60.73 -38.55 85.5 Favored 'General case' 0 N--CA 1.491 1.603 0 O-C-N 121.203 -0.936 . . . . 0.0 109.833 -179.719 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . -62.34 -52.06 52.03 Favored Glycine 0 N--CA 1.494 2.507 0 N-CA-C 109.698 -1.361 . . . . 0.0 109.698 179.951 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 97.3 mttt -67.59 -37.21 82.25 Favored 'General case' 0 N--CA 1.492 1.644 0 O-C-N 121.32 -1.106 . . . . 0.0 109.739 179.157 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 48' ' ' LEU . . . . . 0.5 ' O ' ' N ' ' A' ' 51' ' ' TYR . 20.7 tp -61.62 -40.13 93.74 Favored 'General case' 0 C--N 1.299 -1.595 0 O-C-N 121.532 -0.73 . . . . 0.0 109.427 -179.177 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 49' ' ' ALA . . . . . 0.426 ' C ' ' O ' ' A' ' 48' ' ' LEU . . . -40.44 -33.24 0.24 Allowed 'General case' 0 N--CA 1.497 1.91 0 CA-C-O 121.617 0.723 . . . . 0.0 109.955 -179.588 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 72.8 mm-40 -68.69 -38.53 80.38 Favored 'General case' 0 N--CA 1.491 1.608 0 O-C-N 121.32 -0.862 . . . . 0.0 109.658 179.513 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 51' ' ' TYR . . . . . 0.5 ' N ' ' O ' ' A' ' 48' ' ' LEU . 21.3 m-85 -62.04 -45.31 94.11 Favored 'General case' 0 N--CA 1.494 1.74 0 O-C-N 121.224 -0.923 . . . . 0.0 109.79 -179.761 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 52' ' ' ILE . . . . . . . . . . . . . 97.2 mt -65.24 -44.16 95.17 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.658 0 O-C-N 121.347 -0.845 . . . . 0.0 109.857 -179.658 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 68.9 m -62.52 -45.02 94.9 Favored 'General case' 0 N--CA 1.494 1.729 0 O-C-N 121.163 -0.96 . . . . 0.0 109.713 -179.642 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 54' ' ' LEU . . . . . 0.442 HD12 HG22 ' A' ' 95' ' ' THR . 88.2 mt -65.87 -39.38 90.66 Favored 'General case' 0 N--CA 1.492 1.646 0 O-C-N 121.371 -0.831 . . . . 0.0 109.784 179.883 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -61.37 -38.82 88.37 Favored 'General case' 0 N--CA 1.49 1.565 0 O-C-N 121.352 -0.842 . . . . 0.0 109.666 -179.522 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 56' ' ' LYS . . . . . . . . . . . . . 56.6 mtpt -64.43 -42.53 95.96 Favored 'General case' 0 N--CA 1.491 1.599 0 O-C-N 121.246 -0.909 . . . . 0.0 109.565 179.68 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 19.3 mm100 -68.54 -41.8 79.32 Favored 'General case' 0 N--CA 1.49 1.532 0 O-C-N 121.286 -0.884 . . . . 0.0 109.521 -179.897 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 58' ' ' VAL . . . . . . . . . . . . . 75.0 t -64.76 -45.57 94.74 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.638 0 O-C-N 121.285 -0.884 . . . . 0.0 109.755 179.809 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 59' ' ' TYR . . . . . . . . . . . . . 51.2 t80 -135.09 121.69 20.7 Favored 'General case' 0 N--CA 1.497 1.909 0 O-C-N 121.339 -0.85 . . . . 0.0 109.77 -179.588 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -68.04 144.51 55.08 Favored 'General case' 0 N--CA 1.492 1.673 0 CA-C-O 121.645 0.736 . . . . 0.0 110.764 -179.585 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 61' ' ' ASN . . . . . . . . . . . . . 55.9 t-20 57.75 41.33 25.3 Favored 'General case' 0 N--CA 1.489 1.508 0 CA-C-O 121.906 0.86 . . . . 0.0 108.98 179.659 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 62' ' ' VAL . . . . . . . . . . . . . 7.4 p -70.76 138.66 21.4 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.516 0 CA-C-O 121.772 0.796 . . . . 0.0 110.321 -179.67 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 97.1 mt-10 -111.19 136.74 49.82 Favored 'General case' 0 N--CA 1.494 1.749 0 CA-C-O 121.611 0.719 . . . . 0.0 109.466 -179.849 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 64' ' ' TYR . . . . . . . . . . . . . 52.4 p90 -147.6 161.3 41.41 Favored 'General case' 0 N--CA 1.489 1.485 0 O-C-N 121.432 -0.792 . . . . 0.0 109.767 -179.549 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 83.1 tt0 -144.56 150.16 37.04 Favored 'General case' 0 N--CA 1.49 1.57 0 N-CA-C 108.935 -0.765 . . . . 0.0 108.935 -179.992 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 66' ' ' VAL . . . . . . . . . . . . . 57.3 t -111.48 129.67 66.4 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.89 0 CA-C-O 121.752 0.787 . . . . 0.0 109.83 -179.705 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 67' ' ' ALA . . . . . 0.514 ' HB1' ' HD2' ' A' ' 68' ' ' PRO . . . -79.45 170.54 15.59 Favored Pre-proline 0 N--CA 1.486 1.369 0 O-C-N 121.698 -0.626 . . . . 0.0 109.589 -179.487 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 68' ' ' PRO . . . . . 0.514 ' HD2' ' HB1' ' A' ' 67' ' ' ALA . 51.3 Cg_exo -54.72 119.11 5.91 Favored 'Trans proline' 0 N--CA 1.496 1.651 0 C-N-CA 122.412 2.075 . . . . 0.0 112.448 179.64 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 69' ' ' VAL . . . . . . . . . . . . . 74.7 t -131.98 133.28 61.01 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.946 0 O-C-N 121.469 -0.769 . . . . 0.0 109.653 179.634 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -78.61 158.07 28.55 Favored 'General case' 0 N--CA 1.493 1.684 0 CA-C-O 121.757 0.789 . . . . 0.0 110.253 179.869 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 56.6 m-20 -64.09 -37.04 85.99 Favored 'General case' 0 N--CA 1.493 1.684 0 O-C-N 121.58 -0.7 . . . . 0.0 109.39 -179.807 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 72' ' ' ASN . . . . . . . . . . . . . 8.3 t-20 -103.91 28.9 6.26 Favored 'General case' 0 N--CA 1.495 1.79 0 O-C-N 121.333 -0.855 . . . . 0.0 108.925 -179.703 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 73' ' ' ALA . . . . . 0.5 ' O ' ' N ' ' A' ' 75' ' ' GLU . . . -72.96 -10.07 59.4 Favored 'General case' 0 N--CA 1.493 1.677 0 O-C-N 121.292 -0.88 . . . . 0.0 108.729 179.622 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 74' ' ' THR . . . . . . . . . . . . . 68.4 p 49.69 10.59 0.04 OUTLIER 'General case' 0 N--CA 1.493 1.722 0 O-C-N 121.424 -0.797 . . . . 0.0 109.489 -179.726 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 75' ' ' GLU . . . . . 0.5 ' N ' ' O ' ' A' ' 73' ' ' ALA . 80.8 tt0 -153.82 153.04 31.4 Favored 'General case' 0 C--N 1.302 -1.487 0 O-C-N 121.2 -0.937 . . . . 0.0 109.165 179.618 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 5.7 tt -132.38 134.99 45.82 Favored 'General case' 0 N--CA 1.49 1.546 0 O-C-N 121.608 -0.683 . . . . 0.0 109.324 179.971 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 77' ' ' HIS . . . . . 0.496 ' NE2' ' OE1' ' A' ' 33' ' ' GLU . 74.5 t60 -118.75 126.22 51.4 Favored 'General case' 0 N--CA 1.494 1.758 0 CA-C-O 121.74 0.781 . . . . 0.0 109.46 -179.853 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -144.13 163.87 32.32 Favored 'General case' 0 N--CA 1.492 1.661 0 O-C-N 121.389 -0.82 . . . . 0.0 109.408 -179.719 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 84.5 mtt85 -126.01 144.95 50.51 Favored 'General case' 0 N--CA 1.495 1.792 0 N-CA-C 109.226 -0.657 . . . . 0.0 109.226 -179.877 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 80' ' ' PHE . . . . . . . . . . . . . 64.9 m-85 -128.93 152.0 49.04 Favored 'General case' 0 N--CA 1.495 1.798 0 CA-C-O 121.616 0.722 . . . . 0.0 109.374 -179.717 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 65.0 tttm -106.07 137.72 43.5 Favored 'General case' 0 N--CA 1.492 1.655 0 CA-C-O 121.603 0.716 . . . . 0.0 110.007 -179.507 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 82' ' ' PHE . . . . . . . . . . . . . 80.7 m-85 -133.13 -123.46 0.18 Allowed 'General case' 0 N--CA 1.494 1.768 0 N-CA-C 109.201 -0.666 . . . . 0.0 109.201 179.846 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 49.5 tp10 -153.65 -36.89 0.1 Allowed 'General case' 0 N--CA 1.488 1.442 0 O-C-N 121.225 -0.922 . . . . 0.0 108.704 179.959 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 84' ' ' VAL . . . . . . . . . . . . . 27.8 m -135.89 162.49 36.55 Favored 'Isoleucine or valine' 0 N--CA 1.499 1.991 0 O-C-N 121.329 -0.857 . . . . 0.0 110.155 -179.745 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 77.8 p -69.66 -19.95 63.59 Favored 'General case' 0 N--CA 1.492 1.635 0 O-C-N 121.496 -0.753 . . . . 0.0 109.482 179.618 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 86' ' ' ALA . . . . . . . . . . . . . . . -62.72 -37.6 87.15 Favored 'General case' 0 N--CA 1.492 1.63 0 O-C-N 121.253 -0.905 . . . . 0.0 109.521 179.983 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 80.4 mm-40 -71.8 -27.13 62.73 Favored 'General case' 0 N--CA 1.491 1.596 0 O-C-N 121.348 -0.845 . . . . 0.0 109.109 179.572 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 88' ' ' LYS . . . . . . . . . . . . . 36.8 ttmt -63.41 -50.61 69.14 Favored 'General case' 0 N--CA 1.49 1.544 0 O-C-N 121.258 -0.901 . . . . 0.0 109.726 -179.592 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 89' ' ' LEU . . . . . 0.5 HD22 ' N ' ' A' ' 89' ' ' LEU . 4.0 mm? -65.41 -44.22 88.09 Favored 'General case' 0 N--CA 1.493 1.72 0 O-C-N 121.349 -0.845 . . . . 0.0 109.893 -179.72 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 90' ' ' ILE . . . . . 0.4 ' O ' ' CB ' ' A' ' 94' ' ' LYS . 96.0 mt -66.63 -43.62 90.3 Favored 'Isoleucine or valine' 0 C--N 1.299 -1.616 0 O-C-N 121.296 -0.877 . . . . 0.0 109.625 -179.94 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 91' ' ' PHE . . . . . 0.582 ' O ' HG23 ' A' ' 95' ' ' THR . 82.5 t80 -61.67 -46.74 88.45 Favored 'General case' 0 N--CA 1.49 1.57 0 O-C-N 121.257 -0.902 . . . . 0.0 109.9 -179.619 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 92' ' ' GLU . . . . . . . . . . . . . 8.8 tm-20 -68.19 -51.77 41.87 Favored 'General case' 0 N--CA 1.491 1.611 0 O-C-N 121.345 -0.847 . . . . 0.0 109.996 -179.463 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 93' ' ' LEU . . . . . 0.631 ' O ' HD23 ' A' ' 93' ' ' LEU . 3.1 tt -63.64 -46.67 84.6 Favored 'General case' 0 C--N 1.3 -1.586 0 O-C-N 121.173 -0.954 . . . . 0.0 109.659 -179.101 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 94' ' ' LYS . . . . . 0.4 ' CB ' ' O ' ' A' ' 90' ' ' ILE . 55.1 tttp -63.32 -47.27 82.92 Favored 'General case' 0 N--CA 1.491 1.61 0 O-C-N 121.205 -0.935 . . . . 0.0 110.09 -179.072 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 95' ' ' THR . . . . . 0.582 HG23 ' O ' ' A' ' 91' ' ' PHE . 60.0 p -67.68 -42.09 82.65 Favored 'General case' 0 C--N 1.299 -1.595 0 O-C-N 121.258 -0.901 . . . . 0.0 109.465 -179.854 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 96' ' ' ARG . . . . . . . . . . . . . 12.1 tpt180 -65.47 -41.54 93.23 Favored 'General case' 0 C--N 1.3 -1.553 0 O-C-N 121.313 -0.867 . . . . 0.0 109.322 -179.853 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 97' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.489 1.517 0 O-C-N 121.366 -0.834 . . . . 0.0 109.245 -179.762 . . . . . . . . 0 0 . 1 . 003 nuclear nobuild core ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 96.3 m-20 . . . . . 0 N--CA 1.493 1.702 0 CA-C-O 121.205 0.526 . . . . 0.0 109.688 . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild core ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 49.9 t -120.24 135.63 59.88 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.773 0 N-CA-C 109.112 -0.699 . . . . 0.0 109.112 -179.829 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -118.48 147.91 43.13 Favored 'General case' 0 N--CA 1.492 1.63 0 N-CA-C 109.267 -0.642 . . . . 0.0 109.267 -179.79 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 97.3 mt-10 -105.49 133.92 49.46 Favored 'General case' 0 N--CA 1.492 1.67 0 O-C-N 121.593 -0.692 . . . . 0.0 109.519 -179.74 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 34' ' ' VAL . . . . . . . . . . . . . 48.6 t -123.06 133.44 69.06 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.734 0 N-CA-C 108.771 -0.826 . . . . 0.0 108.771 179.929 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 77.9 p -128.52 122.96 32.33 Favored 'General case' 0 N--CA 1.491 1.588 0 N-CA-C 108.719 -0.845 . . . . 0.0 108.719 -179.944 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 44.9 tp -117.81 132.58 56.43 Favored 'General case' 0 N--CA 1.496 1.858 0 N-CA-C 108.905 -0.776 . . . . 0.0 108.905 179.808 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 37' ' ' PHE . . . . . . . . . . . . . 91.2 t80 -112.98 132.33 55.4 Favored 'General case' 0 N--CA 1.493 1.688 0 O-C-N 121.676 -0.64 . . . . 0.0 109.287 -179.638 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 38' ' ' GLY . . . . . 0.405 ' N ' HD21 ' A' ' 44' ' ' LEU . . . -168.45 -162.79 21.24 Favored Glycine 0 N--CA 1.487 2.074 0 C-N-CA 119.693 -1.241 . . . . 0.0 110.164 -179.667 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 39' ' ' SER . . . . . 0.515 ' OG ' ' N ' ' A' ' 40' ' ' ASP . 30.0 t -62.65 -128.33 0.0 OUTLIER 'General case' 0 N--CA 1.49 1.55 0 O-C-N 121.667 -0.902 . . . . 0.0 110.766 -179.264 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 40' ' ' ASP . . . . . 0.515 ' N ' ' OG ' ' A' ' 39' ' ' SER . 98.5 m-20 -73.52 175.77 6.74 Favored 'General case' 0 N--CA 1.488 1.467 0 O-C-N 121.398 -0.814 . . . . 0.0 110.134 -179.197 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 88.5 tttt -63.18 -39.97 96.19 Favored 'General case' 0 C--N 1.305 -1.361 0 N-CA-C 109.05 -0.722 . . . . 0.0 109.05 179.512 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -54.81 -46.02 74.47 Favored 'General case' 0 N--CA 1.488 1.468 0 O-C-N 121.352 -0.843 . . . . 0.0 109.416 -179.944 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 43' ' ' HIS . . . . . . . . . . . . . 15.3 t-80 -61.24 -41.56 97.09 Favored 'General case' 0 C--N 1.303 -1.426 0 O-C-N 121.29 -0.881 . . . . 0.0 109.263 179.653 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 44' ' ' LEU . . . . . 0.405 HD21 ' N ' ' A' ' 38' ' ' GLY . 96.5 mt -64.41 -39.59 94.13 Favored 'General case' 0 N--CA 1.49 1.526 0 O-C-N 121.459 -0.776 . . . . 0.0 109.656 -179.929 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 97.2 mt-10 -59.39 -41.15 88.71 Favored 'General case' 0 N--CA 1.488 1.462 0 O-C-N 121.178 -0.951 . . . . 0.0 109.847 -179.69 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . -62.81 -46.72 93.04 Favored Glycine 0 N--CA 1.49 2.285 0 N-CA-C 109.162 -1.575 . . . . 0.0 109.162 179.75 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 25.6 mtpp -67.29 -33.12 74.63 Favored 'General case' 0 N--CA 1.488 1.46 0 O-C-N 121.505 -0.997 . . . . 0.0 109.356 179.224 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 44.0 tp -57.55 -38.33 74.57 Favored 'General case' 0 N--CA 1.488 1.467 0 O-C-N 121.518 -0.739 . . . . 0.0 109.399 -179.056 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 49' ' ' ALA . . . . . . . . . . . . . . . -52.15 -40.48 61.47 Favored 'General case' 0 C--N 1.302 -1.46 0 O-C-N 121.26 -0.9 . . . . 0.0 109.998 -179.682 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 75.9 mt-10 -68.01 -40.96 82.88 Favored 'General case' 0 N--CA 1.491 1.586 0 O-C-N 121.138 -0.977 . . . . 0.0 109.629 179.955 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 8.1 m-85 -61.98 -44.9 95.78 Favored 'General case' 0 N--CA 1.49 1.525 0 O-C-N 121.441 -0.787 . . . . 0.0 109.232 179.934 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 52' ' ' ILE . . . . . . . . . . . . . 96.0 mt -63.97 -43.19 97.6 Favored 'Isoleucine or valine' 0 C--N 1.303 -1.422 0 O-C-N 121.513 -0.742 . . . . 0.0 109.771 -179.816 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 79.9 p -59.49 -39.89 85.24 Favored 'General case' 0 N--CA 1.49 1.562 0 O-C-N 121.147 -0.971 . . . . 0.0 110.028 -179.193 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 54' ' ' LEU . . . . . . . . . . . . . 95.0 mt -63.26 -41.84 99.09 Favored 'General case' 0 N--CA 1.489 1.478 0 O-C-N 121.154 -0.967 . . . . 0.0 109.122 179.8 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 55' ' ' ALA . . . . . 0.417 ' HB2' ' CE1' ' A' ' 91' ' ' PHE . . . -64.11 -41.5 97.23 Favored 'General case' 0 N--CA 1.488 1.437 0 O-C-N 121.42 -0.8 . . . . 0.0 109.502 179.911 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 56' ' ' LYS . . . . . . . . . . . . . 56.5 mtpt -65.37 -43.7 89.95 Favored 'General case' 0 N--CA 1.489 1.514 0 O-C-N 121.377 -0.827 . . . . 0.0 109.461 179.728 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 60.7 tt0 -67.34 -43.76 80.73 Favored 'General case' 0 N--CA 1.488 1.456 0 O-C-N 121.408 -0.807 . . . . 0.0 109.377 -179.762 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 58' ' ' VAL . . . . . 0.475 ' CG1' ' OE1' ' A' ' 87' ' ' GLU . 53.6 t -64.63 -45.61 94.88 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.405 0 O-C-N 121.461 -0.774 . . . . 0.0 109.523 179.999 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 59' ' ' TYR . . . . . . . . . . . . . 56.6 t80 -131.98 123.27 27.01 Favored 'General case' 0 N--CA 1.497 1.902 0 O-C-N 121.479 -0.763 . . . . 0.0 109.619 -179.536 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -70.51 144.44 51.36 Favored 'General case' 0 N--CA 1.491 1.612 0 O-C-N 121.544 -0.722 . . . . 0.0 110.898 -179.436 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 61' ' ' ASN . . . . . . . . . . . . . 11.2 t-20 57.94 40.96 25.21 Favored 'General case' 0 N--CA 1.491 1.591 0 O-C-N 121.525 -0.734 . . . . 0.0 109.115 179.594 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 62' ' ' VAL . . . . . . . . . . . . . 11.5 p -75.98 132.32 33.32 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.501 0 O-C-N 121.595 -0.691 . . . . 0.0 110.046 -179.718 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 97.4 mt-10 -90.91 150.74 21.39 Favored 'General case' 0 N--CA 1.492 1.652 0 O-C-N 121.437 -0.789 . . . . 0.0 109.638 -179.89 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 64' ' ' TYR . . . . . 0.45 ' C ' ' OE1' ' A' ' 65' ' ' GLU . 53.9 p90 -156.4 164.07 38.72 Favored 'General case' 0 N--CA 1.49 1.544 0 O-C-N 121.175 -0.953 . . . . 0.0 110.207 -179.729 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 65' ' ' GLU . . . . . 0.602 ' CD ' ' N ' ' A' ' 65' ' ' GLU . 1.8 pm0 -152.61 156.64 39.67 Favored 'General case' 0 N--CA 1.49 1.529 0 N-CA-C 108.634 -0.876 . . . . 0.0 108.634 -179.465 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 66' ' ' VAL . . . . . . . . . . . . . 2.6 p -123.19 129.57 74.85 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.86 0 CA-C-O 121.533 0.683 . . . . 0.0 109.465 -179.82 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 67' ' ' ALA . . . . . 0.467 ' HB1' ' HD2' ' A' ' 68' ' ' PRO . . . -75.96 160.68 77.99 Favored Pre-proline 0 N--CA 1.488 1.469 0 O-C-N 121.607 -0.683 . . . . 0.0 109.333 -179.78 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 68' ' ' PRO . . . . . 0.467 ' HD2' ' HB1' ' A' ' 67' ' ' ALA . 21.4 Cg_endo -59.76 111.83 1.08 Allowed 'Trans proline' 0 N--CA 1.495 1.61 0 C-N-CA 122.831 2.354 . . . . 0.0 111.738 179.905 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 69' ' ' VAL . . . . . . . . . . . . . 56.0 t -124.66 134.61 66.35 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.917 0 N-CA-C 109.136 -0.69 . . . . 0.0 109.136 179.987 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -67.02 149.83 50.08 Favored 'General case' 0 C--N 1.304 -1.41 0 O-C-N 121.527 -0.733 . . . . 0.0 110.27 -179.625 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 71' ' ' ASP . . . . . 0.547 ' OD1' ' N ' ' A' ' 72' ' ' ASN . 48.2 p-10 -64.75 -29.51 70.49 Favored 'General case' 0 N--CA 1.488 1.456 0 O-C-N 121.565 -0.709 . . . . 0.0 109.566 179.797 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 72' ' ' ASN . . . . . 0.547 ' N ' ' OD1' ' A' ' 71' ' ' ASP . 10.7 m120 -90.27 8.28 34.04 Favored 'General case' 0 N--CA 1.49 1.548 0 O-C-N 121.299 -0.876 . . . . 0.0 108.959 -179.942 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -68.76 148.75 49.88 Favored 'General case' 0 N--CA 1.49 1.564 0 O-C-N 121.506 -0.746 . . . . 0.0 110.464 -179.613 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 74' ' ' THR . . . . . . . . . . . . . 12.7 p -100.27 3.71 43.68 Favored 'General case' 0 N--CA 1.494 1.764 0 O-C-N 121.451 -0.78 . . . . 0.0 109.471 179.821 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 22.2 pt-20 -142.28 160.96 39.22 Favored 'General case' 0 N--CA 1.495 1.819 0 O-C-N 121.137 -0.977 . . . . 0.0 109.55 179.796 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 9.9 tp -127.55 135.03 49.76 Favored 'General case' 0 N--CA 1.493 1.717 0 O-C-N 121.636 -0.665 . . . . 0.0 109.285 -179.88 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 77' ' ' HIS . . . . . . . . . . . . . 75.1 m80 -108.4 128.63 54.94 Favored 'General case' 0 N--CA 1.494 1.768 0 N-CA-C 109.16 -0.681 . . . . 0.0 109.16 179.699 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -151.79 154.57 36.49 Favored 'General case' 0 N--CA 1.489 1.506 0 O-C-N 121.258 -0.901 . . . . 0.0 109.369 179.992 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 79' ' ' ARG . . . . . 0.455 ' O ' ' OE2' ' A' ' 65' ' ' GLU . 84.5 mtt85 -128.74 150.43 50.28 Favored 'General case' 0 N--CA 1.493 1.724 0 N-CA-C 109.311 -0.626 . . . . 0.0 109.311 -179.834 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 80' ' ' PHE . . . . . . . . . . . . . 83.1 m-85 -130.58 147.75 52.3 Favored 'General case' 0 N--CA 1.494 1.774 0 O-C-N 121.609 -0.682 . . . . 0.0 109.22 -179.742 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 49.5 mttm -113.67 139.05 49.38 Favored 'General case' 0 N--CA 1.495 1.819 0 N-CA-C 109.173 -0.676 . . . . 0.0 109.173 179.833 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 82' ' ' PHE . . . . . . . . . . . . . 79.2 m-85 -133.19 158.8 41.95 Favored 'General case' 0 N--CA 1.495 1.786 0 CA-C-O 121.496 0.665 . . . . 0.0 109.872 -179.582 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 81.7 tt0 -65.52 -37.66 87.42 Favored 'General case' 0 C--N 1.303 -1.423 0 O-C-N 121.543 -0.723 . . . . 0.0 109.559 179.953 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 84' ' ' VAL . . . . . . . . . . . . . 35.7 m -136.08 159.56 38.89 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.961 0 O-C-N 121.378 -0.826 . . . . 0.0 110.282 -179.549 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 85' ' ' SER . . . . . 0.509 ' O ' ' N ' ' A' ' 88' ' ' LYS . 38.6 t -64.77 -38.95 92.71 Favored 'General case' 0 N--CA 1.49 1.556 0 O-C-N 121.791 -0.568 . . . . 0.0 110.191 -179.946 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 86' ' ' ALA . . . . . . . . . . . . . . . -40.8 -39.46 1.12 Allowed 'General case' 0 N--CA 1.494 1.767 0 O-C-N 121.607 -0.683 . . . . 0.0 110.24 -179.353 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 87' ' ' GLU . . . . . 0.475 ' OE1' ' CG1' ' A' ' 58' ' ' VAL . 79.5 mm-40 -66.02 -34.03 77.16 Favored 'General case' 0 N--CA 1.488 1.432 0 O-C-N 121.508 -0.745 . . . . 0.0 109.477 179.751 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 88' ' ' LYS . . . . . 0.509 ' N ' ' O ' ' A' ' 85' ' ' SER . 88.5 tttt -62.15 -44.9 95.61 Favored 'General case' 0 N--CA 1.489 1.509 0 O-C-N 121.297 -0.877 . . . . 0.0 109.936 -179.988 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 50.7 tp -62.56 -50.35 71.68 Favored 'General case' 0 N--CA 1.489 1.483 0 O-C-N 121.271 -0.893 . . . . 0.0 110.234 -178.905 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 90' ' ' ILE . . . . . 0.543 ' N ' HD12 ' A' ' 90' ' ' ILE . 1.4 mp -69.27 -45.42 79.27 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.567 0 O-C-N 121.302 -0.874 . . . . 0.0 109.853 -179.684 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 91' ' ' PHE . . . . . 0.417 ' CE1' ' HB2' ' A' ' 55' ' ' ALA . 69.7 t80 -62.59 -44.66 95.76 Favored 'General case' 0 N--CA 1.489 1.51 0 O-C-N 121.388 -0.82 . . . . 0.0 110.168 -179.551 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 92' ' ' GLU . . . . . 0.515 ' OE2' ' NH2' ' A' ' 96' ' ' ARG . 83.0 tt0 -62.36 -38.74 90.71 Favored 'General case' 0 C--N 1.305 -1.369 0 O-C-N 121.358 -0.839 . . . . 0.0 109.95 -179.36 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 93' ' ' LEU . . . . . . . . . . . . . 39.3 mt -63.2 -44.4 95.43 Favored 'General case' 0 N--CA 1.49 1.55 0 O-C-N 121.209 -0.932 . . . . 0.0 109.97 -179.574 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 94' ' ' LYS . . . . . . . . . . . . . 60.9 mttp -66.32 -44.15 84.19 Favored 'General case' 0 N--CA 1.488 1.467 0 O-C-N 121.183 -0.948 . . . . 0.0 110.128 -179.993 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 34.3 p -68.31 -35.82 78.39 Favored 'General case' 0 N--CA 1.487 1.423 0 O-C-N 121.338 -0.851 . . . . 0.0 109.714 -179.654 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 96' ' ' ARG . . . . . 0.515 ' NH2' ' OE2' ' A' ' 92' ' ' GLU . 19.3 tpp180 -68.08 -39.53 82.91 Favored 'General case' 0 N--CA 1.488 1.467 0 O-C-N 121.197 -0.94 . . . . 0.0 108.773 179.608 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 97' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.486 1.372 0 O-C-N 121.337 -0.852 . . . . 0.0 109.097 179.935 . . . . . . . . 0 0 . 1 . 004 nuclear nobuild core ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 99.6 m-20 . . . . . 0 N--CA 1.49 1.543 0 CA-C-O 121.363 0.602 . . . . 0.0 109.44 . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild core ' A' A ' 31' ' ' VAL . . . . . 0.443 HG22 ' N ' ' A' ' 32' ' ' ALA . 9.2 p -86.16 161.34 2.98 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.635 0 O-C-N 121.34 -0.85 . . . . 0.0 109.608 -179.67 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 32' ' ' ALA . . . . . 0.443 ' N ' HG22 ' A' ' 31' ' ' VAL . . . -143.61 139.42 29.63 Favored 'General case' 0 N--CA 1.493 1.721 0 O-C-N 121.294 -0.879 . . . . 0.0 109.016 179.835 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 83.7 tt0 -101.38 142.75 32.33 Favored 'General case' 0 N--CA 1.494 1.755 0 O-C-N 121.403 -0.81 . . . . 0.0 109.132 179.989 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 34' ' ' VAL . . . . . . . . . . . . . 52.4 t -122.54 131.56 72.97 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.905 0 N-CA-C 108.905 -0.776 . . . . 0.0 108.905 179.812 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 35.3 m -111.17 123.41 50.15 Favored 'General case' 0 N--CA 1.494 1.735 0 N-CA-C 108.658 -0.867 . . . . 0.0 108.658 179.904 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 26.3 mt -119.23 149.41 41.81 Favored 'General case' 0 N--CA 1.497 1.887 0 O-C-N 121.501 -0.75 . . . . 0.0 109.649 -179.436 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 37' ' ' PHE . . . . . . . . . . . . . 97.0 m-85 -128.74 147.36 50.76 Favored 'General case' 0 N--CA 1.493 1.717 0 N-CA-C 109.083 -0.71 . . . . 0.0 109.083 -179.405 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . -177.79 -177.65 46.75 Favored Glycine 0 N--CA 1.487 2.091 0 N-CA-C 109.474 -1.45 . . . . 0.0 109.474 -179.865 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 8.7 p -87.48 -81.64 0.23 Allowed 'General case' 0 N--CA 1.489 1.498 0 O-C-N 121.387 -1.066 . . . . 0.0 109.824 -179.911 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 40' ' ' ASP . . . . . . . . . . . . . 52.4 p30 -87.78 168.51 12.89 Favored 'General case' 0 N--CA 1.493 1.724 0 O-C-N 121.464 -0.772 . . . . 0.0 110.399 -179.445 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 88.6 tttt -65.93 -36.63 83.9 Favored 'General case' 0 N--CA 1.49 1.555 0 O-C-N 121.674 -0.641 . . . . 0.0 110.188 179.883 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -57.64 -41.62 81.76 Favored 'General case' 0 N--CA 1.492 1.629 0 O-C-N 121.272 -0.893 . . . . 0.0 110.155 -179.106 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 43' ' ' HIS . . . . . . . . . . . . . 80.0 t60 -63.39 -42.13 98.79 Favored 'General case' 0 N--CA 1.489 1.516 0 O-C-N 121.169 -0.957 . . . . 0.0 109.42 -179.788 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 95.3 mt -63.47 -40.54 97.39 Favored 'General case' 0 N--CA 1.489 1.514 0 O-C-N 121.399 -0.813 . . . . 0.0 109.827 -179.671 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 74.5 mt-10 -62.75 -39.68 94.9 Favored 'General case' 0 N--CA 1.488 1.437 0 O-C-N 121.239 -0.913 . . . . 0.0 109.759 -179.639 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . -65.01 -45.17 93.1 Favored Glycine 0 N--CA 1.49 2.287 0 N-CA-C 109.671 -1.372 . . . . 0.0 109.671 -179.844 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 16.9 tptm -64.95 -36.03 83.07 Favored 'General case' 0 N--CA 1.489 1.509 0 O-C-N 121.27 -1.135 . . . . 0.0 109.236 179.882 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 60.8 tp -61.73 -39.5 91.74 Favored 'General case' 0 N--CA 1.488 1.451 0 O-C-N 121.339 -0.851 . . . . 0.0 109.345 -179.707 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 49' ' ' ALA . . . . . . . . . . . . . . . -54.03 -34.01 58.81 Favored 'General case' 0 N--CA 1.488 1.468 0 O-C-N 121.336 -0.852 . . . . 0.0 109.823 -179.627 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 79.3 mm-40 -65.31 -41.04 94.46 Favored 'General case' 0 N--CA 1.491 1.599 0 O-C-N 121.226 -0.921 . . . . 0.0 109.713 -179.981 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 10.8 m-85 -60.78 -39.67 89.72 Favored 'General case' 0 N--CA 1.491 1.581 0 O-C-N 121.487 -0.758 . . . . 0.0 109.552 -179.631 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 52' ' ' ILE . . . . . 0.522 HD12 ' CE1' ' A' ' 64' ' ' TYR . 34.1 mm -63.59 -43.51 98.25 Favored 'Isoleucine or valine' 0 C--N 1.301 -1.536 0 O-C-N 121.39 -0.819 . . . . 0.0 109.491 -179.484 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 53' ' ' SER . . . . . 0.481 ' O ' ' NE2' ' A' ' 57' ' ' GLN . 71.1 m -60.32 -51.7 68.4 Favored 'General case' 0 N--CA 1.492 1.674 0 O-C-N 121.081 -1.012 . . . . 0.0 110.136 -179.488 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 54' ' ' LEU . . . . . 0.444 ' N ' HD12 ' A' ' 54' ' ' LEU . 10.4 mp -65.07 -41.68 94.86 Favored 'General case' 0 N--CA 1.491 1.587 0 O-C-N 121.166 -0.958 . . . . 0.0 109.418 179.785 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -64.67 -39.38 93.57 Favored 'General case' 0 N--CA 1.488 1.428 0 O-C-N 121.282 -0.886 . . . . 0.0 109.731 -179.692 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 56' ' ' LYS . . . . . . . . . . . . . 50.9 tttp -64.08 -45.17 89.91 Favored 'General case' 0 C--N 1.305 -1.36 0 O-C-N 121.237 -0.915 . . . . 0.0 109.393 -179.94 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 57' ' ' GLN . . . . . 0.534 ' OE1' ' N ' ' A' ' 57' ' ' GLN . 0.8 OUTLIER -65.73 -43.78 87.99 Favored 'General case' 0 N--CA 1.488 1.439 0 O-C-N 121.418 -0.801 . . . . 0.0 109.508 -179.853 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 58' ' ' VAL . . . . . . . . . . . . . 56.0 t -63.35 -45.81 97.14 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.39 0 O-C-N 121.25 -0.906 . . . . 0.0 109.453 -179.801 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 59' ' ' TYR . . . . . . . . . . . . . 71.4 t80 -137.79 119.11 14.65 Favored 'General case' 0 N--CA 1.494 1.752 0 O-C-N 121.334 -0.854 . . . . 0.0 109.578 -179.502 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -69.75 153.53 43.24 Favored 'General case' 0 N--CA 1.493 1.682 0 O-C-N 121.563 -0.71 . . . . 0.0 110.538 -179.486 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 61' ' ' ASN . . . . . . . . . . . . . 98.2 m-20 57.73 36.44 26.57 Favored 'General case' 0 N--CA 1.494 1.746 0 O-C-N 121.752 -0.592 . . . . 0.0 109.671 179.897 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 62' ' ' VAL . . . . . . . . . . . . . 12.3 p -72.65 138.45 21.44 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.583 0 O-C-N 121.436 -0.79 . . . . 0.0 109.858 179.933 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 83.1 tt0 -115.61 142.19 47.07 Favored 'General case' 0 N--CA 1.497 1.921 0 O-C-N 121.571 -0.705 . . . . 0.0 109.313 -179.878 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 64' ' ' TYR . . . . . 0.522 ' CE1' HD12 ' A' ' 52' ' ' ILE . 51.4 p90 -148.29 161.27 41.86 Favored 'General case' 0 N--CA 1.493 1.709 0 O-C-N 121.365 -0.834 . . . . 0.0 109.539 -179.866 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 51.1 tp10 -141.0 147.76 39.21 Favored 'General case' 0 N--CA 1.495 1.799 0 N-CA-C 108.687 -0.857 . . . . 0.0 108.687 179.911 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 66' ' ' VAL . . . . . . . . . . . . . 28.8 m -117.82 129.08 74.77 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.805 0 CA-C-O 121.688 0.756 . . . . 0.0 109.953 -179.472 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 67' ' ' ALA . . . . . 0.625 ' HB1' ' HD2' ' A' ' 68' ' ' PRO . . . -70.65 171.81 7.44 Favored Pre-proline 0 N--CA 1.49 1.558 0 O-C-N 121.657 -0.652 . . . . 0.0 109.61 -179.417 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 68' ' ' PRO . . . . . 0.625 ' HD2' ' HB1' ' A' ' 67' ' ' ALA . 73.2 Cg_exo -50.86 129.89 29.2 Favored 'Trans proline' 0 N--CA 1.497 1.7 0 C-N-CA 122.355 2.037 . . . . 0.0 112.399 179.891 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 69' ' ' VAL . . . . . . . . . . . . . 54.4 t -131.04 134.42 61.53 Favored 'Isoleucine or valine' 0 N--CA 1.499 2.016 0 O-C-N 121.455 -0.778 . . . . 0.0 109.247 179.814 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -83.36 159.73 21.78 Favored 'General case' 0 N--CA 1.491 1.577 0 O-C-N 121.434 -0.792 . . . . 0.0 109.897 -179.913 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 53.3 t0 -64.12 -36.08 82.85 Favored 'General case' 0 N--CA 1.491 1.604 0 O-C-N 121.5 -0.75 . . . . 0.0 109.662 179.562 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 72' ' ' ASN . . . . . . . . . . . . . 55.7 p30 -96.67 17.33 16.69 Favored 'General case' 0 N--CA 1.495 1.778 0 O-C-N 121.235 -0.916 . . . . 0.0 109.237 -179.726 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -61.88 144.23 55.23 Favored 'General case' 0 N--CA 1.492 1.64 0 O-C-N 121.414 -0.804 . . . . 0.0 110.167 -179.641 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 74' ' ' THR . . . . . . . . . . . . . 71.8 p -101.79 -3.07 28.69 Favored 'General case' 0 N--CA 1.496 1.826 0 O-C-N 121.48 -0.763 . . . . 0.0 109.467 179.703 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 17.0 pt-20 -148.62 158.69 44.31 Favored 'General case' 0 N--CA 1.494 1.744 0 O-C-N 121.145 -0.972 . . . . 0.0 109.361 179.624 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 5.7 tt -131.7 134.52 46.0 Favored 'General case' 0 N--CA 1.496 1.829 0 O-C-N 121.521 -0.737 . . . . 0.0 109.237 -179.981 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 77' ' ' HIS . . . . . . . . . . . . . 98.2 m-70 -103.28 130.59 50.58 Favored 'General case' 0 N--CA 1.494 1.738 0 N-CA-C 109.255 -0.646 . . . . 0.0 109.255 -179.642 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -142.53 155.01 44.98 Favored 'General case' 0 N--CA 1.494 1.725 0 O-C-N 121.286 -0.884 . . . . 0.0 109.517 -179.726 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 83.9 mtp180 -127.95 148.11 50.5 Favored 'General case' 0 N--CA 1.494 1.745 0 N-CA-C 108.957 -0.757 . . . . 0.0 108.957 -179.86 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 80' ' ' PHE . . . . . . . . . . . . . 62.4 m-85 -129.33 147.83 51.2 Favored 'General case' 0 N--CA 1.496 1.862 0 O-C-N 121.555 -0.716 . . . . 0.0 109.285 -179.572 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 70.9 mmtt -112.6 104.1 12.18 Favored 'General case' 0 N--CA 1.496 1.827 0 N-CA-C 108.79 -0.818 . . . . 0.0 108.79 -179.996 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 82' ' ' PHE . . . . . . . . . . . . . 68.1 m-85 -98.91 148.92 23.47 Favored 'General case' 0 N--CA 1.492 1.636 0 O-C-N 121.591 -0.693 . . . . 0.0 109.871 -179.263 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 82.9 tt0 -65.4 -36.82 85.13 Favored 'General case' 0 N--CA 1.488 1.431 0 O-C-N 121.48 -0.762 . . . . 0.0 109.904 -179.648 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 84' ' ' VAL . . . . . . . . . . . . . 27.4 m -133.49 156.86 42.13 Favored 'Isoleucine or valine' 0 N--CA 1.499 2.021 0 O-C-N 121.333 -0.854 . . . . 0.0 110.073 -179.582 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 27.1 t -70.15 -17.43 63.18 Favored 'General case' 0 N--CA 1.488 1.443 0 O-C-N 121.573 -0.704 . . . . 0.0 109.529 179.899 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 86' ' ' ALA . . . . . . . . . . . . . . . -62.43 -41.17 98.52 Favored 'General case' 0 N--CA 1.49 1.528 0 O-C-N 121.256 -0.902 . . . . 0.0 109.537 -179.722 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 98.9 mt-10 -65.59 -33.51 76.07 Favored 'General case' 0 C--N 1.302 -1.475 0 O-C-N 121.458 -0.776 . . . . 0.0 109.024 179.642 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 88' ' ' LYS . . . . . . . . . . . . . 88.2 tttt -62.98 -43.96 97.36 Favored 'General case' 0 C--N 1.303 -1.433 0 O-C-N 121.449 -0.782 . . . . 0.0 109.979 179.836 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 96.3 mt -62.42 -48.11 81.13 Favored 'General case' 0 N--CA 1.488 1.427 0 O-C-N 121.193 -0.942 . . . . 0.0 109.884 -179.04 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 90' ' ' ILE . . . . . 0.53 ' N ' HD12 ' A' ' 90' ' ' ILE . 1.4 mp -70.58 -44.44 76.8 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.599 0 O-C-N 121.3 -0.875 . . . . 0.0 109.312 179.639 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 91' ' ' PHE . . . . . 0.456 ' O ' HG23 ' A' ' 95' ' ' THR . 70.6 t80 -59.13 -44.56 92.03 Favored 'General case' 0 C--N 1.299 -1.606 0 O-C-N 121.461 -0.774 . . . . 0.0 109.883 -179.196 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 92' ' ' GLU . . . . . . . . . . . . . 42.8 tp10 -63.18 -59.09 5.22 Favored 'General case' 0 N--CA 1.49 1.527 0 O-C-N 121.26 -0.9 . . . . 0.0 110.3 -179.322 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 93' ' ' LEU . . . . . 0.445 ' N ' HD12 ' A' ' 93' ' ' LEU . 8.8 mp -63.1 -42.67 99.63 Favored 'General case' 0 N--CA 1.492 1.65 0 O-C-N 121.315 -0.866 . . . . 0.0 109.954 -179.347 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 94' ' ' LYS . . . . . . . . . . . . . 64.2 tttp -62.86 -45.29 93.27 Favored 'General case' 0 C--N 1.301 -1.505 0 O-C-N 121.298 -0.876 . . . . 0.0 109.834 -179.682 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 95' ' ' THR . . . . . 0.456 HG23 ' O ' ' A' ' 91' ' ' PHE . 22.0 p -65.97 -43.03 89.08 Favored 'General case' 0 N--CA 1.488 1.452 0 O-C-N 121.117 -0.989 . . . . 0.0 109.354 179.709 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 96' ' ' ARG . . . . . . . . . . . . . 93.0 mtt-85 -64.35 -38.51 91.29 Favored 'General case' 0 N--CA 1.487 1.381 0 O-C-N 121.278 -0.889 . . . . 0.0 109.02 179.36 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 97' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.304 -1.388 0 O-C-N 121.537 -0.727 . . . . 0.0 109.182 179.756 . . . . . . . . 0 0 . 1 . 005 nuclear nobuild core ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 44.2 p30 . . . . . 0 N--CA 1.493 1.7 0 N-CA-C 109.007 -0.738 . . . . 0.0 109.007 . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild core ' A' A ' 31' ' ' VAL . . . . . 0.434 ' CG1' HH21 ' A' ' 79' ' ' ARG . 93.3 t -118.71 134.56 61.93 Favored 'Isoleucine or valine' 0 N--CA 1.499 2.016 0 CA-C-O 121.712 0.768 . . . . 0.0 109.452 -179.822 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -98.88 157.2 16.47 Favored 'General case' 0 N--CA 1.494 1.745 0 CA-C-O 121.787 0.803 . . . . 0.0 110.409 -179.019 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 33' ' ' GLU . . . . . 0.424 ' OE1' ' CD ' ' A' ' 79' ' ' ARG . 48.9 tp10 -108.03 126.0 52.22 Favored 'General case' 0 N--CA 1.493 1.7 0 CA-C-O 121.716 0.769 . . . . 0.0 110.13 -179.186 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 34' ' ' VAL . . . . . . . . . . . . . 54.0 t -124.24 133.62 68.85 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.875 0 CA-C-O 121.629 0.728 . . . . 0.0 109.626 179.635 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 74.0 p -137.03 126.91 25.72 Favored 'General case' 0 N--CA 1.494 1.752 0 CA-C-O 121.854 0.835 . . . . 0.0 110.042 179.276 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 40.0 tp -117.41 132.41 56.58 Favored 'General case' 0 N--CA 1.49 1.527 0 CA-C-O 121.665 0.745 . . . . 0.0 109.788 179.74 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 37' ' ' PHE . . . . . . . . . . . . . 90.7 t80 -109.04 131.1 55.4 Favored 'General case' 0 N--CA 1.493 1.707 0 CA-C-O 121.868 0.842 . . . . 0.0 109.582 179.99 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . -173.14 -164.23 28.15 Favored Glycine 0 N--CA 1.487 2.061 0 N-CA-C 109.867 -1.293 . . . . 0.0 109.867 -179.689 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 22.9 t -62.55 -147.56 0.0 OUTLIER 'General case' 0 N--CA 1.49 1.534 0 O-C-N 121.891 -0.77 . . . . 0.0 110.726 -179.237 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 40' ' ' ASP . . . . . . . . . . . . . 44.6 p-10 -55.94 174.77 0.11 Allowed 'General case' 0 N--CA 1.488 1.444 0 CA-C-O 121.771 0.795 . . . . 0.0 110.807 -178.812 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 88.7 tttt -62.53 -41.16 98.69 Favored 'General case' 0 N--CA 1.49 1.554 0 CA-C-O 121.225 0.536 . . . . 0.0 109.868 -179.075 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -53.67 -46.83 70.76 Favored 'General case' 0 N--CA 1.492 1.647 0 O-C-N 121.897 -0.502 . . . . 0.0 109.978 -178.965 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 43' ' ' HIS . . . . . . . . . . . . . 59.1 t-80 -62.96 -40.8 98.78 Favored 'General case' 0 C--N 1.302 -1.476 0 O-C-N 121.749 -0.595 . . . . 0.0 109.462 -179.619 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 95.1 mt -63.33 -39.99 96.08 Favored 'General case' 0 N--CA 1.491 1.592 0 O-C-N 121.805 -0.559 . . . . 0.0 109.546 -179.702 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 95.1 mt-10 -61.28 -41.02 96.24 Favored 'General case' 0 N--CA 1.49 1.555 0 N-CA-C 109.262 -0.644 . . . . 0.0 109.262 -179.756 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . -61.17 -42.5 99.8 Favored Glycine 0 N--CA 1.492 2.376 0 N-CA-C 109.65 -1.38 . . . . 0.0 109.65 -179.725 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 71.2 mmtt -81.53 -21.14 38.76 Favored 'General case' 0 N--CA 1.492 1.647 0 O-C-N 121.702 -0.881 . . . . 0.0 108.953 -179.801 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 44.9 tp -63.41 -40.15 96.42 Favored 'General case' 0 N--CA 1.489 1.504 0 CA-C-O 121.308 0.575 . . . . 0.0 109.48 -179.694 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 49' ' ' ALA . . . . . . . . . . . . . . . -49.89 -38.16 34.52 Favored 'General case' 0 N--CA 1.492 1.628 0 O-C-N 121.846 -0.534 . . . . 0.0 109.933 -178.635 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 50' ' ' GLU . . . . . 0.458 ' OE1' ' N ' ' A' ' 50' ' ' GLU . 56.5 mp0 -68.01 -43.14 79.5 Favored 'General case' 0 N--CA 1.491 1.581 0 O-C-N 121.635 -0.666 . . . . 0.0 109.777 -179.929 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 10.0 m-85 -63.07 -45.48 91.97 Favored 'General case' 0 N--CA 1.492 1.635 0 N-CA-C 109.58 -0.526 . . . . 0.0 109.58 -179.337 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 52' ' ' ILE . . . . . . . . . . . . . 92.0 mt -64.97 -42.75 95.57 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.531 0 N-CA-C 109.331 -0.618 . . . . 0.0 109.331 -179.746 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 49.6 m -57.43 -41.31 80.21 Favored 'General case' 0 N--CA 1.495 1.776 0 O-C-N 121.815 -0.553 . . . . 0.0 109.608 -179.151 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 54' ' ' LEU . . . . . 0.635 HD22 ' NZ ' ' A' ' 94' ' ' LYS . 82.6 mt -63.35 -40.21 96.64 Favored 'General case' 0 N--CA 1.491 1.584 0 N-CA-C 109.336 -0.616 . . . . 0.0 109.336 179.964 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 55' ' ' ALA . . . . . 0.477 ' HB2' ' CE1' ' A' ' 91' ' ' PHE . . . -59.26 -42.77 91.96 Favored 'General case' 0 N--CA 1.489 1.484 0 N-CA-C 109.194 -0.669 . . . . 0.0 109.194 -179.417 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 56' ' ' LYS . . . . . . . . . . . . . 64.1 tttp -65.46 -41.02 93.85 Favored 'General case' 0 N--CA 1.486 1.339 0 CA-C-O 121.265 0.555 . . . . 0.0 109.624 179.984 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 16.5 tt0 -64.07 -43.75 94.5 Favored 'General case' 0 N--CA 1.491 1.58 0 O-C-N 121.76 -0.587 . . . . 0.0 109.587 -179.274 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 58' ' ' VAL . . . . . . . . . . . . . 72.1 t -65.38 -44.89 94.45 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.563 0 N-CA-C 109.561 -0.533 . . . . 0.0 109.561 -179.708 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 59' ' ' TYR . . . . . 0.417 ' O ' ' O ' ' A' ' 60' ' ' ALA . 58.4 t80 -127.12 132.33 50.61 Favored 'General case' 0 N--CA 1.498 1.945 0 CA-C-O 121.812 0.815 . . . . 0.0 109.611 -179.595 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 60' ' ' ALA . . . . . 0.417 ' O ' ' O ' ' A' ' 59' ' ' TYR . . . -42.34 -97.0 0.0 OUTLIER 'General case' 0 N--CA 1.491 1.593 0 CA-C-O 121.378 0.608 . . . . 0.0 110.739 -179.281 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 61' ' ' ASN . . . . . . . . . . . . . 20.2 t-20 -85.05 92.62 8.4 Favored 'General case' 0 N--CA 1.491 1.581 0 CA-C-O 121.713 0.768 . . . . 0.0 109.856 -178.74 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 62' ' ' VAL . . . . . . . . . . . . . 10.9 p -99.45 133.71 41.27 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.717 0 CA-C-O 121.801 0.81 . . . . 0.0 110.037 179.995 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 81.0 tt0 -105.13 143.7 32.95 Favored 'General case' 0 N--CA 1.49 1.546 0 CA-C-O 121.702 0.763 . . . . 0.0 109.283 179.979 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 64' ' ' TYR . . . . . . . . . . . . . 51.0 p90 -151.96 161.15 43.1 Favored 'General case' 0 C--N 1.303 -1.443 0 CA-C-O 121.962 0.887 . . . . 0.0 110.493 -179.594 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 47.7 tp10 -147.18 146.95 30.04 Favored 'General case' 0 N--CA 1.49 1.57 0 CA-C-O 121.729 0.776 . . . . 0.0 109.32 179.83 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 66' ' ' VAL . . . . . . . . . . . . . 88.4 t -102.57 125.13 56.91 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.707 0 CA-C-O 121.866 0.841 . . . . 0.0 109.935 -179.926 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 67' ' ' ALA . . . . . 0.598 ' HB1' ' HD2' ' A' ' 68' ' ' PRO . . . -76.97 171.08 13.36 Favored Pre-proline 0 C--N 1.304 -1.41 0 CA-C-O 121.227 0.536 . . . . 0.0 109.935 -179.72 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 68' ' ' PRO . . . . . 0.598 ' HD2' ' HB1' ' A' ' 67' ' ' ALA . 51.1 Cg_exo -54.48 137.32 72.38 Favored 'Trans proline' 0 N--CA 1.496 1.62 0 C-N-CA 122.965 2.443 . . . . 0.0 113.057 -179.923 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 69' ' ' VAL . . . . . 0.453 ' C ' ' H ' ' A' ' 71' ' ' ASP . 73.2 t -128.39 131.91 68.57 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.928 0 CA-C-O 121.848 0.832 . . . . 0.0 110.087 179.963 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 70' ' ' ALA . . . . . 0.646 ' O ' ' N ' ' A' ' 72' ' ' ASN . . . -74.8 34.25 0.1 Allowed 'General case' 0 N--CA 1.491 1.6 0 CA-C-N 116.154 -0.475 . . . . 0.0 109.963 179.811 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 71' ' ' ASP . . . . . 0.453 ' H ' ' C ' ' A' ' 69' ' ' VAL . 66.4 t0 54.78 -72.52 0.01 OUTLIER 'General case' 0 N--CA 1.493 1.708 0 CA-C-O 121.448 0.642 . . . . 0.0 109.969 179.693 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 72' ' ' ASN . . . . . 0.783 ' O ' HG23 ' A' ' 74' ' ' THR . 63.8 t30 -84.67 12.54 6.99 Favored 'General case' 0 C--N 1.301 -1.533 0 N-CA-C 108.626 -0.879 . . . . 0.0 108.626 179.941 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 73' ' ' ALA . . . . . 0.512 ' HB2' ' HB3' ' A' ' 70' ' ' ALA . . . -52.16 -6.53 0.05 OUTLIER 'General case' 0 N--CA 1.497 1.902 0 N-CA-C 109.503 -0.554 . . . . 0.0 109.503 179.95 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 74' ' ' THR . . . . . 0.783 HG23 ' O ' ' A' ' 72' ' ' ASN . 70.4 p 51.03 11.59 0.1 Allowed 'General case' 0 C--N 1.304 -1.411 0 CA-C-O 121.469 0.652 . . . . 0.0 109.296 -179.771 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 75' ' ' GLU . . . . . 0.49 ' H ' ' C ' ' A' ' 73' ' ' ALA . 81.9 tt0 -149.63 151.98 34.66 Favored 'General case' 0 C--N 1.302 -1.457 0 CA-C-O 121.666 0.746 . . . . 0.0 109.446 179.582 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 7.2 tt -128.31 131.08 48.67 Favored 'General case' 0 N--CA 1.489 1.493 0 CA-C-O 121.796 0.807 . . . . 0.0 109.798 179.848 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 77' ' ' HIS . . . . . . . . . . . . . 98.3 m-70 -101.91 128.87 48.11 Favored 'General case' 0 N--CA 1.495 1.781 0 CA-C-O 121.906 0.86 . . . . 0.0 109.92 -180.0 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -136.0 152.2 50.69 Favored 'General case' 0 N--CA 1.491 1.595 0 CA-C-O 121.674 0.749 . . . . 0.0 109.88 179.991 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 79' ' ' ARG . . . . . 0.434 HH21 ' CG1' ' A' ' 31' ' ' VAL . 50.1 mmm-85 -127.7 144.53 51.07 Favored 'General case' 0 N--CA 1.494 1.74 0 CA-C-O 121.755 0.788 . . . . 0.0 109.544 -179.25 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 80' ' ' PHE . . . . . . . . . . . . . 82.1 m-85 -130.6 150.78 51.64 Favored 'General case' 0 N--CA 1.494 1.741 0 CA-C-O 121.571 0.7 . . . . 0.0 109.819 -179.385 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 63.1 tttm -114.96 127.9 55.96 Favored 'General case' 0 N--CA 1.495 1.793 0 CA-C-O 121.722 0.772 . . . . 0.0 110.041 -179.514 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 82' ' ' PHE . . . . . . . . . . . . . 81.1 m-85 -129.37 143.9 51.03 Favored 'General case' 0 N--CA 1.496 1.852 0 CA-C-O 121.732 0.777 . . . . 0.0 109.904 179.579 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 6.8 pt-20 -69.39 -34.27 74.27 Favored 'General case' 0 N--CA 1.489 1.491 0 N-CA-C 109.487 -0.56 . . . . 0.0 109.487 -179.672 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 84' ' ' VAL . . . . . . . . . . . . . 26.8 m -131.37 161.03 41.86 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.924 0 CA-C-O 121.885 0.85 . . . . 0.0 110.29 -179.629 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 33.6 m -76.54 -17.48 59.22 Favored 'General case' 0 N--CA 1.492 1.653 0 CA-C-N 116.055 -0.521 . . . . 0.0 109.91 -179.209 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 86' ' ' ALA . . . . . . . . . . . . . . . -62.71 -40.83 98.38 Favored 'General case' 0 N--CA 1.491 1.61 0 N-CA-C 109.129 -0.693 . . . . 0.0 109.129 -179.435 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 97.4 mt-10 -71.69 -32.16 67.54 Favored 'General case' 0 N--CA 1.49 1.541 0 N-CA-C 109.112 -0.699 . . . . 0.0 109.112 179.889 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 88' ' ' LYS . . . . . . . . . . . . . 88.0 tttt -62.84 -47.58 82.76 Favored 'General case' 0 N--CA 1.489 1.506 0 O-C-N 121.789 -0.569 . . . . 0.0 109.51 -179.711 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 96.9 mt -63.76 -45.54 89.33 Favored 'General case' 0 N--CA 1.491 1.587 0 O-C-N 121.745 -0.597 . . . . 0.0 110.151 -179.1 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 90' ' ' ILE . . . . . . . . . . . . . 96.9 mt -68.32 -43.96 84.07 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.636 0 CA-C-O 121.399 0.619 . . . . 0.0 109.41 -179.717 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 91' ' ' PHE . . . . . 0.477 ' CE1' ' HB2' ' A' ' 55' ' ' ALA . 40.3 t80 -61.78 -46.95 87.37 Favored 'General case' 0 N--CA 1.489 1.486 0 N-CA-C 109.28 -0.637 . . . . 0.0 109.28 -179.512 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 92' ' ' GLU . . . . . . . . . . . . . 95.4 mt-10 -67.32 -33.76 75.94 Favored 'General case' 0 N--CA 1.489 1.477 0 N-CA-C 109.142 -0.688 . . . . 0.0 109.142 179.751 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 93' ' ' LEU . . . . . . . . . . . . . 49.4 tp -63.75 -45.68 88.74 Favored 'General case' 0 N--CA 1.487 1.379 0 CA-C-O 121.373 0.606 . . . . 0.0 109.42 -179.559 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 94' ' ' LYS . . . . . 0.635 ' NZ ' HD22 ' A' ' 54' ' ' LEU . 7.9 mtpm? -66.98 -44.02 81.51 Favored 'General case' 0 N--CA 1.489 1.515 0 O-C-N 121.749 -0.595 . . . . 0.0 109.812 -179.446 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 67.0 p -67.53 -33.8 75.81 Favored 'General case' 0 N--CA 1.491 1.622 0 O-C-N 121.783 -0.573 . . . . 0.0 109.773 -179.262 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 96' ' ' ARG . . . . . . . . . . . . . 61.3 ttm-85 -62.62 -43.47 98.73 Favored 'General case' 0 N--CA 1.492 1.656 0 O-C-N 121.676 -0.64 . . . . 0.0 109.508 -179.563 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 97' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.492 1.647 0 N-CA-C 109.522 -0.547 . . . . 0.0 109.522 -179.661 . . . . . . . . 0 0 . 1 . 006 nuclear nobuild core ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 96.0 m-20 . . . . . 0 N--CA 1.494 1.77 0 N-CA-C 109.13 -0.693 . . . . 0.0 109.13 . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild core ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 3.8 p -129.22 154.04 39.52 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.861 0 CA-C-O 121.641 0.734 . . . . 0.0 109.799 -179.69 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -122.51 142.02 51.03 Favored 'General case' 0 N--CA 1.496 1.853 0 CA-C-O 121.937 0.875 . . . . 0.0 109.819 -179.896 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 33' ' ' GLU . . . . . 0.4 ' H ' ' HG2' ' A' ' 33' ' ' GLU . 21.9 pt-20 -94.36 138.01 32.83 Favored 'General case' 0 N--CA 1.492 1.669 0 CA-C-O 121.782 0.801 . . . . 0.0 110.444 -179.154 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 34' ' ' VAL . . . . . 0.41 HG13 ' CE2' ' A' ' 51' ' ' TYR . 55.0 t -127.01 130.83 71.32 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.834 0 CA-C-O 121.844 0.83 . . . . 0.0 109.263 179.371 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 51.1 m -133.53 128.73 35.91 Favored 'General case' 0 N--CA 1.495 1.809 0 CA-C-O 121.522 0.677 . . . . 0.0 109.315 179.355 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 74.1 mt -119.43 151.37 38.64 Favored 'General case' 0 N--CA 1.499 1.996 0 CA-C-O 121.863 0.84 . . . . 0.0 110.223 -179.39 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 37' ' ' PHE . . . . . . . . . . . . . 96.1 m-85 -124.56 137.92 54.36 Favored 'General case' 0 N--CA 1.497 1.881 0 CA-C-O 121.866 0.841 . . . . 0.0 109.702 -179.669 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 38' ' ' GLY . . . . . 0.528 ' N ' HD21 ' A' ' 44' ' ' LEU . . . 177.2 179.89 47.73 Favored Glycine 0 N--CA 1.491 2.339 0 N-CA-C 110.296 -1.122 . . . . 0.0 110.296 -179.984 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 36.0 p -88.48 -76.69 0.39 Allowed 'General case' 0 N--CA 1.491 1.605 0 O-C-N 121.718 -0.871 . . . . 0.0 109.877 -179.705 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 40' ' ' ASP . . . . . . . . . . . . . 32.9 t70 -80.36 155.46 27.17 Favored 'General case' 0 N--CA 1.497 1.884 0 O-C-N 121.318 -0.864 . . . . 0.0 110.666 -179.2 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 88.8 tttt -63.37 -39.84 95.63 Favored 'General case' 0 N--CA 1.489 1.48 0 CA-C-O 121.107 0.479 . . . . 0.0 110.117 -179.645 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -54.93 -38.9 68.25 Favored 'General case' 0 N--CA 1.492 1.668 0 O-C-N 121.551 -0.718 . . . . 0.0 109.45 -178.951 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 43' ' ' HIS . . . . . 0.636 ' CE1' ' NZ ' ' A' ' 47' ' ' LYS . 11.5 t-160 -67.54 -42.27 82.97 Favored 'General case' 0 N--CA 1.495 1.778 0 O-C-N 121.751 -0.593 . . . . 0.0 109.409 -179.999 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 44' ' ' LEU . . . . . 0.528 HD21 ' N ' ' A' ' 38' ' ' GLY . 96.0 mt -63.02 -40.54 98.07 Favored 'General case' 0 N--CA 1.487 1.385 0 N-CA-C 106.527 -1.657 . . . . 0.0 106.527 178.72 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 77.0 mm-40 -64.36 -32.04 73.49 Favored 'General case' 0 N--CA 1.487 1.409 0 CA-C-N 115.726 -0.67 . . . . 0.0 109.446 179.241 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . -61.33 -50.0 71.5 Favored Glycine 0 N--CA 1.495 2.589 0 N-CA-C 109.507 -1.437 . . . . 0.0 109.507 -179.756 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 47' ' ' LYS . . . . . 0.636 ' NZ ' ' CE1' ' A' ' 43' ' ' HIS . 62.2 mttp -65.99 -38.62 88.98 Favored 'General case' 0 N--CA 1.49 1.536 0 O-C-N 121.678 -0.895 . . . . 0.0 109.039 179.561 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 61.8 tp -56.07 -34.19 65.73 Favored 'General case' 0 C--N 1.302 -1.471 0 N-CA-C 109.348 -0.612 . . . . 0.0 109.348 -179.167 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 49' ' ' ALA . . . . . . . . . . . . . . . -60.05 -38.07 81.72 Favored 'General case' 0 N--CA 1.492 1.655 0 O-C-N 121.614 -0.679 . . . . 0.0 109.183 -179.601 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 97.0 mt-10 -67.8 -38.51 83.42 Favored 'General case' 0 N--CA 1.491 1.617 0 O-C-N 121.638 -0.664 . . . . 0.0 109.308 179.786 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 51' ' ' TYR . . . . . 0.41 ' CE2' HG13 ' A' ' 34' ' ' VAL . 8.3 m-85 -60.97 -45.5 94.5 Favored 'General case' 0 N--CA 1.493 1.676 0 N-CA-C 108.808 -0.812 . . . . 0.0 108.808 179.889 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 52' ' ' ILE . . . . . . . . . . . . . 92.0 mt -65.11 -44.63 95.55 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.557 0 N-CA-C 109.596 -0.52 . . . . 0.0 109.596 -179.828 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 66.9 m -62.9 -46.58 87.14 Favored 'General case' 0 N--CA 1.494 1.738 0 O-C-N 121.415 -0.803 . . . . 0.0 109.862 -179.459 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 54' ' ' LEU . . . . . . . . . . . . . 93.2 mt -65.94 -42.62 89.78 Favored 'General case' 0 N--CA 1.494 1.737 0 O-C-N 121.648 -0.657 . . . . 0.0 109.858 179.999 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -65.57 -38.82 90.64 Favored 'General case' 0 N--CA 1.491 1.589 0 O-C-N 121.81 -0.556 . . . . 0.0 110.015 -178.913 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 56' ' ' LYS . . . . . . . . . . . . . 66.1 tttm -64.82 -45.47 86.06 Favored 'General case' 0 N--CA 1.487 1.414 0 O-C-N 121.42 -0.8 . . . . 0.0 109.729 -179.426 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 29.0 mt-30 -66.38 -44.23 83.7 Favored 'General case' 0 N--CA 1.493 1.69 0 O-C-N 121.594 -0.692 . . . . 0.0 109.675 -179.606 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 58' ' ' VAL . . . . . . . . . . . . . 74.8 t -65.05 -44.65 95.79 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.536 0 N-CA-C 109.116 -0.698 . . . . 0.0 109.116 -179.637 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 59' ' ' TYR . . . . . . . . . . . . . 9.2 t80 -106.97 -143.5 0.38 Allowed 'General case' 0 N--CA 1.496 1.866 0 CA-C-O 121.498 0.666 . . . . 0.0 109.585 -179.676 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -164.79 125.01 1.96 Allowed 'General case' 0 N--CA 1.491 1.622 0 CA-C-O 121.851 0.834 . . . . 0.0 110.255 179.998 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 61' ' ' ASN . . . . . . . . . . . . . 30.8 t-20 57.92 36.24 26.06 Favored 'General case' 0 N--CA 1.493 1.682 0 CA-C-O 121.816 0.817 . . . . 0.0 109.127 179.738 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 62' ' ' VAL . . . . . . . . . . . . . 5.4 p -67.77 139.28 21.1 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.606 0 CA-C-O 121.776 0.798 . . . . 0.0 110.552 -179.653 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 49.9 tp10 -116.94 147.47 42.22 Favored 'General case' 0 N--CA 1.494 1.736 0 CA-C-O 121.65 0.738 . . . . 0.0 109.241 179.957 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 64' ' ' TYR . . . . . . . . . . . . . 48.3 p90 -149.39 166.18 29.83 Favored 'General case' 0 N--CA 1.49 1.556 0 CA-C-O 122.008 0.909 . . . . 0.0 110.798 -179.323 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 75.5 mm-40 -132.16 147.23 52.41 Favored 'General case' 0 N--CA 1.495 1.791 0 CA-C-O 121.496 0.665 . . . . 0.0 109.475 -179.711 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 66' ' ' VAL . . . . . . . . . . . . . 57.7 t -120.74 130.88 74.1 Favored 'Isoleucine or valine' 0 N--CA 1.5 2.058 0 CA-C-O 121.975 0.893 . . . . 0.0 109.968 -179.571 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -79.22 155.94 76.7 Favored Pre-proline 0 C--N 1.306 -1.299 0 N-CA-C 109.348 -0.612 . . . . 0.0 109.348 -179.484 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 68' ' ' PRO . . . . . . . . . . . . . 89.2 Cg_exo -45.71 127.94 10.39 Favored 'Trans proline' 0 N--CA 1.492 1.409 0 C-N-CA 122.612 2.208 . . . . 0.0 113.075 179.765 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 69' ' ' VAL . . . . . . . . . . . . . 47.9 t -130.89 132.46 63.88 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.898 0 CA-C-O 121.822 0.82 . . . . 0.0 110.057 179.807 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -73.29 151.96 41.14 Favored 'General case' 0 N--CA 1.49 1.527 0 CA-C-O 121.749 0.785 . . . . 0.0 110.146 179.328 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 71' ' ' ASP . . . . . 0.537 ' OD1' ' N ' ' A' ' 72' ' ' ASN . 41.5 p-10 -63.73 -35.11 79.5 Favored 'General case' 0 N--CA 1.489 1.505 0 O-C-N 121.769 -0.582 . . . . 0.0 109.607 -179.825 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 72' ' ' ASN . . . . . 0.537 ' N ' ' OD1' ' A' ' 71' ' ' ASP . 99.2 m-20 -95.59 15.3 20.23 Favored 'General case' 0 N--CA 1.494 1.742 0 N-CA-C 108.972 -0.751 . . . . 0.0 108.972 -179.556 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -61.09 146.93 45.6 Favored 'General case' 0 N--CA 1.498 1.954 0 CA-C-O 121.774 0.797 . . . . 0.0 110.704 -179.645 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 74' ' ' THR . . . . . . . . . . . . . 50.6 p -98.63 -1.68 40.28 Favored 'General case' 0 N--CA 1.498 1.943 0 O-C-N 121.751 -0.593 . . . . 0.0 109.467 -179.758 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 2.9 pp20? -156.13 160.1 39.61 Favored 'General case' 0 N--CA 1.495 1.78 0 O-C-N 121.243 -0.911 . . . . 0.0 110.395 179.695 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 5.4 tt -128.06 135.27 49.61 Favored 'General case' 0 N--CA 1.493 1.707 0 CA-C-O 121.565 0.697 . . . . 0.0 109.876 -179.869 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 77' ' ' HIS . . . . . . . . . . . . . 82.2 t60 -117.22 124.3 48.74 Favored 'General case' 0 N--CA 1.497 1.909 0 CA-C-O 122.143 0.973 . . . . 0.0 109.937 -179.883 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -152.62 159.65 43.22 Favored 'General case' 0 N--CA 1.49 1.565 0 CA-C-O 121.506 0.67 . . . . 0.0 109.591 179.708 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 96.5 mtt-85 -127.07 149.82 49.75 Favored 'General case' 0 N--CA 1.497 1.917 0 CA-C-O 121.553 0.692 . . . . 0.0 109.841 -179.528 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 80' ' ' PHE . . . . . . . . . . . . . 35.8 m-85 -122.9 149.68 43.91 Favored 'General case' 0 N--CA 1.497 1.902 0 CA-C-O 121.736 0.779 . . . . 0.0 109.62 -179.653 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 49.7 mtmt -108.56 115.12 29.51 Favored 'General case' 0 N--CA 1.494 1.749 0 CA-C-O 121.62 0.724 . . . . 0.0 109.437 -179.505 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 82' ' ' PHE . . . . . 0.677 ' C ' ' H ' ' A' ' 84' ' ' VAL . 53.6 m-85 -110.56 -0.7 17.21 Favored 'General case' 0 N--CA 1.497 1.889 0 N-CA-C 108.567 -0.901 . . . . 0.0 108.567 179.643 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 41.7 mm-40 63.62 -20.99 0.06 Allowed 'General case' 0 N--CA 1.492 1.657 0 N-CA-C 109.277 -0.638 . . . . 0.0 109.277 179.936 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 84' ' ' VAL . . . . . 0.677 ' H ' ' C ' ' A' ' 82' ' ' PHE . 3.3 m -133.83 133.58 56.49 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.519 0 CA-C-O 121.822 0.82 . . . . 0.0 109.674 -179.621 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 85' ' ' SER . . . . . 0.52 ' O ' ' N ' ' A' ' 88' ' ' LYS . 14.2 t -64.97 -41.0 95.82 Favored 'General case' 0 C--N 1.3 -1.581 0 CA-C-O 121.214 0.531 . . . . 0.0 110.156 179.919 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 86' ' ' ALA . . . . . 0.423 ' C ' ' O ' ' A' ' 85' ' ' SER . . . -41.15 -38.13 1.02 Allowed 'General case' 0 N--CA 1.496 1.854 0 O-C-N 121.514 -0.742 . . . . 0.0 110.121 -178.802 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -69.95 -32.88 71.36 Favored 'General case' 0 N--CA 1.489 1.5 0 O-C-N 121.481 -0.762 . . . . 0.0 109.517 -179.886 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 88' ' ' LYS . . . . . 0.52 ' N ' ' O ' ' A' ' 85' ' ' SER . 64.3 tttm -61.67 -47.19 86.49 Favored 'General case' 0 C--N 1.3 -1.569 0 O-C-N 121.845 -0.534 . . . . 0.0 109.88 -178.937 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 96.0 mt -64.76 -47.92 76.4 Favored 'General case' 0 N--CA 1.493 1.703 0 O-C-N 121.67 -0.644 . . . . 0.0 110.464 -178.94 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 90' ' ' ILE . . . . . . . . . . . . . 96.3 mt -69.6 -43.97 79.95 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.647 0 O-C-N 121.637 -0.665 . . . . 0.0 109.64 -179.887 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 91' ' ' PHE . . . . . . . . . . . . . 82.6 t80 -62.26 -44.74 95.85 Favored 'General case' 0 N--CA 1.493 1.717 0 O-C-N 121.59 -0.694 . . . . 0.0 109.354 -179.979 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 92' ' ' GLU . . . . . . . . . . . . . 81.4 tt0 -63.55 -43.12 97.99 Favored 'General case' 0 N--CA 1.489 1.507 0 N-CA-C 109.309 -0.626 . . . . 0.0 109.309 -179.576 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 93' ' ' LEU . . . . . 0.612 ' O ' HD23 ' A' ' 93' ' ' LEU . 2.8 tt -63.26 -47.26 83.14 Favored 'General case' 0 N--CA 1.489 1.498 0 CA-C-O 121.667 0.746 . . . . 0.0 109.624 -179.119 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 94' ' ' LYS . . . . . . . . . . . . . 55.2 mtpt -63.9 -44.97 91.4 Favored 'General case' 0 N--CA 1.49 1.559 0 O-C-N 121.492 -0.755 . . . . 0.0 109.792 -179.177 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 14.4 p -66.48 -39.86 89.0 Favored 'General case' 0 N--CA 1.492 1.625 0 O-C-N 121.794 -0.566 . . . . 0.0 110.037 -179.539 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 96' ' ' ARG . . . . . . . . . . . . . 16.1 tpt85 -70.77 -17.99 62.77 Favored 'General case' 0 C--N 1.3 -1.555 0 O-C-N 121.562 -0.711 . . . . 0.0 109.788 -179.484 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 97' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.491 1.604 0 O-C-N 121.624 -0.673 . . . . 0.0 109.761 -179.25 . . . . . . . . 0 0 . 1 . 007 nuclear nobuild core ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 38.3 p30 . . . . . 0 N--CA 1.495 1.78 0 N-CA-C 108.822 -0.807 . . . . 0.0 108.822 . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild core ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 53.3 t -115.99 133.59 61.97 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.9 0 CA-C-O 121.795 0.807 . . . . 0.0 109.41 179.934 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -97.98 154.18 17.86 Favored 'General case' 0 N--CA 1.494 1.744 0 CA-C-O 121.871 0.843 . . . . 0.0 110.135 -179.47 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 33' ' ' GLU . . . . . 0.508 ' OE2' ' NE2' ' A' ' 77' ' ' HIS . 49.7 tp10 -101.58 124.21 46.87 Favored 'General case' 0 N--CA 1.492 1.645 0 CA-C-O 121.515 0.674 . . . . 0.0 109.528 -179.667 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 34' ' ' VAL . . . . . . . . . . . . . 55.7 t -124.24 131.99 72.02 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.791 0 CA-C-O 121.889 0.852 . . . . 0.0 109.689 179.774 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 38.1 t -136.11 138.78 42.41 Favored 'General case' 0 N--CA 1.492 1.637 0 CA-C-O 121.545 0.688 . . . . 0.0 109.35 179.498 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 47.2 tp -126.89 139.33 53.16 Favored 'General case' 0 N--CA 1.493 1.719 0 CA-C-O 121.795 0.807 . . . . 0.0 110.076 -179.664 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 37' ' ' PHE . . . . . . . . . . . . . 96.9 m-85 -112.36 144.77 41.23 Favored 'General case' 0 N--CA 1.496 1.828 0 CA-C-O 121.797 0.808 . . . . 0.0 109.694 179.917 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . -171.0 176.35 44.41 Favored Glycine 0 N--CA 1.489 2.226 0 N-CA-C 110.23 -1.148 . . . . 0.0 110.23 -179.909 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 1.7 m -83.55 -71.59 0.5 Allowed 'General case' 0 N--CA 1.489 1.482 0 O-C-N 121.854 -0.792 . . . . 0.0 109.751 -179.758 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 40' ' ' ASP . . . . . . . . . . . . . 37.0 t70 -98.78 159.06 15.22 Favored 'General case' 0 N--CA 1.498 1.96 0 CA-C-O 121.952 0.882 . . . . 0.0 110.65 -179.223 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 41' ' ' LYS . . . . . 0.43 ' O ' ' OE1' ' A' ' 45' ' ' GLU . 64.5 tttm -62.79 -42.26 99.63 Favored 'General case' 0 N--CA 1.491 1.587 0 CA-C-N 116.091 -0.504 . . . . 0.0 110.213 -179.971 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -49.88 -43.08 49.15 Favored 'General case' 0 N--CA 1.493 1.71 0 O-C-N 121.591 -0.693 . . . . 0.0 109.747 -178.828 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 43' ' ' HIS . . . . . . . . . . . . . 79.7 m-70 -67.47 -42.42 83.04 Favored 'General case' 0 N--CA 1.49 1.527 0 O-C-N 121.701 -0.624 . . . . 0.0 109.506 -179.933 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 81.8 mt -64.27 -44.0 93.07 Favored 'General case' 0 N--CA 1.494 1.737 0 O-C-N 121.742 -0.599 . . . . 0.0 109.792 -179.633 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 45' ' ' GLU . . . . . 0.503 ' OE1' ' N ' ' A' ' 45' ' ' GLU . 2.7 mp0 -66.7 -40.51 88.51 Favored 'General case' 0 N--CA 1.488 1.474 0 O-C-N 121.69 -0.631 . . . . 0.0 109.352 -179.799 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . -60.72 -44.73 97.59 Favored Glycine 0 N--CA 1.492 2.397 0 N-CA-C 109.699 -1.36 . . . . 0.0 109.699 -179.189 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 54.9 mtpt -71.16 -25.6 62.62 Favored 'General case' 0 N--CA 1.49 1.532 0 O-C-N 121.781 -0.835 . . . . 0.0 109.102 179.843 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 48' ' ' LEU . . . . . 0.59 HD13 ' O ' ' A' ' 48' ' ' LEU . 0.3 OUTLIER -61.52 -44.86 96.29 Favored 'General case' 0 C--N 1.303 -1.434 0 O-C-N 121.572 -0.705 . . . . 0.0 109.353 -179.102 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 49' ' ' ALA . . . . . . . . . . . . . . . -53.83 -35.85 61.9 Favored 'General case' 0 N--CA 1.493 1.721 0 O-C-N 121.442 -0.786 . . . . 0.0 109.488 -179.328 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 72.9 mm-40 -69.16 -37.28 78.13 Favored 'General case' 0 N--CA 1.491 1.597 0 N-CA-C 109.258 -0.645 . . . . 0.0 109.258 -179.983 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 4.4 m-85 -63.46 -39.37 94.28 Favored 'General case' 0 N--CA 1.496 1.859 0 O-C-N 121.669 -0.644 . . . . 0.0 109.496 -179.458 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 52' ' ' ILE . . . . . 0.581 HD12 ' CZ ' ' A' ' 64' ' ' TYR . 31.9 mm -64.07 -44.28 97.68 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.611 0 O-C-N 121.634 -0.666 . . . . 0.0 109.626 -179.424 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 66.9 m -60.55 -41.62 94.91 Favored 'General case' 0 N--CA 1.493 1.7 0 O-C-N 121.815 -0.553 . . . . 0.0 109.574 -179.696 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 54' ' ' LEU . . . . . . . . . . . . . 95.4 mt -64.04 -40.49 96.42 Favored 'General case' 0 N--CA 1.492 1.634 0 O-C-N 121.658 -0.651 . . . . 0.0 109.315 -179.926 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -57.92 -46.47 84.95 Favored 'General case' 0 N--CA 1.491 1.619 0 CA-C-O 121.148 0.499 . . . . 0.0 110.147 -178.984 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 56' ' ' LYS . . . . . 0.447 ' HZ2' HG22 ' A' ' 52' ' ' ILE . 62.7 mttp -64.59 -41.53 96.18 Favored 'General case' 0 N--CA 1.491 1.584 0 O-C-N 121.631 -0.668 . . . . 0.0 109.955 -179.742 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 88.2 mt-30 -64.66 -43.65 92.93 Favored 'General case' 0 N--CA 1.491 1.598 0 O-C-N 121.499 -0.751 . . . . 0.0 109.287 -179.726 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 58' ' ' VAL . . . . . . . . . . . . . 77.9 t -65.92 -44.54 92.47 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.619 0 O-C-N 121.742 -0.599 . . . . 0.0 109.419 -179.881 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 59' ' ' TYR . . . . . 0.404 ' O ' ' O ' ' A' ' 60' ' ' ALA . 75.8 t80 -137.47 151.56 48.6 Favored 'General case' 0 N--CA 1.496 1.861 0 CA-C-O 121.913 0.863 . . . . 0.0 110.318 -179.521 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 60' ' ' ALA . . . . . 0.538 ' O ' ' N ' ' A' ' 62' ' ' VAL . . . -59.85 -143.3 0.0 OUTLIER 'General case' 0 N--CA 1.491 1.587 0 CA-C-O 121.449 0.642 . . . . 0.0 110.693 -179.298 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 61' ' ' ASN . . . . . . . . . . . . . 99.3 m-20 -43.67 91.6 0.0 OUTLIER 'General case' 0 N--CA 1.495 1.802 0 CA-C-O 121.85 0.834 . . . . 0.0 109.879 -178.836 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 62' ' ' VAL . . . . . 0.538 ' N ' ' O ' ' A' ' 60' ' ' ALA . 13.2 p -99.42 132.58 44.58 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.503 0 CA-C-O 121.897 0.856 . . . . 0.0 110.279 -179.438 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 63' ' ' GLU . . . . . 0.533 ' OE1' ' N ' ' A' ' 63' ' ' GLU . 57.1 mp0 -105.42 136.51 44.84 Favored 'General case' 0 N--CA 1.492 1.637 0 CA-C-O 121.726 0.774 . . . . 0.0 109.44 -179.764 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 64' ' ' TYR . . . . . 0.581 ' CZ ' HD12 ' A' ' 52' ' ' ILE . 53.5 p90 -149.6 161.84 41.38 Favored 'General case' 0 N--CA 1.491 1.584 0 CA-C-O 121.778 0.799 . . . . 0.0 110.246 -179.516 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 48.7 tp10 -143.39 144.76 32.18 Favored 'General case' 0 N--CA 1.493 1.703 0 CA-C-O 121.736 0.779 . . . . 0.0 109.266 179.412 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 66' ' ' VAL . . . . . . . . . . . . . 14.7 p -121.27 129.95 75.13 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.713 0 CA-C-O 121.866 0.841 . . . . 0.0 109.893 -179.852 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 67' ' ' ALA . . . . . 0.479 ' HB1' ' HD2' ' A' ' 68' ' ' PRO . . . -77.76 159.85 75.63 Favored Pre-proline 0 N--CA 1.49 1.55 0 N-CA-C 109.398 -0.593 . . . . 0.0 109.398 -179.699 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 68' ' ' PRO . . . . . 0.479 ' HD2' ' HB1' ' A' ' 67' ' ' ALA . 17.9 Cg_endo -59.58 140.28 93.07 Favored 'Trans proline' 0 C--N 1.309 -1.545 0 C-N-CA 122.579 2.186 . . . . 0.0 112.57 179.41 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 69' ' ' VAL . . . . . . . . . . . . . 49.6 t -133.8 136.21 54.3 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.787 0 CA-C-O 121.835 0.826 . . . . 0.0 110.074 -179.723 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -76.69 165.52 24.63 Favored 'General case' 0 N--CA 1.492 1.654 0 CA-C-O 121.875 0.845 . . . . 0.0 110.504 -179.953 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 62.0 t0 -63.14 -44.45 95.51 Favored 'General case' 0 N--CA 1.489 1.487 0 CA-C-O 121.224 0.535 . . . . 0.0 109.926 -179.614 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 72' ' ' ASN . . . . . . . . . . . . . 98.5 m-20 -99.75 24.91 7.75 Favored 'General case' 0 N--CA 1.494 1.768 0 N-CA-C 109.347 -0.612 . . . . 0.0 109.347 -179.146 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 73' ' ' ALA . . . . . 0.55 ' C ' ' H ' ' A' ' 75' ' ' GLU . . . -64.47 -26.11 68.3 Favored 'General case' 0 N--CA 1.492 1.666 0 O-C-N 121.607 -0.683 . . . . 0.0 109.228 179.825 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 74' ' ' THR . . . . . 0.48 ' OG1' ' O ' ' A' ' 73' ' ' ALA . 63.0 p 53.35 4.04 0.04 OUTLIER 'General case' 0 N--CA 1.493 1.683 0 CA-C-O 121.256 0.55 . . . . 0.0 109.625 -179.347 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 75' ' ' GLU . . . . . 0.55 ' H ' ' C ' ' A' ' 73' ' ' ALA . 96.5 mt-10 -144.69 156.83 44.28 Favored 'General case' 0 N--CA 1.491 1.605 0 CA-C-O 121.975 0.893 . . . . 0.0 110.135 179.85 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 4.1 tt -141.24 141.09 34.03 Favored 'General case' 0 C--N 1.304 -1.405 0 CA-C-O 121.622 0.725 . . . . 0.0 109.857 -179.907 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 77' ' ' HIS . . . . . 0.508 ' NE2' ' OE2' ' A' ' 33' ' ' GLU . 63.1 t-80 -120.38 128.48 53.26 Favored 'General case' 0 N--CA 1.494 1.735 0 CA-C-O 121.928 0.87 . . . . 0.0 109.763 -179.978 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -150.16 155.21 39.37 Favored 'General case' 0 N--CA 1.49 1.536 0 CA-C-O 121.688 0.756 . . . . 0.0 109.696 179.937 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 33.2 ptt-85 -135.03 153.16 52.16 Favored 'General case' 0 N--CA 1.495 1.778 0 CA-C-O 121.814 0.816 . . . . 0.0 109.845 -179.778 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 80' ' ' PHE . . . . . . . . . . . . . 45.5 m-85 -133.16 153.38 51.58 Favored 'General case' 0 N--CA 1.495 1.821 0 CA-C-O 121.694 0.759 . . . . 0.0 110.175 -179.265 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 64.2 tttm -107.4 125.66 51.5 Favored 'General case' 0 N--CA 1.496 1.841 0 CA-C-O 121.595 0.712 . . . . 0.0 109.366 179.968 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 82' ' ' PHE . . . . . . . . . . . . . 63.1 m-85 -123.21 146.51 47.76 Favored 'General case' 0 N--CA 1.495 1.821 0 CA-C-O 121.615 0.721 . . . . 0.0 109.936 -179.896 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 81.3 tt0 -69.04 -37.88 78.83 Favored 'General case' 0 N--CA 1.491 1.595 0 N-CA-C 109.222 -0.658 . . . . 0.0 109.222 -179.579 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 84' ' ' VAL . . . . . . . . . . . . . 35.1 m -135.79 159.11 39.72 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.926 0 CA-C-O 121.889 0.852 . . . . 0.0 109.984 -179.933 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 85' ' ' SER . . . . . 0.481 ' O ' ' N ' ' A' ' 88' ' ' LYS . 11.2 t -63.62 -42.61 98.19 Favored 'General case' 0 N--CA 1.49 1.563 0 CA-C-O 121.193 0.521 . . . . 0.0 110.08 -179.775 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 86' ' ' ALA . . . . . . . . . . . . . . . -41.23 -40.95 1.73 Allowed 'General case' 0 N--CA 1.494 1.752 0 CA-C-O 121.278 0.561 . . . . 0.0 110.07 -178.976 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 96.6 mt-10 -67.52 -33.17 74.53 Favored 'General case' 0 N--CA 1.491 1.577 0 O-C-N 121.677 -0.64 . . . . 0.0 109.64 -179.829 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 88' ' ' LYS . . . . . 0.481 ' N ' ' O ' ' A' ' 85' ' ' SER . 64.4 tttm -62.37 -45.61 92.38 Favored 'General case' 0 N--CA 1.493 1.677 0 O-C-N 121.645 -0.659 . . . . 0.0 109.673 -179.627 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 89' ' ' LEU . . . . . 0.494 HD22 ' N ' ' A' ' 89' ' ' LEU . 3.8 mm? -64.3 -42.05 96.56 Favored 'General case' 0 N--CA 1.492 1.633 0 O-C-N 121.519 -0.738 . . . . 0.0 109.796 -179.447 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 90' ' ' ILE . . . . . . . . . . . . . 95.3 mt -65.99 -44.23 92.36 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.669 0 CA-C-O 121.325 0.583 . . . . 0.0 109.934 -179.398 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 91' ' ' PHE . . . . . . . . . . . . . 71.3 t80 -61.97 -45.58 93.01 Favored 'General case' 0 N--CA 1.493 1.707 0 O-C-N 121.689 -0.632 . . . . 0.0 109.993 -179.18 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 92' ' ' GLU . . . . . 0.555 ' N ' ' OE1' ' A' ' 92' ' ' GLU . 1.9 mp0 -64.8 -37.98 89.44 Favored 'General case' 0 N--CA 1.491 1.592 0 O-C-N 121.555 -0.716 . . . . 0.0 110.175 -178.976 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 93' ' ' LEU . . . . . . . . . . . . . 5.1 tt -62.11 -45.17 94.66 Favored 'General case' 0 C--N 1.299 -1.599 0 O-C-N 121.472 -0.767 . . . . 0.0 109.958 -178.845 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 94' ' ' LYS . . . . . . . . . . . . . 98.8 mttt -66.14 -43.13 87.95 Favored 'General case' 0 N--CA 1.493 1.694 0 O-C-N 121.826 -0.546 . . . . 0.0 110.045 -179.508 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 21.2 p -67.94 -38.08 82.41 Favored 'General case' 0 N--CA 1.493 1.708 0 O-C-N 121.557 -0.714 . . . . 0.0 109.629 -179.217 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 96' ' ' ARG . . . . . . . . . . . . . 73.6 mmt-85 -64.47 -40.86 96.49 Favored 'General case' 0 C--N 1.301 -1.502 0 O-C-N 121.592 -0.692 . . . . 0.0 109.639 -179.891 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 97' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.302 -1.472 0 N-CA-C 108.994 -0.743 . . . . 0.0 108.994 -179.93 . . . . . . . . 0 0 . 1 . 008 nuclear nobuild core ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 34.8 t0 . . . . . 0 N--CA 1.491 1.608 0 CA-C-O 121.505 0.669 . . . . 0.0 109.513 . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild core ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 53.6 t -117.79 133.93 63.01 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.802 0 CA-C-O 121.854 0.835 . . . . 0.0 109.276 179.989 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 32' ' ' ALA . . . . . 0.703 ' HB1' ' HZ2' ' A' ' 88' ' ' LYS . . . -99.22 151.67 20.76 Favored 'General case' 0 N--CA 1.49 1.528 0 CA-C-O 121.698 0.761 . . . . 0.0 109.838 -179.637 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 33' ' ' GLU . . . . . 0.543 ' N ' ' OE1' ' A' ' 33' ' ' GLU . 57.4 mp0 -110.17 120.04 41.2 Favored 'General case' 0 N--CA 1.492 1.675 0 CA-C-O 121.619 0.723 . . . . 0.0 109.442 -179.853 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 34' ' ' VAL . . . . . . . . . . . . . 55.0 t -125.42 133.8 68.37 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.73 0 CA-C-O 121.88 0.848 . . . . 0.0 109.605 179.996 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 15.6 m -153.87 138.94 17.33 Favored 'General case' 0 N--CA 1.49 1.532 0 CA-C-O 121.768 0.794 . . . . 0.0 109.425 179.412 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 36' ' ' LEU . . . . . 0.452 HD12 ' N ' ' A' ' 36' ' ' LEU . 8.2 mp -107.73 152.95 23.65 Favored 'General case' 0 N--CA 1.495 1.797 0 CA-C-O 121.823 0.821 . . . . 0.0 109.833 -179.628 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 37' ' ' PHE . . . . . . . . . . . . . 91.8 m-85 -127.67 149.14 50.34 Favored 'General case' 0 N--CA 1.491 1.58 0 CA-C-O 121.929 0.871 . . . . 0.0 109.962 -179.518 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 38' ' ' GLY . . . . . 0.426 ' O ' ' O ' ' A' ' 39' ' ' SER . . . 84.63 178.17 51.23 Favored Glycine 0 N--CA 1.487 2.084 0 N-CA-C 110.396 -1.082 . . . . 0.0 110.396 179.442 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 39' ' ' SER . . . . . 0.524 ' HG ' ' CG ' ' A' ' 43' ' ' HIS . 0.3 OUTLIER 55.66 159.78 0.01 OUTLIER 'General case' 0 N--CA 1.488 1.467 0 CA-C-O 121.659 0.743 . . . . 0.0 110.483 179.819 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 40' ' ' ASP . . . . . . . . . . . . . 54.9 p-10 -79.94 174.26 11.77 Favored 'General case' 0 N--CA 1.489 1.492 0 CA-C-O 121.906 0.86 . . . . 0.0 110.785 -179.11 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 41' ' ' LYS . . . . . 0.424 ' O ' ' OE1' ' A' ' 45' ' ' GLU . 21.1 tptm -59.48 -45.54 91.36 Favored 'General case' 0 C--N 1.306 -1.306 0 CA-C-N 116.022 -0.536 . . . . 0.0 110.105 -179.362 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -57.65 -47.32 82.6 Favored 'General case' 0 N--CA 1.492 1.645 0 O-C-N 121.735 -0.603 . . . . 0.0 109.886 -178.828 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 43' ' ' HIS . . . . . 0.524 ' CG ' ' HG ' ' A' ' 39' ' ' SER . 58.7 t-80 -68.33 -35.77 78.26 Favored 'General case' 0 N--CA 1.49 1.572 0 O-C-N 121.628 -0.67 . . . . 0.0 109.683 -179.736 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 13.9 mt -61.94 -42.53 99.21 Favored 'General case' 0 N--CA 1.492 1.67 0 O-C-N 121.625 -0.672 . . . . 0.0 109.386 -179.013 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 45' ' ' GLU . . . . . 0.512 ' OE1' ' N ' ' A' ' 45' ' ' GLU . 1.2 mp0 -63.32 -46.57 86.06 Favored 'General case' 0 N--CA 1.485 1.323 0 O-C-N 121.681 -0.637 . . . . 0.0 109.389 -179.587 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . -61.81 -44.22 98.17 Favored Glycine 0 N--CA 1.49 2.279 0 N-CA-C 109.044 -1.622 . . . . 0.0 109.044 -179.602 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 41.3 tptt -67.22 -35.41 79.54 Favored 'General case' 0 N--CA 1.485 1.315 0 O-C-N 121.834 -0.804 . . . . 0.0 109.039 179.887 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 27.1 tp -58.17 -29.99 66.05 Favored 'General case' 0 N--CA 1.492 1.638 0 N-CA-C 108.805 -0.813 . . . . 0.0 108.805 -179.394 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 49' ' ' ALA . . . . . . . . . . . . . . . -49.62 -27.93 5.18 Favored 'General case' 0 N--CA 1.492 1.651 0 CA-C-O 121.154 0.502 . . . . 0.0 109.988 -179.33 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 50' ' ' GLU . . . . . 0.507 ' CG ' ' N ' ' A' ' 51' ' ' TYR . 16.4 pt-20 -69.41 -42.36 75.15 Favored 'General case' 0 N--CA 1.489 1.514 0 CA-C-O 121.647 0.737 . . . . 0.0 109.281 -179.875 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 51' ' ' TYR . . . . . 0.507 ' N ' ' CG ' ' A' ' 50' ' ' GLU . 22.4 m-85 -60.91 -48.89 79.75 Favored 'General case' 0 N--CA 1.488 1.468 0 O-C-N 121.733 -0.605 . . . . 0.0 109.787 -178.638 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 52' ' ' ILE . . . . . . . . . . . . . 94.6 mt -66.5 -43.39 90.87 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.637 0 CA-C-O 121.201 0.525 . . . . 0.0 109.817 -179.479 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 68.3 m -59.78 -58.18 9.67 Favored 'General case' 0 N--CA 1.493 1.714 0 O-C-N 121.762 -0.587 . . . . 0.0 110.047 -178.567 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 54' ' ' LEU . . . . . 0.427 ' N ' HD22 ' A' ' 54' ' ' LEU . 4.1 mm? -64.03 -40.84 97.21 Favored 'General case' 0 C--N 1.301 -1.512 0 O-C-N 121.717 -0.614 . . . . 0.0 109.943 -179.724 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -60.05 -43.07 95.62 Favored 'General case' 0 N--CA 1.489 1.523 0 N-CA-C 109.508 -0.553 . . . . 0.0 109.508 -179.126 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 56' ' ' LYS . . . . . . . . . . . . . 65.8 tttm -65.36 -43.4 90.93 Favored 'General case' 0 C--N 1.307 -1.276 0 O-C-N 121.713 -0.617 . . . . 0.0 109.534 -179.981 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 87.7 mt-30 -65.21 -44.24 88.99 Favored 'General case' 0 N--CA 1.491 1.62 0 O-C-N 121.841 -0.537 . . . . 0.0 109.693 -179.393 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 58' ' ' VAL . . . . . . . . . . . . . 77.3 t -64.47 -44.8 97.0 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.536 0 N-CA-C 109.143 -0.688 . . . . 0.0 109.143 -179.667 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 59' ' ' TYR . . . . . 0.434 ' CE1' ' O ' ' A' ' 60' ' ' ALA . 54.5 t80 -130.58 120.25 23.74 Favored 'General case' 0 N--CA 1.495 1.806 0 CA-C-O 121.829 0.823 . . . . 0.0 109.727 -179.874 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 60' ' ' ALA . . . . . 0.434 ' O ' ' CE1' ' A' ' 59' ' ' TYR . . . -69.2 145.71 52.98 Favored 'General case' 0 N--CA 1.489 1.487 0 CA-C-O 121.623 0.725 . . . . 0.0 110.55 -179.771 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 61' ' ' ASN . . . . . . . . . . . . . 32.2 t-20 57.82 42.24 23.62 Favored 'General case' 0 N--CA 1.494 1.765 0 CA-C-O 121.325 0.583 . . . . 0.0 109.745 179.643 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 62' ' ' VAL . . . . . . . . . . . . . 12.6 p -68.87 137.85 23.52 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.628 0 CA-C-O 121.551 0.691 . . . . 0.0 110.179 179.959 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 63' ' ' GLU . . . . . 0.541 ' OE1' ' N ' ' A' ' 63' ' ' GLU . 57.1 mp0 -112.06 137.71 49.71 Favored 'General case' 0 N--CA 1.494 1.769 0 CA-C-O 121.81 0.814 . . . . 0.0 109.587 -179.752 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 64' ' ' TYR . . . . . . . . . . . . . 55.5 p90 -155.8 164.84 38.03 Favored 'General case' 0 N--CA 1.487 1.417 0 CA-C-O 121.931 0.872 . . . . 0.0 110.413 -179.693 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 83.0 tt0 -142.5 153.69 43.84 Favored 'General case' 0 N--CA 1.491 1.622 0 CA-C-O 121.56 0.695 . . . . 0.0 109.318 179.832 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 66' ' ' VAL . . . . . . . . . . . . . 2.9 p -123.53 132.32 71.58 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.794 0 CA-C-O 122.085 0.945 . . . . 0.0 109.887 -179.744 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 67' ' ' ALA . . . . . 0.481 ' HB1' ' HD2' ' A' ' 68' ' ' PRO . . . -85.89 160.23 53.05 Favored Pre-proline 0 N--CA 1.491 1.585 0 N-CA-C 109.221 -0.659 . . . . 0.0 109.221 179.945 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 68' ' ' PRO . . . . . 0.481 ' HD2' ' HB1' ' A' ' 67' ' ' ALA . 28.4 Cg_endo -59.83 134.67 58.56 Favored 'Trans proline' 0 C--N 1.307 -1.631 0 C-N-CA 122.728 2.286 . . . . 0.0 112.593 179.666 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 69' ' ' VAL . . . . . . . . . . . . . 99.5 t -138.63 139.15 41.67 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.8 0 CA-C-O 121.766 0.793 . . . . 0.0 110.442 179.82 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -67.08 154.64 40.7 Favored 'General case' 0 N--CA 1.488 1.47 0 CA-C-O 121.794 0.807 . . . . 0.0 110.018 179.787 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 71' ' ' ASP . . . . . 0.545 ' OD1' ' N ' ' A' ' 72' ' ' ASN . 42.3 p-10 -63.92 -34.44 77.96 Favored 'General case' 0 C--N 1.302 -1.465 0 CA-C-O 121.424 0.631 . . . . 0.0 109.45 -179.597 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 72' ' ' ASN . . . . . 0.545 ' N ' ' OD1' ' A' ' 71' ' ' ASP . 8.1 m120 -104.28 28.32 6.97 Favored 'General case' 0 N--CA 1.494 1.773 0 N-CA-C 109.114 -0.699 . . . . 0.0 109.114 -179.474 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 73' ' ' ALA . . . . . 0.445 ' C ' ' H ' ' A' ' 75' ' ' GLU . . . -70.43 -11.54 60.99 Favored 'General case' 0 N--CA 1.493 1.695 0 N-CA-C 109.135 -0.691 . . . . 0.0 109.135 -179.88 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 74' ' ' THR . . . . . . . . . . . . . 47.5 p 52.4 10.31 0.13 Allowed 'General case' 0 N--CA 1.493 1.697 0 CA-C-O 121.27 0.557 . . . . 0.0 109.513 179.854 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 75' ' ' GLU . . . . . 0.445 ' H ' ' C ' ' A' ' 73' ' ' ALA . 15.3 pt-20 -153.01 179.91 8.26 Favored 'General case' 0 N--CA 1.49 1.571 0 CA-C-O 121.806 0.812 . . . . 0.0 110.095 179.834 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 7.3 tp -146.06 133.48 20.75 Favored 'General case' 0 C--N 1.303 -1.422 0 CA-C-O 121.708 0.766 . . . . 0.0 109.988 179.878 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 77' ' ' HIS . . . . . . . . . . . . . 97.8 m-70 -116.53 118.32 32.32 Favored 'General case' 0 N--CA 1.493 1.717 0 CA-C-O 121.854 0.835 . . . . 0.0 109.438 179.533 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -151.25 161.53 42.54 Favored 'General case' 0 N--CA 1.49 1.547 0 CA-C-O 121.657 0.742 . . . . 0.0 109.871 -179.885 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 81.0 mtp85 -130.31 150.61 51.47 Favored 'General case' 0 N--CA 1.495 1.789 0 CA-C-O 121.695 0.759 . . . . 0.0 109.803 -179.631 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 80' ' ' PHE . . . . . . . . . . . . . 28.9 m-85 -126.17 150.77 48.07 Favored 'General case' 0 N--CA 1.496 1.847 0 CA-C-O 121.574 0.702 . . . . 0.0 109.852 -179.711 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 88.4 tttt -113.66 126.8 55.66 Favored 'General case' 0 N--CA 1.494 1.755 0 CA-C-O 121.738 0.78 . . . . 0.0 109.593 -179.835 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 82' ' ' PHE . . . . . 0.524 ' CG ' ' OE2' ' A' ' 87' ' ' GLU . 73.0 m-85 -125.41 148.77 48.67 Favored 'General case' 0 N--CA 1.495 1.813 0 CA-C-O 121.796 0.808 . . . . 0.0 109.996 179.907 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 45.6 tp10 -70.51 -33.75 71.54 Favored 'General case' 0 N--CA 1.488 1.462 0 N-CA-C 109.346 -0.613 . . . . 0.0 109.346 -179.586 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 84' ' ' VAL . . . . . . . . . . . . . 33.1 m -131.68 162.52 39.33 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.936 0 CA-C-O 121.965 0.888 . . . . 0.0 110.411 -179.12 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 69.3 m -88.25 -15.65 35.29 Favored 'General case' 0 N--CA 1.492 1.672 0 N-CA-C 109.578 -0.527 . . . . 0.0 109.578 -179.643 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 86' ' ' ALA . . . . . . . . . . . . . . . -60.11 -46.23 90.3 Favored 'General case' 0 N--CA 1.492 1.642 0 O-C-N 121.444 -0.785 . . . . 0.0 109.475 -179.234 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 87' ' ' GLU . . . . . 0.524 ' OE2' ' CG ' ' A' ' 82' ' ' PHE . 2.9 pp20? -67.33 -30.68 70.58 Favored 'General case' 0 N--CA 1.488 1.45 0 O-C-N 121.738 -0.601 . . . . 0.0 109.411 -179.715 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 88' ' ' LYS . . . . . 0.703 ' HZ2' ' HB1' ' A' ' 32' ' ' ALA . 56.8 tttp -62.79 -45.54 92.17 Favored 'General case' 0 N--CA 1.491 1.582 0 O-C-N 121.73 -0.606 . . . . 0.0 109.379 -179.58 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 96.0 mt -62.89 -50.46 70.79 Favored 'General case' 0 N--CA 1.492 1.641 0 O-C-N 121.852 -0.53 . . . . 0.0 110.025 -179.036 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 90' ' ' ILE . . . . . . . . . . . . . 93.5 mt -69.77 -43.79 79.63 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.591 0 O-C-N 121.731 -0.605 . . . . 0.0 110.013 -179.971 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 91' ' ' PHE . . . . . 0.462 ' O ' HG23 ' A' ' 95' ' ' THR . 74.6 t80 -62.6 -45.81 91.15 Favored 'General case' 0 N--CA 1.491 1.614 0 O-C-N 121.57 -0.707 . . . . 0.0 109.799 -179.052 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 92' ' ' GLU . . . . . 0.54 ' CG ' ' NH1' ' A' ' 96' ' ' ARG . 82.1 tt0 -66.12 -40.65 90.83 Favored 'General case' 0 N--CA 1.491 1.599 0 O-C-N 121.662 -0.649 . . . . 0.0 109.332 -179.64 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 93' ' ' LEU . . . . . . . . . . . . . 4.7 tp -65.45 -43.35 90.63 Favored 'General case' 0 N--CA 1.489 1.495 0 O-C-N 121.584 -0.697 . . . . 0.0 109.749 -179.868 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 94' ' ' LYS . . . . . . . . . . . . . 6.9 ttpm? -68.58 -36.61 78.98 Favored 'General case' 0 N--CA 1.491 1.62 0 CA-C-O 121.24 0.543 . . . . 0.0 110.099 -179.073 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 95' ' ' THR . . . . . 0.462 HG23 ' O ' ' A' ' 91' ' ' PHE . 7.0 p -62.02 -50.5 71.8 Favored 'General case' 0 N--CA 1.491 1.606 0 O-C-N 121.64 -0.663 . . . . 0.0 109.824 -178.802 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 96' ' ' ARG . . . . . 0.54 ' NH1' ' CG ' ' A' ' 92' ' ' GLU . 72.5 mtt85 -64.62 -39.61 94.02 Favored 'General case' 0 N--CA 1.488 1.449 0 N-CA-C 108.864 -0.791 . . . . 0.0 108.864 179.39 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 97' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.488 1.444 0 N-CA-C 108.995 -0.743 . . . . 0.0 108.995 179.995 . . . . . . . . 0 0 . 1 . 009 nuclear nobuild core ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 90.1 m-20 . . . . . 0 N--CA 1.489 1.481 0 N-CA-C 108.414 -0.958 . . . . 0.0 108.414 . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild core ' A' A ' 31' ' ' VAL . . . . . 0.611 HG11 HH21 ' A' ' 79' ' ' ARG . 52.2 t -126.64 135.38 63.9 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.9 0 N-CA-C 109.109 -0.7 . . . . 0.0 109.109 179.827 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -112.25 155.83 23.39 Favored 'General case' 0 N--CA 1.495 1.777 0 CA-C-O 121.629 0.728 . . . . 0.0 109.906 -179.378 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 83.6 tt0 -107.07 123.05 47.66 Favored 'General case' 0 N--CA 1.494 1.757 0 O-C-N 121.647 -0.658 . . . . 0.0 109.614 -179.578 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 34' ' ' VAL . . . . . . . . . . . . . 55.0 t -127.51 132.92 68.81 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.727 0 CA-C-O 121.681 0.753 . . . . 0.0 109.436 179.757 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 37.3 t -148.71 141.0 24.11 Favored 'General case' 0 N--CA 1.49 1.529 0 N-CA-C 109.143 -0.688 . . . . 0.0 109.143 179.61 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 4.9 mp -130.74 151.12 51.52 Favored 'General case' 0 N--CA 1.494 1.766 0 CA-C-O 121.76 0.79 . . . . 0.0 109.928 -179.683 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 37' ' ' PHE . . . . . . . . . . . . . 32.4 p90 -143.69 159.73 41.95 Favored 'General case' 0 C--N 1.301 -1.501 0 CA-C-O 121.551 0.691 . . . . 0.0 109.656 -179.733 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . 114.33 152.96 10.66 Favored Glycine 0 N--CA 1.493 2.475 0 N-CA-C 110.263 -1.135 . . . . 0.0 110.263 179.6 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 39' ' ' SER . . . . . 0.561 ' OG ' ' N ' ' A' ' 40' ' ' ASP . 16.8 t 52.59 -169.24 0.04 OUTLIER 'General case' 0 N--CA 1.491 1.598 0 CA-C-O 122.019 0.914 . . . . 0.0 110.883 179.622 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 40' ' ' ASP . . . . . 0.561 ' N ' ' OG ' ' A' ' 39' ' ' SER . 54.5 p-10 -85.42 178.48 7.43 Favored 'General case' 0 C--N 1.306 -1.318 0 CA-C-O 121.654 0.74 . . . . 0.0 110.178 -179.606 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 88.5 tttt -62.35 -39.0 91.69 Favored 'General case' 0 N--CA 1.49 1.559 0 CA-C-O 121.393 0.616 . . . . 0.0 110.32 -179.577 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -53.31 -41.91 66.13 Favored 'General case' 0 N--CA 1.493 1.714 0 O-C-N 121.286 -0.884 . . . . 0.0 109.825 -179.437 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 43' ' ' HIS . . . . . . . . . . . . . 86.5 t60 -66.76 -41.25 88.05 Favored 'General case' 0 N--CA 1.493 1.712 0 O-C-N 121.242 -0.911 . . . . 0.0 109.488 179.513 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 96.7 mt -63.18 -40.07 96.47 Favored 'General case' 0 N--CA 1.495 1.78 0 O-C-N 121.327 -0.858 . . . . 0.0 109.216 -180.0 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 97.1 mt-10 -61.23 -39.41 90.2 Favored 'General case' 0 N--CA 1.493 1.714 0 O-C-N 121.439 -0.788 . . . . 0.0 109.724 -179.921 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . -60.43 -49.12 82.06 Favored Glycine 0 N--CA 1.492 2.394 0 N-CA-C 109.814 -1.314 . . . . 0.0 109.814 179.96 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 52.1 mtpt -65.9 -37.91 87.35 Favored 'General case' 0 C--N 1.301 -1.526 0 O-C-N 121.429 -1.042 . . . . 0.0 109.565 179.62 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 48' ' ' LEU . . . . . 0.558 HD13 ' O ' ' A' ' 48' ' ' LEU . 0.2 OUTLIER -62.58 -44.39 96.44 Favored 'General case' 0 C--N 1.302 -1.486 0 O-C-N 121.324 -0.86 . . . . 0.0 109.596 -178.805 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 49' ' ' ALA . . . . . . . . . . . . . . . -62.23 -41.76 98.69 Favored 'General case' 0 C--N 1.299 -1.601 0 O-C-N 121.069 -1.019 . . . . 0.0 109.471 -179.617 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 77.1 tt0 -69.47 -36.83 76.93 Favored 'General case' 0 C--N 1.306 -1.316 0 O-C-N 121.419 -0.8 . . . . 0.0 109.199 179.718 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 3.1 m-85 -61.98 -43.49 98.73 Favored 'General case' 0 N--CA 1.496 1.828 0 O-C-N 121.579 -0.701 . . . . 0.0 109.361 -179.996 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 52' ' ' ILE . . . . . 0.407 HD13 ' CZ ' ' A' ' 64' ' ' TYR . 76.7 mt -63.66 -43.19 98.02 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.606 0 O-C-N 121.539 -0.726 . . . . 0.0 109.726 -179.883 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 78.1 p -61.13 -41.71 97.21 Favored 'General case' 0 N--CA 1.493 1.687 0 O-C-N 121.423 -0.798 . . . . 0.0 110.19 -179.253 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 54' ' ' LEU . . . . . . . . . . . . . 93.6 mt -64.98 -42.48 94.51 Favored 'General case' 0 N--CA 1.494 1.737 0 O-C-N 121.264 -0.897 . . . . 0.0 109.4 179.822 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 55' ' ' ALA . . . . . 0.408 ' HB2' ' CE1' ' A' ' 91' ' ' PHE . . . -67.07 -37.06 83.34 Favored 'General case' 0 N--CA 1.491 1.596 0 O-C-N 121.504 -0.748 . . . . 0.0 109.568 179.799 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 56' ' ' LYS . . . . . . . . . . . . . 56.4 tttp -63.27 -43.97 96.43 Favored 'General case' 0 N--CA 1.487 1.377 0 O-C-N 121.491 -0.756 . . . . 0.0 109.568 -179.718 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 77.5 mt-30 -66.13 -44.4 84.35 Favored 'General case' 0 N--CA 1.493 1.687 0 O-C-N 121.324 -0.86 . . . . 0.0 109.433 179.898 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 58' ' ' VAL . . . . . . . . . . . . . 72.3 t -65.18 -45.09 94.98 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.554 0 O-C-N 121.498 -0.751 . . . . 0.0 109.47 179.627 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 59' ' ' TYR . . . . . . . . . . . . . 87.1 t80 -125.05 127.45 46.96 Favored 'General case' 0 N--CA 1.497 1.901 0 CA-C-O 121.748 0.785 . . . . 0.0 109.666 -179.653 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -66.17 148.74 51.38 Favored 'General case' 0 N--CA 1.49 1.554 0 CA-C-O 121.829 0.824 . . . . 0.0 110.848 -179.182 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 61' ' ' ASN . . . . . . . . . . . . . 6.3 p-10 42.93 66.72 0.73 Allowed 'General case' 0 N--CA 1.493 1.71 0 CA-C-O 121.844 0.83 . . . . 0.0 109.966 179.904 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 62' ' ' VAL . . . . . . . . . . . . . 11.7 p -85.55 136.29 23.14 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.616 0 O-C-N 121.549 -0.719 . . . . 0.0 109.794 179.824 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 96.1 mt-10 -111.97 145.24 39.95 Favored 'General case' 0 N--CA 1.496 1.872 0 CA-C-O 121.734 0.778 . . . . 0.0 109.971 -179.517 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 64' ' ' TYR . . . . . 0.407 ' CZ ' HD13 ' A' ' 52' ' ' ILE . 46.9 p90 -149.52 161.54 41.93 Favored 'General case' 0 N--CA 1.49 1.552 0 CA-C-O 121.798 0.809 . . . . 0.0 110.212 -179.424 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 78.4 mm-40 -141.19 146.18 36.6 Favored 'General case' 0 N--CA 1.494 1.734 0 N-CA-C 109.034 -0.728 . . . . 0.0 109.034 179.851 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 66' ' ' VAL . . . . . . . . . . . . . 8.8 p -127.2 131.45 70.64 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.967 0 CA-C-O 121.608 0.718 . . . . 0.0 110.184 -179.744 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 67' ' ' ALA . . . . . 0.462 ' HB1' ' HD2' ' A' ' 68' ' ' PRO . . . -78.95 167.18 36.95 Favored Pre-proline 0 C--N 1.305 -1.356 0 N-CA-C 109.155 -0.683 . . . . 0.0 109.155 -179.95 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 68' ' ' PRO . . . . . 0.462 ' HD2' ' HB1' ' A' ' 67' ' ' ALA . 53.0 Cg_exo -52.27 127.49 23.96 Favored 'Trans proline' 0 N--CA 1.495 1.57 0 C-N-CA 122.383 2.055 . . . . 0.0 112.905 179.573 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 69' ' ' VAL . . . . . . . . . . . . . 70.9 t -132.5 133.27 59.9 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.845 0 O-C-N 121.541 -0.724 . . . . 0.0 109.621 179.482 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -82.04 157.86 24.0 Favored 'General case' 0 C--N 1.302 -1.495 0 O-C-N 121.607 -0.683 . . . . 0.0 109.951 179.637 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 43.4 t0 -64.01 -37.98 89.42 Favored 'General case' 0 N--CA 1.493 1.696 0 CA-C-O 121.606 0.717 . . . . 0.0 109.697 179.552 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 72' ' ' ASN . . . . . . . . . . . . . 11.4 m120 -92.45 12.9 21.24 Favored 'General case' 0 N--CA 1.494 1.743 0 O-C-N 121.422 -0.799 . . . . 0.0 109.467 -179.567 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -64.25 146.51 54.22 Favored 'General case' 0 N--CA 1.496 1.83 0 O-C-N 121.19 -0.944 . . . . 0.0 110.406 -179.551 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 74' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -101.08 -4.35 27.53 Favored 'General case' 0 N--CA 1.494 1.748 0 O-C-N 121.515 -0.741 . . . . 0.0 109.69 179.819 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 82.9 tt0 -144.13 148.02 34.5 Favored 'General case' 0 N--CA 1.497 1.91 0 O-C-N 120.901 -1.125 . . . . 0.0 109.748 179.898 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 3.5 tt -126.17 135.31 51.49 Favored 'General case' 0 N--CA 1.49 1.573 0 CA-C-O 121.502 0.668 . . . . 0.0 109.549 -179.925 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 77' ' ' HIS . . . . . . . . . . . . . 99.1 m-70 -107.78 129.63 55.04 Favored 'General case' 0 N--CA 1.494 1.727 0 CA-C-O 121.578 0.704 . . . . 0.0 109.705 -179.519 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -148.03 153.99 39.67 Favored 'General case' 0 N--CA 1.49 1.529 0 O-C-N 121.587 -0.696 . . . . 0.0 109.438 -179.866 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 79' ' ' ARG . . . . . 0.611 HH21 HG11 ' A' ' 31' ' ' VAL . 79.7 mtp85 -132.74 149.36 52.29 Favored 'General case' 0 N--CA 1.494 1.726 0 CA-C-O 121.393 0.616 . . . . 0.0 109.387 -179.817 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 80' ' ' PHE . . . . . . . . . . . . . 61.8 m-85 -127.53 150.63 49.6 Favored 'General case' 0 N--CA 1.495 1.802 0 CA-C-O 121.536 0.684 . . . . 0.0 109.455 -179.872 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 53.7 tttp -110.5 112.85 25.05 Favored 'General case' 0 N--CA 1.493 1.678 0 CA-C-O 121.569 0.7 . . . . 0.0 109.35 179.874 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 82' ' ' PHE . . . . . . . . . . . . . 59.1 m-85 -111.24 145.22 39.12 Favored 'General case' 0 N--CA 1.495 1.788 0 CA-C-O 121.598 0.713 . . . . 0.0 109.71 179.915 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 46.2 tp10 -66.46 -38.65 87.81 Favored 'General case' 0 C--N 1.301 -1.505 0 O-C-N 121.692 -0.63 . . . . 0.0 109.904 -179.818 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 84' ' ' VAL . . . . . 0.431 ' CG2' ' OE2' ' A' ' 87' ' ' GLU . 16.6 m -136.17 161.24 37.88 Favored 'Isoleucine or valine' 0 N--CA 1.499 1.994 0 O-C-N 121.322 -0.861 . . . . 0.0 110.52 -179.421 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 33.9 m -70.57 -16.54 62.87 Favored 'General case' 0 N--CA 1.49 1.556 0 CA-C-O 121.367 0.604 . . . . 0.0 109.883 -179.902 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 86' ' ' ALA . . . . . . . . . . . . . . . -60.78 -42.37 97.38 Favored 'General case' 0 N--CA 1.493 1.724 0 O-C-N 121.188 -0.945 . . . . 0.0 109.567 -179.876 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 87' ' ' GLU . . . . . 0.551 ' N ' ' OE1' ' A' ' 87' ' ' GLU . 0.4 OUTLIER -70.36 -34.06 72.16 Favored 'General case' 0 N--CA 1.491 1.605 0 O-C-N 121.33 -0.856 . . . . 0.0 109.224 179.858 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 88' ' ' LYS . . . . . . . . . . . . . 88.5 tttt -61.79 -47.07 86.79 Favored 'General case' 0 N--CA 1.49 1.53 0 O-C-N 121.293 -0.88 . . . . 0.0 109.77 -179.921 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 56.6 tp -63.38 -45.77 89.57 Favored 'General case' 0 N--CA 1.489 1.515 0 O-C-N 121.288 -0.883 . . . . 0.0 109.715 -179.489 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 90' ' ' ILE . . . . . . . . . . . . . 96.5 mt -66.04 -44.54 92.03 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.611 0 O-C-N 121.508 -0.745 . . . . 0.0 109.839 -179.832 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 91' ' ' PHE . . . . . 0.408 ' CE1' ' HB2' ' A' ' 55' ' ' ALA . 54.1 t80 -62.98 -43.95 97.38 Favored 'General case' 0 N--CA 1.492 1.629 0 CA-C-O 121.64 0.733 . . . . 0.0 109.799 -179.636 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 92' ' ' GLU . . . . . . . . . . . . . 40.6 tp10 -56.28 -58.98 5.66 Favored 'General case' 0 N--CA 1.493 1.682 0 O-C-N 121.461 -0.775 . . . . 0.0 110.444 -178.897 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 93' ' ' LEU . . . . . 0.476 ' N ' HD12 ' A' ' 93' ' ' LEU . 10.8 mp -64.53 -39.27 93.46 Favored 'General case' 0 N--CA 1.495 1.778 0 O-C-N 121.266 -0.896 . . . . 0.0 110.553 -179.444 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 94' ' ' LYS . . . . . . . . . . . . . 38.6 ttmt -61.73 -46.96 87.41 Favored 'General case' 0 N--CA 1.493 1.719 0 O-C-N 120.997 -1.064 . . . . 0.0 110.639 -178.764 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 21.0 p -69.0 -40.6 78.61 Favored 'General case' 0 N--CA 1.493 1.719 0 O-C-N 120.887 -1.133 . . . . 0.0 109.686 -179.667 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 96' ' ' ARG . . . . . . . . . . . . . 82.6 mtp180 -64.89 -40.61 95.37 Favored 'General case' 0 N--CA 1.491 1.603 0 O-C-N 121.395 -0.816 . . . . 0.0 109.337 179.52 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 97' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 1.559 0 O-C-N 121.448 -0.783 . . . . 0.0 109.518 179.907 . . . . . . . . 0 0 . 1 . 010 nuclear nobuild core ' A' A ' 30' ' ' ASP . . . . . 0.459 ' N ' ' OD1' ' A' ' 30' ' ' ASP . 9.0 p-10 . . . . . 0 N--CA 1.487 1.384 0 CA-C-O 121.485 0.659 . . . . 0.0 109.777 . . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 31' ' ' VAL . . . . . 0.596 ' CG1' HH11 ' A' ' 79' ' ' ARG . 53.5 t -124.96 135.33 64.42 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.881 0 CA-C-O 121.426 0.632 . . . . 0.0 109.433 179.858 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -130.56 140.98 50.46 Favored 'General case' 0 N--CA 1.494 1.759 0 CA-C-O 121.585 0.707 . . . . 0.0 109.471 -179.915 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 22.2 pt-20 -96.01 140.36 30.86 Favored 'General case' 0 N--CA 1.493 1.686 0 CA-C-O 121.501 0.667 . . . . 0.0 110.055 -179.495 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 34' ' ' VAL . . . . . 0.4 HG21 ' CD1' ' A' ' 80' ' ' PHE . 55.4 t -127.0 132.8 69.58 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.763 0 CA-C-O 121.513 0.673 . . . . 0.0 109.304 179.885 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 35' ' ' SER . . . . . 0.506 ' C ' HD12 ' A' ' 36' ' ' LEU . 39.4 t -140.35 128.27 21.99 Favored 'General case' 0 N--CA 1.493 1.701 0 CA-C-O 121.506 0.669 . . . . 0.0 109.724 -179.968 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 36' ' ' LEU . . . . . 0.506 HD12 ' C ' ' A' ' 35' ' ' SER . 11.0 mp -111.25 154.06 24.99 Favored 'General case' 0 N--CA 1.499 2.0 0 CA-C-O 121.509 0.671 . . . . 0.0 109.434 179.977 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 37' ' ' PHE . . . . . . . . . . . . . 92.3 t80 -124.58 130.24 52.07 Favored 'General case' 0 N--CA 1.493 1.679 0 CA-C-O 121.644 0.735 . . . . 0.0 109.508 -179.794 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . -164.95 -171.34 31.07 Favored Glycine 0 N--CA 1.491 2.314 0 N-CA-C 110.182 -1.167 . . . . 0.0 110.182 -179.697 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 14.0 p -85.99 -90.06 0.11 Allowed 'General case' 0 N--CA 1.497 1.903 0 O-C-N 121.909 -0.759 . . . . 0.0 110.738 -179.312 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 40' ' ' ASP . . . . . . . . . . . . . 52.6 p-10 -84.67 168.65 15.08 Favored 'General case' 0 N--CA 1.494 1.742 0 CA-C-O 121.777 0.799 . . . . 0.0 110.525 -178.944 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 88.9 tttt -65.2 -38.08 89.33 Favored 'General case' 0 N--CA 1.496 1.874 0 CA-C-O 121.311 0.577 . . . . 0.0 110.584 -179.506 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -55.1 -41.7 71.97 Favored 'General case' 0 N--CA 1.498 1.933 0 O-C-N 121.358 -0.839 . . . . 0.0 110.413 -178.974 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 43' ' ' HIS . . . . . . . . . . . . . 54.8 t-80 -66.63 -42.09 87.31 Favored 'General case' 0 N--CA 1.496 1.854 0 O-C-N 121.473 -0.767 . . . . 0.0 110.258 -179.555 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 74.1 mt -63.94 -40.34 96.24 Favored 'General case' 0 N--CA 1.497 1.897 0 O-C-N 121.469 -0.769 . . . . 0.0 109.767 -179.412 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 71.7 mm-40 -61.44 -43.46 98.83 Favored 'General case' 0 N--CA 1.492 1.655 0 CA-C-O 121.54 0.686 . . . . 0.0 109.794 -179.451 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . -62.2 -48.33 83.59 Favored Glycine 0 N--CA 1.494 2.534 0 N-CA-C 110.226 -1.15 . . . . 0.0 110.226 -179.648 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 61.5 tttp -66.82 -30.2 70.33 Favored 'General case' 0 N--CA 1.495 1.786 0 O-C-N 121.527 -0.984 . . . . 0.0 109.536 179.936 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 45.3 tp -62.23 -38.24 88.45 Favored 'General case' 0 N--CA 1.491 1.624 0 CA-C-O 121.492 0.663 . . . . 0.0 109.574 -179.509 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 49' ' ' ALA . . . . . . . . . . . . . . . -51.53 -33.47 32.16 Favored 'General case' 0 N--CA 1.493 1.687 0 O-C-N 121.565 -0.71 . . . . 0.0 109.559 -179.588 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 97.8 mt-10 -63.65 -43.2 97.44 Favored 'General case' 0 N--CA 1.493 1.695 0 O-C-N 121.585 -0.697 . . . . 0.0 109.622 -179.906 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 51' ' ' TYR . . . . . 0.468 ' CE1' HD21 ' A' ' 36' ' ' LEU . 32.8 m-85 -62.13 -46.39 89.23 Favored 'General case' 0 N--CA 1.494 1.764 0 O-C-N 121.466 -0.771 . . . . 0.0 109.706 -179.975 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 52' ' ' ILE . . . . . . . . . . . . . 96.5 mt -65.08 -43.99 95.79 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.652 0 O-C-N 121.649 -0.657 . . . . 0.0 109.871 -179.444 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 9.7 t -63.01 -46.63 86.72 Favored 'General case' 0 N--CA 1.495 1.807 0 O-C-N 121.48 -0.762 . . . . 0.0 109.656 -179.701 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 54' ' ' LEU . . . . . . . . . . . . . 91.0 mt -67.32 -40.0 85.92 Favored 'General case' 0 N--CA 1.494 1.732 0 CA-C-O 121.743 0.782 . . . . 0.0 109.181 179.54 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -58.83 -46.33 87.91 Favored 'General case' 0 N--CA 1.494 1.735 0 CA-C-O 121.46 0.648 . . . . 0.0 109.858 -179.447 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 56' ' ' LYS . . . . . . . . . . . . . 68.0 mttm -64.2 -41.21 97.16 Favored 'General case' 0 N--CA 1.492 1.668 0 O-C-N 121.537 -0.727 . . . . 0.0 109.647 179.834 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 67.2 tp60 -65.41 -46.1 81.32 Favored 'General case' 0 N--CA 1.491 1.608 0 O-C-N 121.591 -0.693 . . . . 0.0 109.506 -179.739 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 58' ' ' VAL . . . . . . . . . . . . . 71.5 t -65.89 -44.08 92.78 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.568 0 O-C-N 121.622 -0.673 . . . . 0.0 109.441 -179.98 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 59' ' ' TYR . . . . . 0.412 ' O ' ' O ' ' A' ' 60' ' ' ALA . 52.8 t80 -125.37 133.1 52.66 Favored 'General case' 0 N--CA 1.498 1.964 0 CA-C-O 121.799 0.809 . . . . 0.0 109.758 -179.874 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 60' ' ' ALA . . . . . 0.412 ' O ' ' O ' ' A' ' 59' ' ' TYR . . . -46.45 -100.04 0.0 OUTLIER 'General case' 0 N--CA 1.494 1.733 0 CA-C-O 121.562 0.696 . . . . 0.0 111.042 -179.471 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 61' ' ' ASN . . . . . . . . . . . . . 10.7 m120 -86.01 90.09 8.0 Favored 'General case' 0 N--CA 1.491 1.612 0 CA-C-O 121.805 0.812 . . . . 0.0 109.79 -178.676 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 62' ' ' VAL . . . . . . . . . . . . . 9.6 p -90.89 140.45 15.96 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.587 0 CA-C-O 121.488 0.661 . . . . 0.0 109.952 179.947 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 76.1 mm-40 -112.67 134.44 54.19 Favored 'General case' 0 N--CA 1.494 1.741 0 CA-C-O 121.589 0.709 . . . . 0.0 109.445 -179.809 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 64' ' ' TYR . . . . . . . . . . . . . 47.0 p90 -148.9 162.5 39.73 Favored 'General case' 0 N--CA 1.492 1.661 0 CA-C-O 121.718 0.771 . . . . 0.0 110.078 -179.333 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 15.7 pt-20 -143.18 154.37 43.8 Favored 'General case' 0 N--CA 1.494 1.732 0 N-CA-C 109.2 -0.667 . . . . 0.0 109.2 179.905 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 66' ' ' VAL . . . . . . . . . . . . . 77.3 t -119.83 130.42 74.2 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.878 0 CA-C-O 121.686 0.755 . . . . 0.0 109.856 -179.569 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 67' ' ' ALA . . . . . 0.601 ' HB1' ' HD2' ' A' ' 68' ' ' PRO . . . -84.36 170.99 12.12 Favored Pre-proline 0 N--CA 1.49 1.559 0 N-CA-C 109.423 -0.584 . . . . 0.0 109.423 -179.932 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 68' ' ' PRO . . . . . 0.601 ' HD2' ' HB1' ' A' ' 67' ' ' ALA . 62.9 Cg_exo -52.01 131.47 38.97 Favored 'Trans proline' 0 N--CA 1.496 1.659 0 C-N-CA 122.699 2.266 . . . . 0.0 112.971 -179.806 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 69' ' ' VAL . . . . . . . . . . . . . 53.3 t -132.33 131.99 60.6 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.897 0 CA-C-O 121.651 0.738 . . . . 0.0 109.896 179.838 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -74.9 152.72 38.84 Favored 'General case' 0 N--CA 1.491 1.59 0 CA-C-O 121.731 0.776 . . . . 0.0 110.021 179.625 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 53.3 m-20 -64.11 -36.0 82.6 Favored 'General case' 0 N--CA 1.493 1.677 0 CA-C-O 121.541 0.686 . . . . 0.0 109.267 179.969 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 72' ' ' ASN . . . . . . . . . . . . . 63.2 t30 -94.58 13.37 24.35 Favored 'General case' 0 N--CA 1.494 1.745 0 O-C-N 121.279 -0.888 . . . . 0.0 109.279 179.977 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -58.05 145.38 36.58 Favored 'General case' 0 N--CA 1.497 1.889 0 CA-C-O 121.74 0.781 . . . . 0.0 110.806 -179.273 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 74' ' ' THR . . . . . . . . . . . . . 41.0 p -98.45 -1.03 42.34 Favored 'General case' 0 N--CA 1.493 1.717 0 N-CA-C 109.309 -0.626 . . . . 0.0 109.309 179.6 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 18.9 pt-20 -154.3 163.04 40.76 Favored 'General case' 0 N--CA 1.494 1.747 0 O-C-N 121.259 -0.9 . . . . 0.0 109.912 179.887 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 5.3 tt -126.41 127.81 46.02 Favored 'General case' 0 N--CA 1.494 1.738 0 CA-C-O 121.574 0.702 . . . . 0.0 109.728 -179.855 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 77' ' ' HIS . . . . . . . . . . . . . 60.6 t-80 -97.83 124.01 42.04 Favored 'General case' 0 N--CA 1.491 1.606 0 CA-C-O 121.775 0.798 . . . . 0.0 109.88 -179.765 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -142.75 158.03 44.05 Favored 'General case' 0 N--CA 1.491 1.618 0 N-CA-C 108.881 -0.785 . . . . 0.0 108.881 179.693 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 79' ' ' ARG . . . . . 0.596 HH11 ' CG1' ' A' ' 31' ' ' VAL . 63.2 ttm-85 -128.83 137.67 51.62 Favored 'General case' 0 N--CA 1.493 1.693 0 CA-C-O 121.536 0.684 . . . . 0.0 109.551 -179.685 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 80' ' ' PHE . . . . . 0.4 ' CD1' HG21 ' A' ' 34' ' ' VAL . 59.3 m-85 -123.78 146.67 48.16 Favored 'General case' 0 N--CA 1.496 1.844 0 CA-C-O 121.521 0.677 . . . . 0.0 109.524 -179.803 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 63.6 tttp -115.76 128.91 56.21 Favored 'General case' 0 N--CA 1.496 1.845 0 N-CA-C 109.115 -0.698 . . . . 0.0 109.115 -179.859 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 82' ' ' PHE . . . . . 0.402 ' O ' ' OD2' ' A' ' 30' ' ' ASP . 94.4 m-85 -122.55 -122.01 0.28 Allowed 'General case' 0 N--CA 1.499 1.979 0 CA-C-O 121.346 0.593 . . . . 0.0 109.902 -179.413 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 52.8 tp10 -150.71 -39.84 0.13 Allowed 'General case' 0 N--CA 1.489 1.521 0 N-CA-C 108.747 -0.834 . . . . 0.0 108.747 -179.544 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 84' ' ' VAL . . . . . . . . . . . . . 25.6 m -137.12 157.7 35.48 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.888 0 O-C-N 121.469 -0.77 . . . . 0.0 109.686 179.928 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 85' ' ' SER . . . . . 0.482 ' O ' ' N ' ' A' ' 88' ' ' LYS . 11.3 t -64.08 -42.03 97.11 Favored 'General case' 0 N--CA 1.494 1.726 0 CA-C-O 121.33 0.586 . . . . 0.0 110.329 -179.979 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 86' ' ' ALA . . . . . 0.42 ' C ' ' O ' ' A' ' 85' ' ' SER . . . -39.22 -46.06 1.45 Allowed 'General case' 0 N--CA 1.5 2.026 0 CA-C-O 121.45 0.643 . . . . 0.0 110.587 -179.01 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 96.1 mt-10 -62.73 -33.94 76.16 Favored 'General case' 0 N--CA 1.494 1.73 0 O-C-N 121.469 -0.769 . . . . 0.0 110.008 -179.779 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 88' ' ' LYS . . . . . 0.482 ' N ' ' O ' ' A' ' 85' ' ' SER . 88.2 tttt -63.02 -43.11 99.62 Favored 'General case' 0 N--CA 1.492 1.664 0 O-C-N 121.414 -0.804 . . . . 0.0 109.648 -179.802 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 89' ' ' LEU . . . . . 0.55 ' N ' HD12 ' A' ' 89' ' ' LEU . 10.6 mp -63.47 -48.47 77.53 Favored 'General case' 0 N--CA 1.495 1.788 0 O-C-N 121.604 -0.685 . . . . 0.0 110.371 -179.093 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 90' ' ' ILE . . . . . 0.52 ' N ' HD12 ' A' ' 90' ' ' ILE . 1.4 mp -69.67 -43.65 80.03 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.756 0 O-C-N 121.355 -0.84 . . . . 0.0 108.972 179.962 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 91' ' ' PHE . . . . . . . . . . . . . 88.3 t80 -59.2 -47.6 84.74 Favored 'General case' 0 C--N 1.302 -1.478 0 CA-C-O 121.725 0.774 . . . . 0.0 109.184 -179.585 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 92' ' ' GLU . . . . . . . . . . . . . 84.2 tt0 -69.97 -31.83 69.74 Favored 'General case' 0 N--CA 1.49 1.56 0 CA-C-O 121.533 0.682 . . . . 0.0 109.431 179.681 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 93' ' ' LEU . . . . . . . . . . . . . 61.6 tp -62.99 -45.46 92.3 Favored 'General case' 0 N--CA 1.492 1.651 0 O-C-N 121.328 -0.857 . . . . 0.0 109.754 -179.455 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 94' ' ' LYS . . . . . . . . . . . . . 52.4 mtmt -65.24 -42.38 93.43 Favored 'General case' 0 N--CA 1.491 1.6 0 CA-C-O 121.467 0.651 . . . . 0.0 110.088 -179.386 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 34.2 p -67.02 -38.35 85.79 Favored 'General case' 0 N--CA 1.492 1.669 0 O-C-N 121.514 -0.741 . . . . 0.0 110.193 -179.325 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 96' ' ' ARG . . . . . . . . . . . . . 77.8 mmt-85 -66.19 -39.02 89.38 Favored 'General case' 0 N--CA 1.493 1.686 0 O-C-N 121.302 -0.874 . . . . 0.0 109.563 -179.954 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 97' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.301 -1.535 0 CA-C-O 121.635 0.731 . . . . 0.0 109.187 179.997 . . . . . . . . 0 0 . 1 . 011 nuclear nobuild core ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 39.1 p-10 . . . . . 0 N--CA 1.494 1.743 0 N-CA-C 109.366 -0.605 . . . . 0.0 109.366 . . . . . . . . . 0 0 . 1 . 011 nuclear nobuild core ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 50.3 t -123.64 133.6 68.76 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.955 0 CA-C-O 121.602 0.715 . . . . 0.0 109.985 179.519 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 32' ' ' ALA . . . . . 0.626 ' HB1' ' NZ ' ' A' ' 88' ' ' LYS . . . -116.96 150.6 38.28 Favored 'General case' 0 N--CA 1.497 1.919 0 CA-C-O 121.977 0.894 . . . . 0.0 110.113 179.825 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 16.4 pt-20 -98.34 142.23 30.24 Favored 'General case' 0 N--CA 1.494 1.727 0 CA-C-O 121.615 0.722 . . . . 0.0 110.118 -179.821 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 34' ' ' VAL . . . . . . . . . . . . . 53.0 t -125.96 134.5 66.4 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.833 0 CA-C-O 121.789 0.804 . . . . 0.0 109.459 179.881 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 34.7 p -137.87 129.51 28.22 Favored 'General case' 0 N--CA 1.494 1.742 0 CA-C-O 121.726 0.774 . . . . 0.0 110.15 179.825 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 25.6 tp -127.99 139.83 52.34 Favored 'General case' 0 N--CA 1.492 1.64 0 CA-C-O 121.725 0.774 . . . . 0.0 109.574 179.656 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 37' ' ' PHE . . . . . . . . . . . . . 46.8 p90 -139.7 148.23 42.05 Favored 'General case' 0 N--CA 1.492 1.663 0 CA-C-O 121.902 0.858 . . . . 0.0 110.109 179.934 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . 155.31 128.52 1.15 Allowed Glycine 0 N--CA 1.49 2.234 0 N-CA-C 109.831 -1.308 . . . . 0.0 109.831 179.796 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 14.7 m 47.84 -146.6 0.25 Allowed 'General case' 0 N--CA 1.488 1.45 0 O-C-N 121.75 -0.853 . . . . 0.0 110.205 179.625 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 40' ' ' ASP . . . . . . . . . . . . . 56.1 p30 -86.94 -177.74 6.13 Favored 'General case' 0 N--CA 1.492 1.666 0 CA-C-O 121.606 0.717 . . . . 0.0 110.451 -178.903 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 88.8 tttt -62.66 -42.03 99.39 Favored 'General case' 0 N--CA 1.494 1.733 0 O-C-N 121.93 -0.481 . . . . 0.0 110.085 -179.091 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -49.86 -41.76 46.07 Favored 'General case' 0 N--CA 1.495 1.825 0 O-C-N 121.662 -0.648 . . . . 0.0 109.738 -178.645 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 43' ' ' HIS . . . . . . . . . . . . . 50.4 t-80 -64.01 -41.55 97.42 Favored 'General case' 0 N--CA 1.491 1.614 0 CA-C-O 121.353 0.597 . . . . 0.0 109.619 -179.809 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 49.8 mt -64.11 -40.11 95.5 Favored 'General case' 0 N--CA 1.492 1.64 0 O-C-N 121.628 -0.67 . . . . 0.0 109.627 -179.467 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 79.6 mm-40 -62.93 -39.59 95.05 Favored 'General case' 0 N--CA 1.493 1.68 0 O-C-N 121.769 -0.582 . . . . 0.0 109.474 -179.263 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . -62.34 -42.4 99.71 Favored Glycine 0 N--CA 1.492 2.383 0 N-CA-C 109.604 -1.398 . . . . 0.0 109.604 -179.646 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 55.1 mtpt -83.19 -18.24 39.99 Favored 'General case' 0 N--CA 1.491 1.594 0 O-C-N 121.661 -0.905 . . . . 0.0 109.255 -179.634 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 58.2 tp -64.13 -39.83 94.88 Favored 'General case' 0 N--CA 1.488 1.45 0 N-CA-C 108.901 -0.777 . . . . 0.0 108.901 179.719 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 49' ' ' ALA . . . . . . . . . . . . . . . -58.02 -41.2 82.65 Favored 'General case' 0 N--CA 1.494 1.758 0 N-CA-C 109.588 -0.523 . . . . 0.0 109.588 -179.018 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 79.5 mm-40 -68.92 -37.16 78.76 Favored 'General case' 0 N--CA 1.494 1.753 0 O-C-N 121.648 -0.657 . . . . 0.0 109.244 179.966 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 3.6 m-85 -61.54 -43.88 98.06 Favored 'General case' 0 N--CA 1.496 1.836 0 O-C-N 121.615 -0.678 . . . . 0.0 109.505 -179.326 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 52' ' ' ILE . . . . . . . . . . . . . 90.8 mt -64.22 -42.38 95.3 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.653 0 N-CA-C 109.0 -0.741 . . . . 0.0 109.0 -179.973 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 11.5 t -59.01 -42.69 90.73 Favored 'General case' 0 N--CA 1.489 1.523 0 N-CA-C 109.092 -0.707 . . . . 0.0 109.092 -179.017 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 54' ' ' LEU . . . . . . . . . . . . . 88.8 mt -63.15 -40.95 99.05 Favored 'General case' 0 C--N 1.301 -1.541 0 N-CA-C 109.231 -0.655 . . . . 0.0 109.231 -179.962 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -65.93 -38.86 89.75 Favored 'General case' 0 N--CA 1.494 1.758 0 O-C-N 121.939 -0.476 . . . . 0.0 110.002 -179.253 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 56' ' ' LYS . . . . . . . . . . . . . 64.7 mttm -64.81 -41.46 95.76 Favored 'General case' 0 N--CA 1.493 1.717 0 O-C-N 121.528 -0.732 . . . . 0.0 109.79 -179.821 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 87.8 mt-30 -61.66 -46.23 90.64 Favored 'General case' 0 N--CA 1.488 1.474 0 N-CA-C 109.074 -0.713 . . . . 0.0 109.074 -179.502 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 58' ' ' VAL . . . . . . . . . . . . . 76.0 t -66.41 -44.27 90.75 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.591 0 N-CA-C 109.235 -0.654 . . . . 0.0 109.235 179.794 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 59' ' ' TYR . . . . . . . . . . . . . 87.7 t80 -140.42 118.53 11.95 Favored 'General case' 0 N--CA 1.498 1.929 0 CA-C-O 121.813 0.816 . . . . 0.0 110.046 -179.844 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -70.79 149.15 47.15 Favored 'General case' 0 N--CA 1.495 1.797 0 CA-C-O 121.572 0.701 . . . . 0.0 110.895 -179.854 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 61' ' ' ASN . . . . . . . . . . . . . 50.2 t-20 61.42 42.47 11.54 Favored 'General case' 0 N--CA 1.493 1.687 0 CA-C-O 121.602 0.715 . . . . 0.0 109.089 179.671 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 62' ' ' VAL . . . . . . . . . . . . . 9.4 p -80.37 137.27 21.78 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.531 0 CA-C-O 121.636 0.731 . . . . 0.0 110.383 -179.811 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 96.6 mt-10 -111.39 146.17 37.62 Favored 'General case' 0 N--CA 1.495 1.793 0 CA-C-O 121.967 0.889 . . . . 0.0 109.932 -179.844 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 64' ' ' TYR . . . . . . . . . . . . . 55.1 p90 -151.47 161.03 43.4 Favored 'General case' 0 N--CA 1.489 1.516 0 CA-C-O 121.503 0.668 . . . . 0.0 110.023 -179.667 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 74.6 mm-40 -138.13 151.02 47.37 Favored 'General case' 0 N--CA 1.5 2.049 0 CA-C-O 121.707 0.765 . . . . 0.0 110.406 -179.481 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 66' ' ' VAL . . . . . . . . . . . . . 53.4 t -122.62 130.84 74.21 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.969 0 CA-C-O 121.923 0.868 . . . . 0.0 110.163 -179.549 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 67' ' ' ALA . . . . . 0.591 ' HB1' ' HD2' ' A' ' 68' ' ' PRO . . . -81.41 170.28 15.88 Favored Pre-proline 0 N--CA 1.487 1.38 0 CA-C-O 121.167 0.508 . . . . 0.0 109.739 179.812 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 68' ' ' PRO . . . . . 0.591 ' HD2' ' HB1' ' A' ' 67' ' ' ALA . 31.5 Cg_exo -56.55 122.86 12.54 Favored 'Trans proline' 0 N--CA 1.494 1.557 0 C-N-CA 122.537 2.158 . . . . 0.0 112.601 179.922 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 69' ' ' VAL . . . . . . . . . . . . . 67.8 t -135.45 134.1 52.16 Favored 'Isoleucine or valine' 0 N--CA 1.499 1.975 0 CA-C-O 121.789 0.804 . . . . 0.0 110.379 179.903 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -71.55 151.64 43.67 Favored 'General case' 0 N--CA 1.497 1.877 0 CA-C-O 121.578 0.704 . . . . 0.0 110.583 179.934 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 98.4 m-20 -62.43 -35.93 80.81 Favored 'General case' 0 N--CA 1.493 1.722 0 N-CA-C 109.531 -0.544 . . . . 0.0 109.531 -179.537 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 72' ' ' ASN . . . . . . . . . . . . . 56.6 p30 -92.04 11.54 24.92 Favored 'General case' 0 N--CA 1.495 1.775 0 O-C-N 121.555 -0.716 . . . . 0.0 109.363 -179.288 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -66.14 144.03 56.92 Favored 'General case' 0 N--CA 1.493 1.723 0 O-C-N 121.496 -0.752 . . . . 0.0 109.736 179.833 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 74' ' ' THR . . . . . . . . . . . . . 3.8 m -99.18 -3.54 34.17 Favored 'General case' 0 N--CA 1.493 1.681 0 N-CA-C 108.697 -0.853 . . . . 0.0 108.697 -179.873 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 84.0 tt0 -135.88 150.49 49.38 Favored 'General case' 0 N--CA 1.492 1.656 0 CA-C-O 121.792 0.806 . . . . 0.0 109.522 179.977 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 4.7 tt -131.21 128.29 39.66 Favored 'General case' 0 N--CA 1.489 1.52 0 CA-C-O 121.806 0.812 . . . . 0.0 109.841 -179.725 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 77' ' ' HIS . . . . . . . . . . . . . 80.5 m80 -96.92 131.41 43.72 Favored 'General case' 0 N--CA 1.493 1.686 0 CA-C-O 121.857 0.836 . . . . 0.0 109.435 -179.805 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -147.64 155.78 42.12 Favored 'General case' 0 N--CA 1.49 1.551 0 CA-C-O 121.716 0.77 . . . . 0.0 109.995 -179.85 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 95.2 mtt180 -128.54 137.66 51.86 Favored 'General case' 0 N--CA 1.496 1.849 0 CA-C-O 121.794 0.807 . . . . 0.0 109.728 -179.881 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 80' ' ' PHE . . . . . . . . . . . . . 30.0 m-85 -129.44 147.78 51.29 Favored 'General case' 0 N--CA 1.495 1.809 0 CA-C-O 121.723 0.773 . . . . 0.0 109.629 179.885 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -124.96 146.24 49.48 Favored 'General case' 0 N--CA 1.495 1.813 0 CA-C-O 121.622 0.725 . . . . 0.0 109.774 179.902 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 82' ' ' PHE . . . . . . . . . . . . . 97.7 m-85 -132.67 -97.6 0.3 Allowed 'General case' 0 N--CA 1.496 1.873 0 CA-C-O 121.351 0.596 . . . . 0.0 109.701 -179.869 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 6.1 pt-20 -177.32 -28.87 0.01 OUTLIER 'General case' 0 N--CA 1.494 1.757 0 O-C-N 121.341 -0.85 . . . . 0.0 108.812 -179.82 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 84' ' ' VAL . . . . . . . . . . . . . 33.7 m -134.27 160.11 41.79 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.903 0 CA-C-O 121.814 0.816 . . . . 0.0 110.208 -179.918 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 35.6 m -79.61 -18.06 52.43 Favored 'General case' 0 N--CA 1.493 1.706 0 CA-C-O 121.348 0.595 . . . . 0.0 109.679 -179.711 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 86' ' ' ALA . . . . . . . . . . . . . . . -63.27 -42.93 99.19 Favored 'General case' 0 N--CA 1.493 1.712 0 O-C-N 121.519 -0.738 . . . . 0.0 109.515 -179.337 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 92.5 mt-10 -67.31 -29.64 69.27 Favored 'General case' 0 N--CA 1.493 1.708 0 O-C-N 121.523 -0.736 . . . . 0.0 109.471 -179.701 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 88' ' ' LYS . . . . . 0.626 ' NZ ' ' HB1' ' A' ' 32' ' ' ALA . 64.6 tttp -63.22 -46.06 88.74 Favored 'General case' 0 N--CA 1.489 1.498 0 O-C-N 121.681 -0.637 . . . . 0.0 109.531 -179.413 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 96.6 mt -64.14 -48.87 74.36 Favored 'General case' 0 N--CA 1.491 1.606 0 O-C-N 121.685 -0.634 . . . . 0.0 110.095 -178.965 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 90' ' ' ILE . . . . . 0.521 ' N ' HD12 ' A' ' 90' ' ' ILE . 1.3 mp -68.68 -44.21 82.6 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.612 0 O-C-N 121.766 -0.584 . . . . 0.0 109.735 179.904 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 91' ' ' PHE . . . . . . . . . . . . . 85.7 t80 -61.81 -44.73 96.28 Favored 'General case' 0 C--N 1.301 -1.542 0 N-CA-C 108.723 -0.843 . . . . 0.0 108.723 -178.972 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 92' ' ' GLU . . . . . . . . . . . . . 50.8 tp10 -63.16 -37.52 87.54 Favored 'General case' 0 C--N 1.302 -1.463 0 N-CA-C 109.28 -0.637 . . . . 0.0 109.28 -179.628 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 93' ' ' LEU . . . . . . . . . . . . . 6.3 tt -63.27 -46.6 86.06 Favored 'General case' 0 N--CA 1.489 1.511 0 CA-C-O 121.426 0.631 . . . . 0.0 109.677 -179.43 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 94' ' ' LYS . . . . . . . . . . . . . 67.8 mttm -66.5 -44.84 81.46 Favored 'General case' 0 N--CA 1.491 1.589 0 O-C-N 121.792 -0.568 . . . . 0.0 110.262 -179.408 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 22.3 p -69.13 -41.77 76.91 Favored 'General case' 0 N--CA 1.494 1.765 0 O-C-N 121.518 -0.738 . . . . 0.0 109.847 -179.188 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 96' ' ' ARG . . . . . . . . . . . . . 64.0 ttm-85 -68.23 -42.3 79.97 Favored 'General case' 0 N--CA 1.491 1.623 0 O-C-N 121.536 -0.727 . . . . 0.0 109.042 -179.818 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 97' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 1.526 0 N-CA-C 109.217 -0.661 . . . . 0.0 109.217 -179.499 . . . . . . . . 0 0 . 1 . 012 nuclear nobuild core ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 62.3 t0 . . . . . 0 N--CA 1.492 1.662 0 N-CA-C 108.674 -0.861 . . . . 0.0 108.674 . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild core ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 4.2 p -129.25 153.98 39.45 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.804 0 CA-C-O 121.349 0.595 . . . . 0.0 109.851 -179.58 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -133.18 148.12 52.06 Favored 'General case' 0 N--CA 1.493 1.71 0 CA-C-O 121.661 0.744 . . . . 0.0 109.575 -179.953 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 98.2 mt-10 -92.17 148.06 22.45 Favored 'General case' 0 N--CA 1.49 1.557 0 CA-C-O 121.559 0.695 . . . . 0.0 110.084 -179.877 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 34' ' ' VAL . . . . . . . . . . . . . 51.6 t -127.01 132.64 69.73 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.671 0 CA-C-O 121.556 0.693 . . . . 0.0 109.385 -179.962 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 70.7 m -125.48 122.75 37.53 Favored 'General case' 0 N--CA 1.492 1.65 0 N-CA-C 109.342 -0.614 . . . . 0.0 109.342 179.918 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 39.8 tp -120.85 133.07 55.31 Favored 'General case' 0 N--CA 1.496 1.841 0 CA-C-O 121.602 0.715 . . . . 0.0 109.336 179.741 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 37' ' ' PHE . . . . . . . . . . . . . 83.4 m-85 -93.94 147.79 22.77 Favored 'General case' 0 N--CA 1.49 1.557 0 CA-C-O 121.646 0.736 . . . . 0.0 110.083 -179.526 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . 179.96 -179.29 48.81 Favored Glycine 0 N--CA 1.487 2.045 0 N-CA-C 110.05 -1.22 . . . . 0.0 110.05 179.877 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 39' ' ' SER . . . . . 0.43 ' O ' ' O ' ' A' ' 73' ' ' ALA . 13.3 p -82.7 -102.85 0.04 OUTLIER 'General case' 0 N--CA 1.49 1.54 0 O-C-N 121.692 -0.887 . . . . 0.0 110.325 -179.715 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 40' ' ' ASP . . . . . . . . . . . . . 52.4 p-10 -83.8 174.97 9.98 Favored 'General case' 0 N--CA 1.492 1.629 0 O-C-N 121.371 -0.83 . . . . 0.0 110.777 -179.037 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 37.5 ttmt -62.95 -39.91 96.06 Favored 'General case' 0 N--CA 1.49 1.54 0 O-C-N 121.712 -0.617 . . . . 0.0 110.63 -179.353 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -56.17 -43.32 78.26 Favored 'General case' 0 N--CA 1.495 1.815 0 O-C-N 121.223 -0.923 . . . . 0.0 109.893 -179.166 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 43' ' ' HIS . . . . . . . . . . . . . 83.2 t60 -66.9 -43.11 84.27 Favored 'General case' 0 N--CA 1.494 1.773 0 O-C-N 121.408 -0.808 . . . . 0.0 109.878 -179.853 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 47.5 mt -63.86 -40.58 96.9 Favored 'General case' 0 N--CA 1.494 1.774 0 O-C-N 121.302 -0.874 . . . . 0.0 109.939 -179.642 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 97.1 mt-10 -65.09 -36.12 83.29 Favored 'General case' 0 N--CA 1.494 1.765 0 O-C-N 121.315 -0.865 . . . . 0.0 109.662 -179.708 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . -61.02 -42.47 99.81 Favored Glycine 0 N--CA 1.492 2.395 0 N-CA-C 109.407 -1.477 . . . . 0.0 109.407 179.993 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 97.4 mttt -83.19 -17.11 44.0 Favored 'General case' 0 N--CA 1.492 1.633 0 O-C-N 121.533 -0.98 . . . . 0.0 109.308 179.548 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 48' ' ' LEU . . . . . 0.564 HD13 ' CD2' ' A' ' 76' ' ' LEU . 51.5 tp -65.18 -39.44 92.91 Favored 'General case' 0 N--CA 1.491 1.611 0 O-C-N 121.536 -0.728 . . . . 0.0 109.697 179.954 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 49' ' ' ALA . . . . . . . . . . . . . . . -54.25 -28.59 42.52 Favored 'General case' 0 N--CA 1.491 1.618 0 O-C-N 121.591 -0.693 . . . . 0.0 109.571 -179.131 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 80.5 mm-40 -66.72 -42.75 85.83 Favored 'General case' 0 N--CA 1.492 1.638 0 O-C-N 121.384 -0.822 . . . . 0.0 109.335 179.78 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 32.0 m-85 -61.2 -44.62 96.99 Favored 'General case' 0 N--CA 1.495 1.811 0 O-C-N 121.551 -0.718 . . . . 0.0 109.891 -179.969 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 52' ' ' ILE . . . . . . . . . . . . . 96.6 mt -65.28 -43.75 95.09 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.59 0 O-C-N 121.676 -0.64 . . . . 0.0 110.58 -179.208 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 5.2 t -61.06 -51.62 68.39 Favored 'General case' 0 N--CA 1.494 1.741 0 O-C-N 121.271 -0.893 . . . . 0.0 110.316 -179.037 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 54' ' ' LEU . . . . . . . . . . . . . 4.0 mm? -66.0 -38.07 87.53 Favored 'General case' 0 N--CA 1.492 1.657 0 O-C-N 121.525 -0.734 . . . . 0.0 109.886 179.716 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -55.39 -48.12 74.82 Favored 'General case' 0 N--CA 1.49 1.572 0 O-C-N 121.513 -0.742 . . . . 0.0 110.332 -179.029 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 56' ' ' LYS . . . . . . . . . . . . . 61.4 mttp -65.65 -42.68 91.12 Favored 'General case' 0 N--CA 1.493 1.683 0 O-C-N 121.299 -0.876 . . . . 0.0 110.121 -179.921 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 27.4 mt-30 -65.62 -45.69 82.14 Favored 'General case' 0 N--CA 1.493 1.7 0 O-C-N 121.402 -0.811 . . . . 0.0 109.488 -179.656 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 58' ' ' VAL . . . . . . . . . . . . . 71.7 t -65.15 -45.86 92.76 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.478 0 O-C-N 121.589 -0.695 . . . . 0.0 109.343 179.783 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 59' ' ' TYR . . . . . . . . . . . . . 52.4 t80 -132.33 119.52 20.85 Favored 'General case' 0 N--CA 1.496 1.853 0 CA-C-O 121.616 0.722 . . . . 0.0 109.108 -179.979 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -70.51 144.39 51.36 Favored 'General case' 0 N--CA 1.491 1.592 0 CA-C-O 121.813 0.816 . . . . 0.0 110.913 -179.236 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 61' ' ' ASN . . . . . . . . . . . . . 40.3 t-20 57.79 41.81 24.4 Favored 'General case' 0 N--CA 1.492 1.63 0 CA-C-O 121.851 0.834 . . . . 0.0 109.349 179.926 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 62' ' ' VAL . . . . . . . . . . . . . 8.2 p -74.09 138.84 20.35 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.48 0 CA-C-O 121.631 0.729 . . . . 0.0 110.452 -179.776 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 71.7 mm-40 -112.64 137.59 50.68 Favored 'General case' 0 N--CA 1.494 1.751 0 CA-C-O 121.609 0.719 . . . . 0.0 109.402 179.968 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 64' ' ' TYR . . . . . . . . . . . . . 50.9 p90 -149.64 161.08 42.88 Favored 'General case' 0 N--CA 1.489 1.493 0 CA-C-O 121.721 0.772 . . . . 0.0 110.337 -179.585 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 50.8 tp10 -142.4 148.72 38.29 Favored 'General case' 0 N--CA 1.49 1.573 0 N-CA-C 108.997 -0.742 . . . . 0.0 108.997 179.782 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 66' ' ' VAL . . . . . . . . . . . . . 54.9 t -111.62 130.87 64.41 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.791 0 CA-C-O 121.79 0.805 . . . . 0.0 109.839 -179.59 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -82.18 158.91 66.22 Favored Pre-proline 0 N--CA 1.488 1.425 0 N-CA-C 109.605 -0.517 . . . . 0.0 109.605 -179.759 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 68' ' ' PRO . . . . . . . . . . . . . 48.6 Cg_exo -51.26 128.8 26.58 Favored 'Trans proline' 0 N--CA 1.493 1.45 0 C-N-CA 122.233 1.955 . . . . 0.0 112.178 179.039 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 69' ' ' VAL . . . . . . . . . . . . . 54.0 t -131.27 135.31 59.83 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.754 0 CA-C-O 121.649 0.738 . . . . 0.0 110.02 -179.827 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -69.71 152.47 44.62 Favored 'General case' 0 C--N 1.303 -1.451 0 CA-C-O 121.75 0.786 . . . . 0.0 110.006 179.554 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 12.9 m-20 -64.27 -34.49 78.24 Favored 'General case' 0 N--CA 1.491 1.586 0 O-C-N 121.629 -0.67 . . . . 0.0 109.424 179.886 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 72' ' ' ASN . . . . . . . . . . . . . 57.1 p30 -94.8 16.32 16.18 Favored 'General case' 0 N--CA 1.493 1.704 0 O-C-N 121.348 -0.845 . . . . 0.0 109.435 -179.445 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 73' ' ' ALA . . . . . 0.43 ' O ' ' O ' ' A' ' 39' ' ' SER . . . -66.6 144.95 56.11 Favored 'General case' 0 N--CA 1.491 1.594 0 O-C-N 121.525 -0.734 . . . . 0.0 110.059 179.964 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 74' ' ' THR . . . . . . . . . . . . . 61.4 p -101.13 -0.96 35.2 Favored 'General case' 0 N--CA 1.493 1.688 0 O-C-N 121.551 -0.718 . . . . 0.0 109.299 179.857 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 95.3 mt-10 -139.58 160.05 40.76 Favored 'General case' 0 N--CA 1.496 1.856 0 O-C-N 121.256 -0.903 . . . . 0.0 109.835 -179.856 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 76' ' ' LEU . . . . . 0.564 ' CD2' HD13 ' A' ' 48' ' ' LEU . 6.5 tp -123.8 131.15 53.53 Favored 'General case' 0 N--CA 1.491 1.617 0 CA-C-O 121.524 0.678 . . . . 0.0 109.37 -179.95 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 77' ' ' HIS . . . . . . . . . . . . . 97.2 m-70 -106.35 126.77 52.65 Favored 'General case' 0 N--CA 1.493 1.681 0 CA-C-O 121.541 0.686 . . . . 0.0 109.689 -179.767 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -149.4 159.75 44.03 Favored 'General case' 0 N--CA 1.49 1.529 0 CA-C-O 121.507 0.67 . . . . 0.0 109.848 -179.763 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 86.4 mtm-85 -127.47 142.37 51.42 Favored 'General case' 0 N--CA 1.495 1.8 0 CA-C-O 121.508 0.671 . . . . 0.0 109.433 -179.847 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 80' ' ' PHE . . . . . . . . . . . . . 44.1 m-85 -127.87 149.47 50.28 Favored 'General case' 0 N--CA 1.498 1.931 0 CA-C-O 121.401 0.619 . . . . 0.0 109.741 -179.482 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 82.8 tttt -111.73 133.36 54.01 Favored 'General case' 0 N--CA 1.493 1.698 0 CA-C-O 121.554 0.692 . . . . 0.0 109.685 -179.861 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 82' ' ' PHE . . . . . . . . . . . . . 71.8 m-85 -137.54 -128.53 0.13 Allowed 'General case' 0 N--CA 1.494 1.73 0 CA-C-O 121.442 0.639 . . . . 0.0 109.711 -179.665 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 81.3 tt0 -149.8 -34.14 0.18 Allowed 'General case' 0 N--CA 1.489 1.489 0 O-C-N 121.519 -0.738 . . . . 0.0 109.132 -179.765 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 84' ' ' VAL . . . . . . . . . . . . . 34.8 m -135.08 158.28 41.05 Favored 'Isoleucine or valine' 0 N--CA 1.499 1.98 0 O-C-N 121.31 -0.869 . . . . 0.0 110.348 -179.971 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 82.8 p -74.07 -16.77 61.02 Favored 'General case' 0 N--CA 1.491 1.582 0 CA-C-O 121.327 0.584 . . . . 0.0 109.823 -179.952 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 86' ' ' ALA . . . . . . . . . . . . . . . -63.89 -38.2 90.22 Favored 'General case' 0 N--CA 1.492 1.667 0 O-C-N 121.367 -0.833 . . . . 0.0 109.457 -179.761 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 94.4 mt-10 -68.08 -35.05 77.56 Favored 'General case' 0 N--CA 1.491 1.624 0 O-C-N 121.499 -0.75 . . . . 0.0 109.302 179.683 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 88' ' ' LYS . . . . . . . . . . . . . 49.1 tptt -61.95 -44.48 96.67 Favored 'General case' 0 C--N 1.302 -1.491 0 O-C-N 121.436 -0.79 . . . . 0.0 109.211 179.82 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 42.5 tp -62.07 -50.16 73.08 Favored 'General case' 0 C--N 1.303 -1.431 0 O-C-N 121.651 -0.655 . . . . 0.0 109.817 -179.029 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 90' ' ' ILE . . . . . . . . . . . . . 96.6 mt -66.66 -43.03 90.5 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.773 0 O-C-N 121.529 -0.732 . . . . 0.0 109.878 179.929 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 91' ' ' PHE . . . . . 0.422 ' O ' HG23 ' A' ' 95' ' ' THR . 71.1 t80 -59.35 -46.09 89.59 Favored 'General case' 0 N--CA 1.493 1.679 0 O-C-N 121.468 -0.77 . . . . 0.0 109.649 -179.186 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 92' ' ' GLU . . . . . . . . . . . . . 9.5 tm-20 -66.98 -41.18 87.22 Favored 'General case' 0 N--CA 1.49 1.536 0 CA-C-O 121.691 0.758 . . . . 0.0 109.191 179.881 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 93' ' ' LEU . . . . . 0.544 ' O ' HD13 ' A' ' 93' ' ' LEU . 0.3 OUTLIER -63.87 -47.71 79.61 Favored 'General case' 0 C--N 1.303 -1.437 0 CA-C-O 121.932 0.873 . . . . 0.0 109.651 -179.226 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 94' ' ' LYS . . . . . . . . . . . . . 54.9 mtpt -65.04 -43.52 92.05 Favored 'General case' 0 C--N 1.3 -1.567 0 O-C-N 121.411 -0.806 . . . . 0.0 109.786 -179.252 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 95' ' ' THR . . . . . 0.422 HG23 ' O ' ' A' ' 91' ' ' PHE . 40.9 p -69.06 -35.56 76.69 Favored 'General case' 0 N--CA 1.491 1.6 0 O-C-N 121.608 -0.683 . . . . 0.0 109.847 -179.867 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 96' ' ' ARG . . . . . . . . . . . . . 74.1 ttt180 -64.63 -42.9 95.16 Favored 'General case' 0 N--CA 1.491 1.587 0 O-C-N 121.487 -0.758 . . . . 0.0 109.267 179.798 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 97' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.493 1.704 0 CA-C-O 121.477 0.656 . . . . 0.0 109.482 -179.946 . . . . . . . . 0 0 . 1 . 013 nuclear nobuild core ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 97.3 m-20 . . . . . 0 N--CA 1.488 1.472 0 CA-C-O 121.515 0.674 . . . . 0.0 109.846 . . . . . . . . . 0 0 . 1 . 013 nuclear nobuild core ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 8.6 p -123.13 144.62 32.06 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.708 0 CA-C-O 121.354 0.597 . . . . 0.0 109.487 179.955 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -116.71 155.46 28.82 Favored 'General case' 0 N--CA 1.495 1.781 0 CA-C-O 121.473 0.654 . . . . 0.0 109.383 -179.404 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 77.7 mm-40 -108.26 136.06 48.55 Favored 'General case' 0 N--CA 1.494 1.729 0 CA-C-O 121.598 0.713 . . . . 0.0 109.61 179.858 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 34' ' ' VAL . . . . . . . . . . . . . 56.0 t -127.26 134.38 66.02 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.874 0 CA-C-O 121.592 0.711 . . . . 0.0 109.937 -179.579 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 45.8 p -136.68 122.42 19.86 Favored 'General case' 0 N--CA 1.493 1.704 0 N-CA-C 108.73 -0.841 . . . . 0.0 108.73 179.299 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 51.0 tp -117.7 143.59 46.05 Favored 'General case' 0 N--CA 1.497 1.882 0 CA-C-O 121.645 0.736 . . . . 0.0 110.109 -179.443 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 37' ' ' PHE . . . . . . . . . . . . . 82.9 m-85 -105.84 145.62 30.98 Favored 'General case' 0 N--CA 1.494 1.752 0 CA-C-O 121.657 0.741 . . . . 0.0 109.998 -179.858 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 38' ' ' GLY . . . . . 0.426 ' N ' HD21 ' A' ' 44' ' ' LEU . . . -173.55 175.28 46.27 Favored Glycine 0 N--CA 1.487 2.081 0 N-CA-C 109.77 -1.332 . . . . 0.0 109.77 -179.972 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 52.5 p -81.85 -92.28 0.06 Allowed 'General case' 0 N--CA 1.492 1.633 0 O-C-N 121.582 -0.952 . . . . 0.0 109.989 -179.819 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 40' ' ' ASP . . . . . . . . . . . . . 99.8 m-20 -82.24 168.82 17.25 Favored 'General case' 0 N--CA 1.495 1.779 0 O-C-N 121.225 -0.922 . . . . 0.0 110.631 -179.387 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 65.8 tttm -64.04 -38.82 92.46 Favored 'General case' 0 N--CA 1.497 1.908 0 O-C-N 121.652 -0.655 . . . . 0.0 110.514 -179.933 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -56.01 -39.21 71.55 Favored 'General case' 0 N--CA 1.494 1.766 0 O-C-N 121.314 -0.866 . . . . 0.0 109.935 -179.246 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 43' ' ' HIS . . . . . 0.68 ' CE1' ' HZ3' ' A' ' 47' ' ' LYS . 78.1 t60 -66.79 -45.2 79.16 Favored 'General case' 0 N--CA 1.494 1.743 0 O-C-N 121.315 -0.866 . . . . 0.0 109.861 -179.928 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 44' ' ' LEU . . . . . 0.426 HD21 ' N ' ' A' ' 38' ' ' GLY . 81.8 mt -64.69 -41.67 95.87 Favored 'General case' 0 N--CA 1.497 1.91 0 O-C-N 121.382 -0.823 . . . . 0.0 109.955 -179.69 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 71.1 mm-40 -63.91 -38.4 90.93 Favored 'General case' 0 N--CA 1.491 1.593 0 CA-C-O 121.66 0.743 . . . . 0.0 109.573 -179.81 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . -57.86 -54.81 34.45 Favored Glycine 0 N--CA 1.492 2.394 0 N-CA-C 109.823 -1.311 . . . . 0.0 109.823 -179.589 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 47' ' ' LYS . . . . . 0.68 ' HZ3' ' CE1' ' A' ' 43' ' ' HIS . 50.5 mttp -66.29 -37.8 86.27 Favored 'General case' 0 N--CA 1.494 1.755 0 O-C-N 121.497 -1.002 . . . . 0.0 109.761 179.45 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 50.5 tp -49.45 -36.17 21.71 Favored 'General case' 0 N--CA 1.492 1.632 0 O-C-N 121.497 -0.752 . . . . 0.0 109.394 -179.525 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 49' ' ' ALA . . . . . . . . . . . . . . . -55.03 -40.1 69.87 Favored 'General case' 0 N--CA 1.493 1.718 0 O-C-N 121.407 -0.808 . . . . 0.0 109.715 -179.918 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 96.8 mt-10 -67.21 -39.43 86.28 Favored 'General case' 0 N--CA 1.497 1.887 0 O-C-N 121.355 -0.84 . . . . 0.0 109.939 -179.888 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 12.4 m-85 -61.6 -47.41 85.61 Favored 'General case' 0 N--CA 1.496 1.856 0 O-C-N 121.36 -0.837 . . . . 0.0 109.918 -179.556 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 52' ' ' ILE . . . . . . . . . . . . . 96.8 mt -66.17 -43.13 92.15 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.629 0 O-C-N 121.524 -0.735 . . . . 0.0 109.884 -179.619 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 80.5 p -58.93 -43.21 91.14 Favored 'General case' 0 N--CA 1.494 1.769 0 O-C-N 121.371 -0.831 . . . . 0.0 109.498 -179.328 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 54' ' ' LEU . . . . . . . . . . . . . 79.7 mt -64.95 -39.88 94.17 Favored 'General case' 0 N--CA 1.494 1.734 0 O-C-N 121.461 -0.774 . . . . 0.0 109.366 179.358 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -58.56 -42.68 88.48 Favored 'General case' 0 N--CA 1.49 1.546 0 CA-C-O 121.535 0.683 . . . . 0.0 109.595 -179.774 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 56' ' ' LYS . . . . . . . . . . . . . 54.0 mtmt -64.9 -45.31 86.44 Favored 'General case' 0 N--CA 1.492 1.672 0 O-C-N 121.326 -0.859 . . . . 0.0 109.554 179.658 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 99.3 mm-40 -63.47 -44.13 95.33 Favored 'General case' 0 N--CA 1.494 1.736 0 O-C-N 121.589 -0.694 . . . . 0.0 109.64 -179.866 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 58' ' ' VAL . . . . . . . . . . . . . 79.4 t -65.17 -45.43 93.98 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.691 0 O-C-N 121.283 -0.885 . . . . 0.0 109.443 179.823 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 59' ' ' TYR . . . . . . . . . . . . . 82.8 t80 -140.25 120.06 13.45 Favored 'General case' 0 N--CA 1.497 1.881 0 O-C-N 121.272 -0.893 . . . . 0.0 109.589 -179.975 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -68.09 148.1 51.42 Favored 'General case' 0 N--CA 1.491 1.586 0 CA-C-O 121.819 0.818 . . . . 0.0 110.631 -179.717 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 61' ' ' ASN . . . . . . . . . . . . . 8.5 t-20 59.44 40.73 20.42 Favored 'General case' 0 N--CA 1.493 1.68 0 CA-C-O 121.689 0.757 . . . . 0.0 109.693 -179.879 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 62' ' ' VAL . . . . . . . . . . . . . 14.9 p -74.84 139.62 18.85 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.618 0 O-C-N 121.52 -0.737 . . . . 0.0 110.056 179.782 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 63' ' ' GLU . . . . . 0.548 ' OE1' ' N ' ' A' ' 63' ' ' GLU . 56.6 mp0 -109.84 137.15 48.04 Favored 'General case' 0 N--CA 1.495 1.785 0 CA-C-O 121.583 0.706 . . . . 0.0 109.474 -179.656 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 64' ' ' TYR . . . . . . . . . . . . . 53.4 p90 -148.68 163.37 37.51 Favored 'General case' 0 N--CA 1.492 1.643 0 CA-C-O 121.718 0.771 . . . . 0.0 110.252 -179.22 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 44.9 tt0 -141.96 147.81 37.59 Favored 'General case' 0 N--CA 1.494 1.762 0 N-CA-C 108.979 -0.749 . . . . 0.0 108.979 179.711 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 66' ' ' VAL . . . . . . . . . . . . . 92.1 t -120.13 130.19 74.6 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.965 0 CA-C-O 121.654 0.74 . . . . 0.0 110.204 -179.825 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 67' ' ' ALA . . . . . 0.413 ' O ' HG23 ' A' ' 69' ' ' VAL . . . -75.72 152.35 85.01 Favored Pre-proline 0 N--CA 1.485 1.319 0 N-CA-C 109.349 -0.611 . . . . 0.0 109.349 -179.888 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 68' ' ' PRO . . . . . . . . . . . . . 80.4 Cg_exo -42.44 131.39 5.09 Favored 'Trans proline' 0 C--N 1.31 -1.449 0 C-N-CA 122.637 2.224 . . . . 0.0 112.89 179.672 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 69' ' ' VAL . . . . . 0.413 HG23 ' O ' ' A' ' 67' ' ' ALA . 88.3 t -125.32 131.21 72.58 Favored 'Isoleucine or valine' 0 N--CA 1.499 1.985 0 CA-C-O 121.722 0.772 . . . . 0.0 109.978 -179.955 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -76.98 156.33 31.98 Favored 'General case' 0 C--N 1.302 -1.495 0 CA-C-O 121.619 0.723 . . . . 0.0 110.016 179.863 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 71' ' ' ASP . . . . . 0.404 ' O ' ' OD1' ' A' ' 71' ' ' ASP . 62.9 t0 -63.13 -37.77 88.55 Favored 'General case' 0 N--CA 1.493 1.692 0 O-C-N 121.542 -0.724 . . . . 0.0 109.694 179.727 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 72' ' ' ASN . . . . . . . . . . . . . 8.5 m120 -94.23 13.05 24.62 Favored 'General case' 0 N--CA 1.496 1.846 0 O-C-N 121.226 -0.922 . . . . 0.0 109.171 -179.948 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -60.03 141.82 55.04 Favored 'General case' 0 N--CA 1.493 1.723 0 O-C-N 121.34 -0.85 . . . . 0.0 109.972 -179.696 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 74' ' ' THR . . . . . . . . . . . . . 16.4 p -104.83 0.23 27.86 Favored 'General case' 0 N--CA 1.494 1.73 0 N-CA-C 109.013 -0.736 . . . . 0.0 109.013 179.585 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 84.3 tt0 -144.46 149.84 36.65 Favored 'General case' 0 N--CA 1.494 1.772 0 O-C-N 121.143 -0.973 . . . . 0.0 109.614 179.766 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 6.3 tt -124.47 130.35 52.31 Favored 'General case' 0 N--CA 1.494 1.726 0 CA-C-O 121.325 0.583 . . . . 0.0 109.512 179.885 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 77' ' ' HIS . . . . . . . . . . . . . 96.4 m-70 -107.59 130.76 54.86 Favored 'General case' 0 N--CA 1.495 1.808 0 CA-C-O 121.655 0.74 . . . . 0.0 109.679 -179.711 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -146.15 156.82 43.69 Favored 'General case' 0 N--CA 1.49 1.561 0 O-C-N 121.6 -0.687 . . . . 0.0 109.318 -179.697 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 84.6 mtt85 -129.67 145.91 51.49 Favored 'General case' 0 N--CA 1.495 1.82 0 O-C-N 121.646 -0.659 . . . . 0.0 109.629 -179.62 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 80' ' ' PHE . . . . . . . . . . . . . 92.8 m-85 -129.64 145.92 51.47 Favored 'General case' 0 N--CA 1.495 1.816 0 O-C-N 121.637 -0.664 . . . . 0.0 109.353 -179.862 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 27.6 ttpt -117.04 121.53 41.6 Favored 'General case' 0 N--CA 1.494 1.752 0 CA-C-O 121.507 0.67 . . . . 0.0 109.721 -179.785 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 82' ' ' PHE . . . . . . . . . . . . . 68.8 m-85 -111.42 148.81 32.29 Favored 'General case' 0 N--CA 1.495 1.816 0 CA-C-O 121.637 0.732 . . . . 0.0 109.756 179.784 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 80.6 tt0 -64.16 -31.79 73.12 Favored 'General case' 0 N--CA 1.49 1.555 0 O-C-N 121.733 -0.604 . . . . 0.0 109.521 179.957 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 84' ' ' VAL . . . . . 0.425 HG23 ' H ' ' A' ' 87' ' ' GLU . 27.6 m -134.11 156.48 40.88 Favored 'Isoleucine or valine' 0 N--CA 1.5 2.044 0 O-C-N 121.359 -0.838 . . . . 0.0 110.139 -179.853 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 78.3 p -70.26 -24.02 62.99 Favored 'General case' 0 N--CA 1.492 1.64 0 CA-C-O 121.51 0.672 . . . . 0.0 109.962 179.802 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 86' ' ' ALA . . . . . . . . . . . . . . . -59.21 -46.08 89.4 Favored 'General case' 0 N--CA 1.494 1.736 0 O-C-N 121.316 -0.865 . . . . 0.0 109.663 -179.712 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 87' ' ' GLU . . . . . 0.425 ' H ' HG23 ' A' ' 84' ' ' VAL . 98.4 mt-10 -70.52 -32.43 69.9 Favored 'General case' 0 N--CA 1.495 1.799 0 CA-C-O 121.742 0.782 . . . . 0.0 109.36 179.593 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 88' ' ' LYS . . . . . . . . . . . . . 14.1 tmtt? -61.98 -47.22 85.81 Favored 'General case' 0 C--N 1.301 -1.539 0 O-C-N 121.52 -0.737 . . . . 0.0 110.081 -179.713 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 95.8 mt -64.34 -43.26 95.15 Favored 'General case' 0 N--CA 1.494 1.766 0 O-C-N 121.419 -0.801 . . . . 0.0 109.639 -179.988 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 90' ' ' ILE . . . . . . . . . . . . . 96.9 mt -65.64 -43.54 93.86 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.667 0 CA-C-O 121.569 0.7 . . . . 0.0 109.793 -179.631 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 91' ' ' PHE . . . . . . . . . . . . . 76.5 t80 -61.4 -45.48 94.14 Favored 'General case' 0 N--CA 1.493 1.717 0 O-C-N 121.573 -0.704 . . . . 0.0 110.05 -179.465 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 92' ' ' GLU . . . . . . . . . . . . . 48.2 tp10 -66.01 -45.79 80.25 Favored 'General case' 0 N--CA 1.492 1.659 0 O-C-N 121.334 -0.854 . . . . 0.0 109.595 -179.691 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 93' ' ' LEU . . . . . . . . . . . . . 82.8 mt -64.44 -43.22 94.99 Favored 'General case' 0 N--CA 1.497 1.881 0 O-C-N 121.327 -0.858 . . . . 0.0 109.934 -179.917 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 94' ' ' LYS . . . . . . . . . . . . . 38.0 ttmt -66.57 -44.41 82.32 Favored 'General case' 0 N--CA 1.494 1.75 0 O-C-N 121.356 -0.84 . . . . 0.0 109.956 -179.824 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 20.9 p -66.35 -43.74 85.22 Favored 'General case' 0 N--CA 1.494 1.747 0 O-C-N 121.407 -0.808 . . . . 0.0 109.632 -179.716 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 96' ' ' ARG . . . . . . . . . . . . . 41.6 mmm-85 -65.94 -38.92 89.9 Favored 'General case' 0 N--CA 1.493 1.693 0 O-C-N 121.485 -0.759 . . . . 0.0 109.547 179.97 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 97' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.493 1.712 0 O-C-N 121.525 -0.734 . . . . 0.0 109.581 -179.957 . . . . . . . . 0 0 . 1 . 014 nuclear nobuild core ' A' A ' 30' ' ' ASP . . . . . 0.431 ' OD2' ' O ' ' A' ' 83' ' ' GLU . 98.1 m-20 . . . . . 0 N--CA 1.493 1.683 0 CA-C-O 121.56 0.695 . . . . 0.0 110.262 . . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 31' ' ' VAL . . . . . 0.412 HG11 HH21 ' A' ' 79' ' ' ARG . 9.8 p -128.23 139.24 52.43 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.904 0 N-CA-C 108.717 -0.846 . . . . 0.0 108.717 179.544 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -114.93 153.6 30.26 Favored 'General case' 0 N--CA 1.498 1.958 0 O-C-N 121.633 -0.667 . . . . 0.0 109.353 -179.515 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 33' ' ' GLU . . . . . 0.547 ' N ' ' OE1' ' A' ' 33' ' ' GLU . 55.7 mp0 -103.13 145.56 29.73 Favored 'General case' 0 N--CA 1.495 1.777 0 O-C-N 121.619 -0.676 . . . . 0.0 109.381 -179.438 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 34' ' ' VAL . . . . . . . . . . . . . 46.3 t -126.14 133.75 68.11 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.936 0 N-CA-C 108.85 -0.796 . . . . 0.0 108.85 179.879 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 40.8 t -129.88 131.56 46.1 Favored 'General case' 0 N--CA 1.495 1.806 0 N-CA-C 108.86 -0.793 . . . . 0.0 108.86 179.756 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 44.5 tp -126.01 131.38 52.22 Favored 'General case' 0 N--CA 1.499 2.014 0 O-C-N 121.418 -0.801 . . . . 0.0 108.967 179.717 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 37' ' ' PHE . . . . . . . . . . . . . 93.7 m-85 -115.74 144.99 43.19 Favored 'General case' 0 N--CA 1.497 1.911 0 N-CA-C 109.294 -0.632 . . . . 0.0 109.294 -179.614 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . -174.07 176.94 46.49 Favored Glycine 0 N--CA 1.491 2.301 0 N-CA-C 109.585 -1.406 . . . . 0.0 109.585 179.907 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 34.6 p -61.36 -98.98 0.0 OUTLIER 'General case' 0 C--N 1.301 -1.528 0 O-C-N 121.267 -1.137 . . . . 0.0 110.776 -179.268 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 40' ' ' ASP . . . . . 0.418 ' OD1' ' N ' ' A' ' 41' ' ' LYS . 51.4 t0 -76.84 153.43 34.83 Favored 'General case' 0 N--CA 1.494 1.727 0 CA-C-O 121.71 0.766 . . . . 0.0 110.938 -178.67 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 41' ' ' LYS . . . . . 0.418 ' N ' ' OD1' ' A' ' 40' ' ' ASP . 65.5 tttm -64.97 -35.64 81.84 Favored 'General case' 0 N--CA 1.491 1.597 0 O-C-N 121.614 -0.679 . . . . 0.0 109.978 -179.974 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -55.94 -39.53 71.83 Favored 'General case' 0 N--CA 1.492 1.659 0 O-C-N 121.276 -0.89 . . . . 0.0 109.496 -179.382 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 43' ' ' HIS . . . . . . . . . . . . . 11.7 t-160 -62.97 -38.56 91.6 Favored 'General case' 0 N--CA 1.489 1.494 0 O-C-N 121.307 -0.871 . . . . 0.0 109.127 179.865 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 46.2 mt -61.3 -40.71 95.18 Favored 'General case' 0 N--CA 1.489 1.497 0 O-C-N 121.23 -0.919 . . . . 0.0 109.299 -179.724 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 97.7 mt-10 -62.76 -36.35 82.78 Favored 'General case' 0 N--CA 1.491 1.579 0 O-C-N 121.344 -0.848 . . . . 0.0 109.306 -179.939 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . -60.86 -41.62 99.29 Favored Glycine 0 N--CA 1.492 2.402 0 N-CA-C 109.501 -1.44 . . . . 0.0 109.501 -179.902 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 97.5 mttt -77.37 -25.13 50.65 Favored 'General case' 0 N--CA 1.493 1.702 0 O-C-N 121.118 -1.225 . . . . 0.0 109.687 179.776 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 57.8 tp -61.66 -39.2 90.54 Favored 'General case' 0 N--CA 1.49 1.554 0 O-C-N 121.432 -0.793 . . . . 0.0 109.44 179.975 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 49' ' ' ALA . . . . . . . . . . . . . . . -53.66 -42.2 67.61 Favored 'General case' 0 N--CA 1.491 1.621 0 O-C-N 121.3 -0.875 . . . . 0.0 109.948 -179.315 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 50' ' ' GLU . . . . . 0.476 ' OE1' ' N ' ' A' ' 50' ' ' GLU . 58.2 mp0 -69.96 -42.35 73.31 Favored 'General case' 0 N--CA 1.494 1.742 0 O-C-N 121.236 -0.915 . . . . 0.0 109.84 -179.679 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 51' ' ' TYR . . . . . 0.461 ' CZ ' ' CG2' ' A' ' 95' ' ' THR . 4.3 m-85 -50.85 -49.11 59.63 Favored 'General case' 0 N--CA 1.489 1.516 0 O-C-N 121.138 -0.976 . . . . 0.0 108.779 -179.193 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 52' ' ' ILE . . . . . 0.47 HD13 ' OH ' ' A' ' 64' ' ' TYR . 93.6 mt -65.52 -43.57 94.26 Favored 'Isoleucine or valine' 0 C--N 1.297 -1.675 0 O-C-N 121.57 -0.706 . . . . 0.0 110.066 179.878 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 48.0 t -58.2 -49.51 76.78 Favored 'General case' 0 N--CA 1.493 1.696 0 O-C-N 121.132 -0.98 . . . . 0.0 110.503 -178.583 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 54' ' ' LEU . . . . . 0.654 HD12 ' NZ ' ' A' ' 94' ' ' LYS . 4.3 mm? -64.35 -41.25 96.84 Favored 'General case' 0 N--CA 1.491 1.622 0 O-C-N 121.099 -1.001 . . . . 0.0 109.105 179.554 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -62.78 -36.35 82.82 Favored 'General case' 0 N--CA 1.49 1.527 0 O-C-N 121.382 -0.823 . . . . 0.0 109.531 -179.831 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 56' ' ' LYS . . . . . . . . . . . . . 30.3 mmtm -62.27 -45.56 92.74 Favored 'General case' 0 N--CA 1.492 1.649 0 O-C-N 121.385 -0.822 . . . . 0.0 109.934 -179.963 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 58.5 tt0 -68.87 -41.78 77.92 Favored 'General case' 0 N--CA 1.49 1.554 0 O-C-N 121.242 -0.911 . . . . 0.0 109.625 -179.86 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 58' ' ' VAL . . . . . 0.478 ' CG1' ' OE1' ' A' ' 87' ' ' GLU . 66.8 t -64.09 -45.71 95.77 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.455 0 O-C-N 121.308 -0.87 . . . . 0.0 109.607 179.883 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 59' ' ' TYR . . . . . 0.44 ' O ' ' O ' ' A' ' 60' ' ' ALA . 62.9 t80 -126.89 136.22 52.02 Favored 'General case' 0 N--CA 1.5 2.032 0 O-C-N 121.494 -0.754 . . . . 0.0 109.586 -179.46 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 60' ' ' ALA . . . . . 0.44 ' O ' ' O ' ' A' ' 59' ' ' TYR . . . -48.25 -102.99 0.0 OUTLIER 'General case' 0 N--CA 1.494 1.741 0 O-C-N 121.693 -0.63 . . . . 0.0 110.867 -179.286 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 61' ' ' ASN . . . . . . . . . . . . . 83.2 m-20 -85.51 86.9 7.34 Favored 'General case' 0 N--CA 1.492 1.637 0 O-C-N 121.266 -0.896 . . . . 0.0 109.439 -179.119 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 62' ' ' VAL . . . . . . . . . . . . . 14.7 p -81.72 136.74 22.44 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.585 0 O-C-N 121.333 -0.855 . . . . 0.0 109.687 -179.927 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 96.8 mt-10 -108.45 137.09 46.99 Favored 'General case' 0 N--CA 1.5 2.05 0 O-C-N 121.407 -0.808 . . . . 0.0 108.95 179.842 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 64' ' ' TYR . . . . . 0.47 ' OH ' HD13 ' A' ' 52' ' ' ILE . 48.6 p90 -152.56 164.11 38.27 Favored 'General case' 0 N--CA 1.49 1.565 0 O-C-N 121.226 -0.921 . . . . 0.0 109.511 -179.615 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 79.7 mm-40 -138.81 154.34 48.46 Favored 'General case' 0 N--CA 1.497 1.895 0 N-CA-C 108.756 -0.831 . . . . 0.0 108.756 179.793 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 66' ' ' VAL . . . . . . . . . . . . . 2.7 p -125.75 129.07 72.61 Favored 'Isoleucine or valine' 0 N--CA 1.499 1.989 0 N-CA-C 109.088 -0.708 . . . . 0.0 109.088 -179.735 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -88.03 119.32 70.38 Favored Pre-proline 0 N--CA 1.494 1.76 0 O-C-N 121.378 -0.826 . . . . 0.0 109.014 -179.972 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 68' ' ' PRO . . . . . . . . . . . . . 84.8 Cg_exo -47.74 136.91 21.66 Favored 'Trans proline' 0 N--CA 1.499 1.847 0 C-N-CA 121.824 1.683 . . . . 0.0 112.916 179.687 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 69' ' ' VAL . . . . . . . . . . . . . 3.1 t -133.08 162.19 40.37 Favored 'Isoleucine or valine' 0 N--CA 1.503 2.182 0 O-C-N 121.601 -0.687 . . . . 0.0 109.935 -179.847 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 70' ' ' ALA . . . . . 0.821 ' HB3' ' HB2' ' A' ' 73' ' ' ALA . . . -62.22 145.68 52.9 Favored 'General case' 0 N--CA 1.496 1.844 0 O-C-N 121.378 -0.826 . . . . 0.0 110.087 -179.734 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 90.3 m-20 -70.01 -29.96 67.15 Favored 'General case' 0 N--CA 1.491 1.591 0 O-C-N 121.429 -0.795 . . . . 0.0 109.68 179.502 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 72' ' ' ASN . . . . . . . . . . . . . 98.6 m-20 -94.21 6.07 49.79 Favored 'General case' 0 N--CA 1.491 1.614 0 O-C-N 121.596 -0.69 . . . . 0.0 109.188 -179.882 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 73' ' ' ALA . . . . . 0.821 ' HB2' ' HB3' ' A' ' 70' ' ' ALA . . . -87.92 155.08 20.03 Favored 'General case' 0 N--CA 1.491 1.614 0 N-CA-C 108.644 -0.873 . . . . 0.0 108.644 179.583 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 74' ' ' THR . . . . . 0.634 ' O ' ' OG1' ' A' ' 74' ' ' THR . 0.0 OUTLIER -77.82 16.97 0.61 Allowed 'General case' 0 C--N 1.293 -1.881 0 CA-C-O 117.574 -1.203 . . . . 0.0 112.801 -179.808 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -158.81 165.85 33.29 Favored 'General case' 0 N--CA 1.523 3.179 0 C-N-CA 113.187 -3.405 . . . . 0.0 119.864 -175.045 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 76' ' ' LEU . . . . . 0.489 ' C ' HD23 ' A' ' 76' ' ' LEU . 7.5 tt -139.03 131.7 28.94 Favored 'General case' 0 C--N 1.297 -1.68 0 CA-C-N 109.348 -3.569 . . . . 0.0 104.952 -178.802 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 77' ' ' HIS . . . . . 0.488 ' N ' HD23 ' A' ' 76' ' ' LEU . 82.9 t60 -133.76 135.09 43.69 Favored 'General case' 0 N--CA 1.506 2.332 0 O-C-N 120.476 -1.39 . . . . 0.0 107.411 179.54 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -141.19 167.65 21.67 Favored 'General case' 0 N--CA 1.496 1.845 0 O-C-N 121.223 -0.923 . . . . 0.0 109.558 -178.989 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 79' ' ' ARG . . . . . 0.412 HH21 HG11 ' A' ' 31' ' ' VAL . 84.3 mtp180 -123.31 148.79 45.61 Favored 'General case' 0 N--CA 1.498 1.949 0 N-CA-C 108.625 -0.879 . . . . 0.0 108.625 179.827 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 80' ' ' PHE . . . . . . . . . . . . . 62.6 m-85 -130.06 150.27 51.4 Favored 'General case' 0 N--CA 1.5 2.042 0 N-CA-C 109.131 -0.692 . . . . 0.0 109.131 -179.565 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 35.6 ttpt -106.83 119.51 39.54 Favored 'General case' 0 N--CA 1.496 1.848 0 O-C-N 121.429 -0.794 . . . . 0.0 109.319 -179.975 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 82' ' ' PHE . . . . . . . . . . . . . 56.2 m-85 -128.65 153.23 47.5 Favored 'General case' 0 N--CA 1.501 2.078 0 O-C-N 121.606 -0.684 . . . . 0.0 109.299 -179.982 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 83' ' ' GLU . . . . . 0.431 ' O ' ' OD2' ' A' ' 30' ' ' ASP . 27.2 mm-40 -64.84 -41.96 95.3 Favored 'General case' 0 C--N 1.299 -1.594 0 O-C-N 121.51 -0.744 . . . . 0.0 109.854 -179.13 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 84' ' ' VAL . . . . . . . . . . . . . 2.9 m -136.34 160.78 37.91 Favored 'Isoleucine or valine' 0 N--CA 1.501 2.082 0 O-C-N 121.354 -0.841 . . . . 0.0 110.424 -179.145 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 85' ' ' SER . . . . . 0.522 ' O ' ' N ' ' A' ' 88' ' ' LYS . 11.6 t -63.75 -41.06 98.08 Favored 'General case' 0 N--CA 1.491 1.6 0 O-C-N 121.597 -0.689 . . . . 0.0 110.24 179.553 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 86' ' ' ALA . . . . . . . . . . . . . . . -40.75 -36.19 0.58 Allowed 'General case' 0 N--CA 1.5 2.04 0 O-C-N 121.621 -0.675 . . . . 0.0 110.02 -179.005 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 87' ' ' GLU . . . . . 0.478 ' OE1' ' CG1' ' A' ' 58' ' ' VAL . 70.3 mm-40 -65.71 -37.7 87.15 Favored 'General case' 0 C--N 1.301 -1.5 0 O-C-N 121.353 -0.842 . . . . 0.0 109.077 179.249 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 88' ' ' LYS . . . . . 0.522 ' N ' ' O ' ' A' ' 85' ' ' SER . 28.2 tptp -63.65 -46.38 85.92 Favored 'General case' 0 C--N 1.303 -1.428 0 O-C-N 121.26 -0.9 . . . . 0.0 109.398 179.875 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 89' ' ' LEU . . . . . 0.537 ' N ' HD12 ' A' ' 89' ' ' LEU . 10.8 mp -61.56 -46.95 87.72 Favored 'General case' 0 C--N 1.302 -1.48 0 O-C-N 121.319 -0.863 . . . . 0.0 109.465 -179.301 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 90' ' ' ILE . . . . . . . . . . . . . 96.8 mt -68.18 -44.2 84.37 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.522 0 O-C-N 121.212 -0.93 . . . . 0.0 109.668 179.81 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 91' ' ' PHE . . . . . . . . . . . . . 88.8 t80 -61.39 -46.48 90.01 Favored 'General case' 0 N--CA 1.491 1.599 0 O-C-N 121.395 -0.815 . . . . 0.0 109.54 -179.722 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 92' ' ' GLU . . . . . . . . . . . . . 84.0 tt0 -66.11 -40.02 90.4 Favored 'General case' 0 C--N 1.303 -1.441 0 O-C-N 121.272 -0.893 . . . . 0.0 109.151 179.98 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 93' ' ' LEU . . . . . . . . . . . . . 8.2 tp -62.93 -48.71 77.76 Favored 'General case' 0 N--CA 1.488 1.471 0 O-C-N 121.397 -0.814 . . . . 0.0 109.343 -179.701 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 94' ' ' LYS . . . . . 0.654 ' NZ ' HD12 ' A' ' 54' ' ' LEU . 17.3 ttpp -70.17 -45.36 66.87 Favored 'General case' 0 N--CA 1.491 1.609 0 O-C-N 121.475 -0.766 . . . . 0.0 109.827 179.74 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 95' ' ' THR . . . . . 0.461 ' CG2' ' CZ ' ' A' ' 51' ' ' TYR . 92.2 m -62.11 -44.26 97.04 Favored 'General case' 0 C--N 1.301 -1.523 0 O-C-N 121.558 -0.714 . . . . 0.0 109.419 -179.825 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 96' ' ' ARG . . . . . . . . . . . . . 71.1 ttp85 -57.99 -42.44 85.13 Favored 'General case' 0 N--CA 1.489 1.497 0 O-C-N 121.389 -0.819 . . . . 0.0 109.161 179.803 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 97' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.301 -1.507 0 O-C-N 121.379 -0.826 . . . . 0.0 108.86 179.733 . . . . . . . . 0 0 . 1 . 015 nuclear nobuild core ' A' A ' 30' ' ' ASP . . . . . 0.533 ' OD2' ' NZ ' ' A' ' 81' ' ' LYS . 25.9 p-10 . . . . . 0 N--CA 1.492 1.658 0 N-CA-C 109.373 -0.603 . . . . 0.0 109.373 . . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 53.1 t -116.7 135.28 57.54 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.845 0 CA-C-O 121.499 0.666 . . . . 0.0 109.647 -179.381 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -109.01 156.21 20.01 Favored 'General case' 0 N--CA 1.492 1.637 0 N-CA-C 109.191 -0.67 . . . . 0.0 109.191 179.92 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 99.4 mt-10 -107.1 128.15 54.13 Favored 'General case' 0 N--CA 1.496 1.825 0 O-C-N 121.551 -0.718 . . . . 0.0 110.113 -179.111 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 34' ' ' VAL . . . . . . . . . . . . . 53.2 t -123.45 135.17 64.17 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.693 0 O-C-N 121.618 -0.677 . . . . 0.0 109.343 -179.864 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 28.1 p -132.33 142.35 49.31 Favored 'General case' 0 N--CA 1.495 1.781 0 O-C-N 121.518 -0.739 . . . . 0.0 109.273 179.608 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 36' ' ' LEU . . . . . 0.457 HD21 ' CE2' ' A' ' 51' ' ' TYR . 85.6 mt -125.43 148.9 48.63 Favored 'General case' 0 N--CA 1.496 1.854 0 O-C-N 121.651 -0.656 . . . . 0.0 109.283 179.854 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 37' ' ' PHE . . . . . . . . . . . . . 91.9 m-85 -127.07 144.94 50.9 Favored 'General case' 0 N--CA 1.493 1.686 0 O-C-N 121.757 -0.59 . . . . 0.0 109.588 -179.746 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . 164.86 -156.14 27.93 Favored Glycine 0 N--CA 1.485 1.913 0 N-CA-C 109.926 -1.27 . . . . 0.0 109.926 179.92 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 9.8 m -80.4 -141.53 0.04 OUTLIER 'General case' 0 N--CA 1.49 1.546 0 O-C-N 121.547 -0.972 . . . . 0.0 110.655 -179.325 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 40' ' ' ASP . . . . . 0.407 ' CG ' ' H ' ' A' ' 41' ' ' LYS . 44.9 t0 -54.31 179.0 0.02 OUTLIER 'General case' 0 N--CA 1.488 1.471 0 CA-C-O 121.773 0.797 . . . . 0.0 110.59 -179.008 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 41' ' ' LYS . . . . . 0.407 ' H ' ' CG ' ' A' ' 40' ' ' ASP . 26.9 ttmt -61.28 -39.84 91.91 Favored 'General case' 0 N--CA 1.49 1.566 0 O-C-N 121.702 -0.624 . . . . 0.0 110.378 -179.394 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -47.08 -49.78 21.09 Favored 'General case' 0 N--CA 1.494 1.76 0 O-C-N 121.248 -0.908 . . . . 0.0 110.289 -178.788 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 43' ' ' HIS . . . . . . . . . . . . . 6.0 t60 -61.64 -41.98 98.26 Favored 'General case' 0 N--CA 1.49 1.573 0 O-C-N 121.346 -0.846 . . . . 0.0 109.564 -179.353 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 54.8 mt -63.96 -39.03 93.21 Favored 'General case' 0 N--CA 1.49 1.554 0 O-C-N 121.415 -0.803 . . . . 0.0 109.623 -179.861 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 96.6 mt-10 -58.22 -41.23 83.6 Favored 'General case' 0 N--CA 1.489 1.488 0 O-C-N 121.319 -0.863 . . . . 0.0 109.428 -179.743 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . -62.43 -43.41 99.08 Favored Glycine 0 N--CA 1.489 2.189 0 N-CA-C 109.244 -1.542 . . . . 0.0 109.244 179.972 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 68.6 mttm -65.28 -39.82 93.09 Favored 'General case' 0 N--CA 1.489 1.506 0 O-C-N 121.364 -1.08 . . . . 0.0 109.285 179.466 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 53.5 tp -62.02 -40.37 95.47 Favored 'General case' 0 N--CA 1.489 1.519 0 O-C-N 121.477 -0.764 . . . . 0.0 109.604 -179.545 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 49' ' ' ALA . . . . . . . . . . . . . . . -57.25 -40.84 78.45 Favored 'General case' 0 N--CA 1.49 1.535 0 O-C-N 121.346 -0.846 . . . . 0.0 109.505 -179.156 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 75.4 mt-10 -68.64 -37.41 79.68 Favored 'General case' 0 N--CA 1.489 1.505 0 O-C-N 121.515 -0.741 . . . . 0.0 109.443 179.828 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 51' ' ' TYR . . . . . 0.457 ' CE2' HD21 ' A' ' 36' ' ' LEU . 3.7 m-85 -61.78 -43.69 98.35 Favored 'General case' 0 N--CA 1.491 1.587 0 O-C-N 121.656 -0.652 . . . . 0.0 109.533 -179.34 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 52' ' ' ILE . . . . . . . . . . . . . 93.3 mt -63.71 -42.96 97.77 Favored 'Isoleucine or valine' 0 C--N 1.302 -1.46 0 N-CA-C 108.892 -0.781 . . . . 0.0 108.892 -179.904 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 25.2 m -49.75 -55.31 14.47 Favored 'General case' 0 N--CA 1.49 1.552 0 O-C-N 121.368 -0.832 . . . . 0.0 109.747 -179.529 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 54' ' ' LEU . . . . . 0.483 HD22 ' N ' ' A' ' 54' ' ' LEU . 4.0 mm? -65.17 -38.48 90.67 Favored 'General case' 0 N--CA 1.489 1.512 0 O-C-N 121.438 -0.789 . . . . 0.0 109.101 179.725 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -55.78 -46.82 77.88 Favored 'General case' 0 N--CA 1.488 1.429 0 O-C-N 121.487 -0.758 . . . . 0.0 109.391 -179.517 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 56' ' ' LYS . . . . . . . . . . . . . 66.0 mttm -63.65 -41.3 98.23 Favored 'General case' 0 C--N 1.303 -1.455 0 O-C-N 121.575 -0.703 . . . . 0.0 109.816 179.922 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 98.8 mm-40 -63.12 -47.21 83.75 Favored 'General case' 0 N--CA 1.487 1.417 0 O-C-N 121.448 -0.783 . . . . 0.0 109.607 -179.618 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 58' ' ' VAL . . . . . . . . . . . . . 75.1 t -66.13 -45.16 91.04 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.452 0 O-C-N 121.363 -0.836 . . . . 0.0 109.801 -179.916 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 59' ' ' TYR . . . . . . . . . . . . . 83.4 t80 -140.64 119.83 12.9 Favored 'General case' 0 N--CA 1.496 1.85 0 O-C-N 121.381 -0.825 . . . . 0.0 109.924 -179.528 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -71.66 154.66 41.23 Favored 'General case' 0 N--CA 1.491 1.608 0 O-C-N 121.629 -0.669 . . . . 0.0 110.939 -179.679 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 61' ' ' ASN . . . . . . . . . . . . . 10.4 m120 60.23 35.96 20.89 Favored 'General case' 0 N--CA 1.493 1.68 0 CA-C-O 121.465 0.65 . . . . 0.0 109.286 179.828 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 62' ' ' VAL . . . . . . . . . . . . . 12.4 p -71.89 137.88 22.73 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.491 0 O-C-N 121.548 -0.72 . . . . 0.0 109.912 -179.995 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 84.5 tt0 -113.01 146.04 39.8 Favored 'General case' 0 N--CA 1.492 1.675 0 CA-C-O 121.488 0.661 . . . . 0.0 109.397 -179.768 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 64' ' ' TYR . . . . . . . . . . . . . 53.3 p90 -150.89 162.94 39.82 Favored 'General case' 0 N--CA 1.487 1.413 0 O-C-N 121.295 -0.878 . . . . 0.0 110.047 179.964 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 65' ' ' GLU . . . . . 0.485 ' CD ' ' N ' ' A' ' 66' ' ' VAL . 9.6 tm-20 -142.6 148.8 38.08 Favored 'General case' 0 N--CA 1.489 1.523 0 N-CA-C 108.949 -0.76 . . . . 0.0 108.949 179.5 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 66' ' ' VAL . . . . . 0.485 ' N ' ' CD ' ' A' ' 65' ' ' GLU . 54.5 t -116.41 131.0 70.27 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.55 0 CA-C-O 121.741 0.782 . . . . 0.0 109.846 -179.652 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -84.76 156.65 61.33 Favored Pre-proline 0 C--N 1.306 -1.294 0 N-CA-C 108.811 -0.811 . . . . 0.0 108.811 179.526 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 68' ' ' PRO . . . . . . . . . . . . . 96.6 Cg_exo -43.03 138.72 3.94 Favored 'Trans proline' 0 N--CA 1.493 1.484 0 C-N-CA 122.588 2.192 . . . . 0.0 112.801 179.626 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 69' ' ' VAL . . . . . 0.496 ' C ' ' H ' ' A' ' 71' ' ' ASP . 67.2 t -124.42 134.06 67.71 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.735 0 CA-C-O 121.569 0.699 . . . . 0.0 109.828 -179.448 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 70' ' ' ALA . . . . . 0.655 ' O ' ' N ' ' A' ' 72' ' ' ASN . . . -73.2 35.89 0.08 Allowed 'General case' 0 N--CA 1.487 1.408 0 O-C-N 121.606 -0.684 . . . . 0.0 109.556 179.828 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 71' ' ' ASP . . . . . 0.496 ' H ' ' C ' ' A' ' 69' ' ' VAL . 97.9 m-20 53.39 -73.45 0.01 OUTLIER 'General case' 0 N--CA 1.496 1.827 0 CA-C-O 121.59 0.709 . . . . 0.0 110.059 179.76 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 72' ' ' ASN . . . . . 0.655 ' N ' ' O ' ' A' ' 70' ' ' ALA . 51.7 t30 -86.96 18.41 3.56 Favored 'General case' 0 C--N 1.299 -1.618 0 N-CA-C 108.136 -1.061 . . . . 0.0 108.136 179.492 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 73' ' ' ALA . . . . . 0.518 ' C ' ' H ' ' A' ' 75' ' ' GLU . . . -52.78 -6.96 0.06 Allowed 'General case' 0 N--CA 1.492 1.673 0 N-CA-C 109.274 -0.639 . . . . 0.0 109.274 -179.986 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 74' ' ' THR . . . . . 0.544 HG23 ' O ' ' A' ' 72' ' ' ASN . 6.1 p 61.96 -4.65 0.18 Allowed 'General case' 0 N--CA 1.492 1.674 0 O-C-N 121.625 -0.672 . . . . 0.0 109.624 -179.866 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 75' ' ' GLU . . . . . 0.518 ' H ' ' C ' ' A' ' 73' ' ' ALA . 22.4 pt-20 -149.08 150.44 32.76 Favored 'General case' 0 N--CA 1.49 1.534 0 O-C-N 121.161 -0.962 . . . . 0.0 109.41 179.404 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 6.2 tt -122.72 129.44 51.78 Favored 'General case' 0 N--CA 1.493 1.704 0 CA-C-O 121.566 0.698 . . . . 0.0 109.49 179.647 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 77' ' ' HIS . . . . . . . . . . . . . 97.7 m-70 -97.87 130.7 44.75 Favored 'General case' 0 N--CA 1.488 1.462 0 O-C-N 121.562 -0.711 . . . . 0.0 109.651 -179.658 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -146.64 153.88 40.82 Favored 'General case' 0 N--CA 1.489 1.498 0 O-C-N 121.37 -0.831 . . . . 0.0 109.582 179.939 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 99.6 mtt180 -129.78 148.02 51.61 Favored 'General case' 0 N--CA 1.491 1.582 0 N-CA-C 109.249 -0.648 . . . . 0.0 109.249 -179.949 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 80' ' ' PHE . . . . . . . . . . . . . 30.1 m-85 -126.12 149.92 48.6 Favored 'General case' 0 N--CA 1.493 1.722 0 O-C-N 121.629 -0.669 . . . . 0.0 109.419 -179.777 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 81' ' ' LYS . . . . . 0.533 ' NZ ' ' OD2' ' A' ' 30' ' ' ASP . 63.9 tttp -105.93 124.04 48.94 Favored 'General case' 0 N--CA 1.491 1.58 0 O-C-N 121.548 -0.72 . . . . 0.0 109.323 -179.969 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 82' ' ' PHE . . . . . 0.405 ' CD1' ' OE2' ' A' ' 87' ' ' GLU . 62.2 m-85 -124.95 144.52 50.31 Favored 'General case' 0 N--CA 1.493 1.675 0 CA-C-O 121.594 0.711 . . . . 0.0 109.56 -179.876 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 83.9 tt0 -67.03 -29.22 68.98 Favored 'General case' 0 N--CA 1.488 1.429 0 O-C-N 121.61 -0.681 . . . . 0.0 109.8 -179.627 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 84' ' ' VAL . . . . . 0.435 HG23 ' H ' ' A' ' 87' ' ' GLU . 35.0 m -131.51 150.37 34.08 Favored 'Isoleucine or valine' 0 N--CA 1.499 2.015 0 CA-C-O 121.832 0.825 . . . . 0.0 110.37 -179.483 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 36.9 m -72.6 -32.29 65.85 Favored 'General case' 0 N--CA 1.49 1.528 0 CA-C-O 121.451 0.643 . . . . 0.0 109.586 179.939 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 86' ' ' ALA . . . . . . . . . . . . . . . -54.36 -34.98 62.27 Favored 'General case' 0 N--CA 1.489 1.514 0 O-C-N 121.299 -0.875 . . . . 0.0 108.79 -179.669 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 87' ' ' GLU . . . . . 0.435 ' H ' HG23 ' A' ' 84' ' ' VAL . 80.4 tt0 -65.33 -32.17 73.69 Favored 'General case' 0 C--N 1.303 -1.437 0 N-CA-C 109.096 -0.705 . . . . 0.0 109.096 179.765 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 88' ' ' LYS . . . . . . . . . . . . . 88.8 tttt -63.2 -44.33 95.67 Favored 'General case' 0 N--CA 1.49 1.551 0 O-C-N 121.373 -0.829 . . . . 0.0 109.39 179.975 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 93.9 mt -62.05 -49.27 76.67 Favored 'General case' 0 N--CA 1.491 1.607 0 O-C-N 121.39 -0.818 . . . . 0.0 110.145 -179.217 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 90' ' ' ILE . . . . . 0.535 ' N ' HD12 ' A' ' 90' ' ' ILE . 1.4 mp -70.32 -42.11 78.65 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.582 0 O-C-N 121.366 -0.834 . . . . 0.0 109.403 -179.971 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 91' ' ' PHE . . . . . . . . . . . . . 70.3 t80 -57.45 -45.85 84.27 Favored 'General case' 0 C--N 1.303 -1.445 0 O-C-N 121.406 -0.809 . . . . 0.0 108.886 -179.137 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 92' ' ' GLU . . . . . . . . . . . . . 98.1 mt-10 -68.23 -33.58 74.66 Favored 'General case' 0 C--N 1.301 -1.506 0 N-CA-C 109.116 -0.698 . . . . 0.0 109.116 179.263 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 93' ' ' LEU . . . . . . . . . . . . . 59.0 tp -62.82 -43.19 99.46 Favored 'General case' 0 N--CA 1.488 1.459 0 O-C-N 121.496 -0.753 . . . . 0.0 109.401 -179.736 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 94' ' ' LYS . . . . . . . . . . . . . 67.2 mmtt -65.25 -42.5 93.27 Favored 'General case' 0 N--CA 1.487 1.407 0 O-C-N 121.468 -0.77 . . . . 0.0 109.735 -179.581 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 18.0 p -66.11 -43.06 88.28 Favored 'General case' 0 N--CA 1.488 1.454 0 O-C-N 121.253 -0.904 . . . . 0.0 109.497 -179.732 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 96' ' ' ARG . . . . . . . . . . . . . 17.3 tpp180 -62.61 -44.76 95.49 Favored 'General case' 0 N--CA 1.487 1.388 0 O-C-N 121.305 -0.872 . . . . 0.0 109.396 -179.81 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 97' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.488 1.434 0 N-CA-C 108.778 -0.823 . . . . 0.0 108.778 -179.835 . . . . . . . . 0 0 . 1 . 016 nuclear nobuild core ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 90.7 m-20 . . . . . 0 N--CA 1.487 1.4 0 N-CA-C 109.651 -0.5 . . . . 0.0 109.651 . . . . . . . . . 0 0 . 1 . 016 nuclear nobuild core ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 51.1 t -119.92 133.85 65.33 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.958 0 O-C-N 121.616 -0.678 . . . . 0.0 109.29 -179.828 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -126.65 149.45 49.51 Favored 'General case' 0 N--CA 1.494 1.766 0 CA-C-O 121.505 0.669 . . . . 0.0 109.603 -179.646 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 17.3 pt-20 -91.54 140.14 30.03 Favored 'General case' 0 N--CA 1.49 1.548 0 O-C-N 121.565 -0.709 . . . . 0.0 109.929 -179.577 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 34' ' ' VAL . . . . . 0.46 HG21 ' CD1' ' A' ' 80' ' ' PHE . 48.4 t -130.16 135.42 60.91 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.793 0 N-CA-C 108.566 -0.901 . . . . 0.0 108.566 179.293 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 44.8 t -134.96 142.71 46.55 Favored 'General case' 0 N--CA 1.493 1.709 0 N-CA-C 109.196 -0.668 . . . . 0.0 109.196 179.877 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 36' ' ' LEU . . . . . 0.53 HD21 ' CE2' ' A' ' 51' ' ' TYR . 76.7 mt -119.72 156.75 29.93 Favored 'General case' 0 N--CA 1.498 1.963 0 N-CA-C 109.256 -0.646 . . . . 0.0 109.256 -179.743 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 37' ' ' PHE . . . . . . . . . . . . . 92.4 m-85 -119.48 138.82 52.9 Favored 'General case' 0 N--CA 1.494 1.772 0 N-CA-C 109.445 -0.576 . . . . 0.0 109.445 -179.582 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 38' ' ' GLY . . . . . 0.52 ' N ' HD21 ' A' ' 44' ' ' LEU . . . -178.14 -175.62 45.43 Favored Glycine 0 N--CA 1.486 2.028 0 N-CA-C 109.781 -1.328 . . . . 0.0 109.781 -179.908 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 39' ' ' SER . . . . . 0.514 ' OG ' ' N ' ' A' ' 40' ' ' ASP . 93.7 p -98.93 -77.39 0.52 Allowed 'General case' 0 N--CA 1.494 1.739 0 O-C-N 121.643 -0.916 . . . . 0.0 109.637 179.89 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 40' ' ' ASP . . . . . 0.543 ' OD1' ' N ' ' A' ' 41' ' ' LYS . 58.3 t0 -80.59 156.44 26.43 Favored 'General case' 0 N--CA 1.49 1.558 0 O-C-N 121.322 -0.861 . . . . 0.0 110.015 -179.169 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 41' ' ' LYS . . . . . 0.543 ' N ' ' OD1' ' A' ' 40' ' ' ASP . 4.5 tmtt? -62.26 -42.13 99.06 Favored 'General case' 0 N--CA 1.488 1.44 0 O-C-N 121.316 -0.865 . . . . 0.0 109.757 -179.306 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -55.7 -41.19 73.42 Favored 'General case' 0 N--CA 1.492 1.628 0 O-C-N 120.984 -1.072 . . . . 0.0 110.291 -179.038 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 43' ' ' HIS . . . . . . . . . . . . . 82.0 t60 -61.24 -42.39 98.53 Favored 'General case' 0 C--N 1.301 -1.536 0 O-C-N 121.135 -0.978 . . . . 0.0 109.537 -179.78 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 44' ' ' LEU . . . . . 0.52 HD21 ' N ' ' A' ' 38' ' ' GLY . 84.0 mt -63.4 -40.06 96.19 Favored 'General case' 0 N--CA 1.49 1.534 0 O-C-N 121.346 -0.846 . . . . 0.0 109.838 -179.775 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 96.5 mt-10 -60.83 -37.22 81.29 Favored 'General case' 0 C--N 1.301 -1.516 0 O-C-N 121.197 -0.94 . . . . 0.0 109.139 179.874 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . -62.16 -42.87 99.73 Favored Glycine 0 N--CA 1.489 2.202 0 N-CA-C 109.341 -1.504 . . . . 0.0 109.341 179.855 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 54.9 mtpt -65.48 -36.61 84.39 Favored 'General case' 0 N--CA 1.488 1.454 0 O-C-N 121.312 -1.111 . . . . 0.0 109.577 179.421 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 57.5 tp -60.89 -40.41 92.94 Favored 'General case' 0 N--CA 1.489 1.485 0 O-C-N 121.497 -0.752 . . . . 0.0 109.593 -179.109 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 49' ' ' ALA . . . . . . . . . . . . . . . -56.11 -42.41 76.8 Favored 'General case' 0 C--N 1.302 -1.491 0 O-C-N 121.178 -0.951 . . . . 0.0 109.433 -179.352 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 97.3 mt-10 -66.48 -39.13 88.59 Favored 'General case' 0 C--N 1.302 -1.488 0 O-C-N 121.467 -0.771 . . . . 0.0 109.512 179.834 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 51' ' ' TYR . . . . . 0.53 ' CE2' HD21 ' A' ' 36' ' ' LEU . 4.3 m-85 -62.2 -40.77 97.19 Favored 'General case' 0 N--CA 1.491 1.598 0 O-C-N 121.519 -0.738 . . . . 0.0 109.638 -179.527 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 52' ' ' ILE . . . . . . . . . . . . . 96.8 mt -63.27 -42.61 97.04 Favored 'Isoleucine or valine' 0 C--N 1.298 -1.641 0 O-C-N 121.364 -0.835 . . . . 0.0 109.402 -179.671 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 66.6 m -57.82 -49.99 74.77 Favored 'General case' 0 N--CA 1.491 1.586 0 O-C-N 121.18 -0.95 . . . . 0.0 110.642 -179.022 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 54' ' ' LEU . . . . . 0.448 ' N ' HD22 ' A' ' 54' ' ' LEU . 4.2 mm? -66.05 -41.16 91.2 Favored 'General case' 0 N--CA 1.493 1.683 0 O-C-N 121.05 -1.031 . . . . 0.0 109.495 179.732 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -64.25 -39.14 93.34 Favored 'General case' 0 C--N 1.301 -1.516 0 O-C-N 121.46 -0.775 . . . . 0.0 109.476 -179.512 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 56' ' ' LYS . . . . . . . . . . . . . 88.8 tttt -64.05 -43.98 93.87 Favored 'General case' 0 C--N 1.304 -1.4 0 O-C-N 121.418 -0.801 . . . . 0.0 110.076 -179.478 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 15.5 mm100 -66.54 -41.64 88.41 Favored 'General case' 0 N--CA 1.489 1.497 0 O-C-N 121.236 -0.915 . . . . 0.0 109.635 -179.624 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 58' ' ' VAL . . . . . 0.469 ' CG1' ' OE1' ' A' ' 87' ' ' GLU . 74.7 t -64.92 -45.3 95.21 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.507 0 O-C-N 121.424 -0.797 . . . . 0.0 110.626 -179.27 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 59' ' ' TYR . . . . . . . . . . . . . 83.5 t80 -127.86 129.93 47.74 Favored 'General case' 0 N--CA 1.499 2.0 0 O-C-N 121.499 -0.751 . . . . 0.0 110.111 -178.898 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 60' ' ' ALA . . . . . 0.441 ' O ' ' CG ' ' A' ' 61' ' ' ASN . . . -68.51 154.99 40.81 Favored 'General case' 0 N--CA 1.489 1.478 0 O-C-N 121.59 -0.693 . . . . 0.0 110.234 -179.787 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 61' ' ' ASN . . . . . 0.441 ' CG ' ' O ' ' A' ' 60' ' ' ALA . 12.9 p30 45.4 58.31 4.27 Favored 'General case' 0 N--CA 1.493 1.724 0 CA-C-O 121.749 0.785 . . . . 0.0 109.347 -179.744 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 62' ' ' VAL . . . . . . . . . . . . . 14.7 p -74.09 136.5 25.15 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.458 0 CA-C-O 121.48 0.657 . . . . 0.0 110.211 -179.508 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 96.9 mt-10 -124.44 140.05 53.31 Favored 'General case' 0 N--CA 1.492 1.661 0 N-CA-C 109.248 -0.649 . . . . 0.0 109.248 179.826 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 64' ' ' TYR . . . . . . . . . . . . . 50.7 p90 -149.93 161.79 41.62 Favored 'General case' 0 C--N 1.303 -1.444 0 O-C-N 121.447 -0.783 . . . . 0.0 109.132 -179.854 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 49.4 tp10 -142.57 147.03 35.22 Favored 'General case' 0 N--CA 1.491 1.599 0 N-CA-C 108.66 -0.867 . . . . 0.0 108.66 179.694 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 66' ' ' VAL . . . . . . . . . . . . . 75.5 t -117.45 128.39 74.72 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.699 0 O-C-N 121.763 -0.586 . . . . 0.0 109.563 -179.85 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 67' ' ' ALA . . . . . 0.466 ' HB1' ' HD2' ' A' ' 68' ' ' PRO . . . -81.84 168.29 25.14 Favored Pre-proline 0 N--CA 1.489 1.487 0 O-C-N 121.533 -0.729 . . . . 0.0 109.158 -179.878 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 68' ' ' PRO . . . . . 0.466 ' HD2' ' HB1' ' A' ' 67' ' ' ALA . 51.1 Cg_exo -53.36 131.7 44.7 Favored 'Trans proline' 0 N--CA 1.497 1.717 0 C-N-CA 122.198 1.932 . . . . 0.0 112.537 179.588 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 69' ' ' VAL . . . . . . . . . . . . . 54.4 t -133.75 136.68 53.8 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.872 0 O-C-N 121.613 -0.679 . . . . 0.0 109.632 179.58 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -67.83 150.64 48.34 Favored 'General case' 0 N--CA 1.49 1.534 0 O-C-N 121.54 -0.725 . . . . 0.0 110.489 -179.694 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 96.8 m-20 -63.08 -37.16 86.1 Favored 'General case' 0 N--CA 1.492 1.669 0 O-C-N 121.426 -0.796 . . . . 0.0 109.979 179.904 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 72' ' ' ASN . . . . . . . . . . . . . 20.2 t-20 -86.64 9.33 18.97 Favored 'General case' 0 N--CA 1.493 1.677 0 O-C-N 121.296 -0.877 . . . . 0.0 108.891 -179.916 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -63.24 142.92 58.2 Favored 'General case' 0 N--CA 1.489 1.505 0 O-C-N 121.412 -0.805 . . . . 0.0 110.157 -179.465 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 74' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -105.84 5.54 30.83 Favored 'General case' 0 N--CA 1.493 1.686 0 N-CA-C 108.405 -0.961 . . . . 0.0 108.405 179.245 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 96.8 mt-10 -141.96 160.49 40.1 Favored 'General case' 0 N--CA 1.496 1.835 0 O-C-N 121.402 -0.811 . . . . 0.0 109.141 179.372 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 6.6 tp -129.1 134.09 47.93 Favored 'General case' 0 N--CA 1.496 1.868 0 O-C-N 121.669 -0.645 . . . . 0.0 109.349 179.912 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 77' ' ' HIS . . . . . . . . . . . . . 77.7 m80 -104.94 124.07 48.85 Favored 'General case' 0 N--CA 1.494 1.726 0 CA-C-O 121.425 0.631 . . . . 0.0 109.587 179.688 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -150.66 162.17 41.2 Favored 'General case' 0 N--CA 1.488 1.469 0 O-C-N 121.492 -0.755 . . . . 0.0 109.019 -179.995 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 84.4 mtt85 -128.89 149.54 50.73 Favored 'General case' 0 N--CA 1.493 1.711 0 N-CA-C 109.114 -0.698 . . . . 0.0 109.114 179.872 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 80' ' ' PHE . . . . . 0.46 ' CD1' HG21 ' A' ' 34' ' ' VAL . 34.4 m-85 -128.14 152.1 48.43 Favored 'General case' 0 N--CA 1.494 1.734 0 O-C-N 121.665 -0.647 . . . . 0.0 109.452 -179.821 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 65.7 tttm -107.81 140.21 41.24 Favored 'General case' 0 N--CA 1.492 1.653 0 CA-C-O 121.324 0.583 . . . . 0.0 109.924 -179.373 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 82' ' ' PHE . . . . . . . . . . . . . 82.7 m-85 -141.67 -164.6 1.81 Allowed 'General case' 0 N--CA 1.492 1.67 0 O-C-N 121.52 -0.738 . . . . 0.0 109.404 179.896 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 83.0 tt0 -100.46 -50.56 3.87 Favored 'General case' 0 N--CA 1.492 1.632 0 O-C-N 121.607 -0.683 . . . . 0.0 109.285 179.806 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 84' ' ' VAL . . . . . . . . . . . . . 2.5 m -134.72 164.88 32.82 Favored 'Isoleucine or valine' 0 N--CA 1.499 2.001 0 O-C-N 121.451 -0.781 . . . . 0.0 110.311 -179.534 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 38.1 t -61.87 -19.05 62.21 Favored 'General case' 0 N--CA 1.489 1.523 0 O-C-N 121.755 -0.591 . . . . 0.0 109.61 -179.908 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 86' ' ' ALA . . . . . . . . . . . . . . . -61.45 -37.21 82.73 Favored 'General case' 0 N--CA 1.489 1.487 0 O-C-N 121.241 -0.912 . . . . 0.0 109.618 -179.899 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 87' ' ' GLU . . . . . 0.469 ' OE1' ' CG1' ' A' ' 58' ' ' VAL . 79.6 mm-40 -66.61 -34.99 79.11 Favored 'General case' 0 N--CA 1.49 1.556 0 O-C-N 121.315 -0.865 . . . . 0.0 109.386 -179.916 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 88' ' ' LYS . . . . . . . . . . . . . 88.7 tttt -62.85 -46.48 87.71 Favored 'General case' 0 N--CA 1.49 1.552 0 O-C-N 121.328 -0.858 . . . . 0.0 109.628 -179.791 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 87.1 mt -63.26 -44.38 95.3 Favored 'General case' 0 N--CA 1.488 1.468 0 O-C-N 121.346 -0.846 . . . . 0.0 109.409 -179.669 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 90' ' ' ILE . . . . . . . . . . . . . 97.0 mt -66.55 -45.15 89.47 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.461 0 O-C-N 121.34 -0.85 . . . . 0.0 109.791 -179.954 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 91' ' ' PHE . . . . . . . . . . . . . 86.2 t80 -64.4 -43.41 94.53 Favored 'General case' 0 N--CA 1.489 1.484 0 O-C-N 121.477 -0.764 . . . . 0.0 109.78 -179.919 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 92' ' ' GLU . . . . . . . . . . . . . 47.6 tp10 -59.21 -39.24 82.04 Favored 'General case' 0 N--CA 1.488 1.46 0 O-C-N 121.409 -0.807 . . . . 0.0 108.887 -179.36 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 93' ' ' LEU . . . . . 0.411 ' HA ' ' HE ' ' A' ' 96' ' ' ARG . 5.5 tt -62.96 -43.56 98.47 Favored 'General case' 0 C--N 1.301 -1.529 0 O-C-N 121.434 -0.792 . . . . 0.0 109.633 179.928 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 94' ' ' LYS . . . . . . . . . . . . . 99.2 mttt -64.68 -40.83 96.07 Favored 'General case' 0 N--CA 1.489 1.482 0 O-C-N 121.529 -0.732 . . . . 0.0 109.428 -179.795 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 95' ' ' THR . . . . . 0.506 ' CG2' ' CE2' ' A' ' 51' ' ' TYR . 21.1 p -64.84 -42.97 94.49 Favored 'General case' 0 N--CA 1.49 1.534 0 O-C-N 121.317 -0.864 . . . . 0.0 109.304 -179.914 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 96' ' ' ARG . . . . . 0.411 ' HE ' ' HA ' ' A' ' 93' ' ' LEU . 89.4 mtm180 -63.81 -38.69 92.03 Favored 'General case' 0 N--CA 1.488 1.441 0 O-C-N 121.467 -0.771 . . . . 0.0 109.136 179.483 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 97' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.488 1.473 0 O-C-N 121.369 -0.832 . . . . 0.0 109.686 -179.931 . . . . . . . . 0 0 . 1 . 017 nuclear nobuild core ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 31.6 p30 . . . . . 0 N--CA 1.49 1.537 0 N-CA-C 108.774 -0.824 . . . . 0.0 108.774 . . . . . . . . . 0 0 . 1 . 017 nuclear nobuild core ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 53.5 t -126.02 133.7 68.31 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.864 0 N-CA-C 109.27 -0.641 . . . . 0.0 109.27 179.802 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -138.33 151.19 47.32 Favored 'General case' 0 N--CA 1.492 1.665 0 O-C-N 121.469 -0.769 . . . . 0.0 109.573 179.897 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 15.4 pt-20 -94.21 145.91 24.38 Favored 'General case' 0 N--CA 1.492 1.671 0 O-C-N 121.528 -0.733 . . . . 0.0 109.961 -179.552 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 34' ' ' VAL . . . . . . . . . . . . . 92.7 t -119.36 127.57 75.85 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.789 0 N-CA-C 108.64 -0.874 . . . . 0.0 108.64 179.893 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 26.1 t -117.36 128.0 54.61 Favored 'General case' 0 N--CA 1.494 1.736 0 N-CA-C 109.103 -0.703 . . . . 0.0 109.103 -179.829 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 36' ' ' LEU . . . . . 0.562 HD13 ' CZ ' ' A' ' 51' ' ' TYR . 55.1 tp -124.98 142.66 51.34 Favored 'General case' 0 N--CA 1.497 1.922 0 CA-C-O 121.381 0.61 . . . . 0.0 109.614 -179.996 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 37' ' ' PHE . . . . . . . . . . . . . 92.8 m-85 -104.69 147.01 28.14 Favored 'General case' 0 N--CA 1.493 1.723 0 O-C-N 121.685 -0.634 . . . . 0.0 109.818 179.992 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . -172.9 179.31 44.43 Favored Glycine 0 N--CA 1.488 2.128 0 N-CA-C 109.759 -1.336 . . . . 0.0 109.759 179.748 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 19.0 t -78.52 -99.27 0.02 OUTLIER 'General case' 0 N--CA 1.49 1.562 0 O-C-N 121.476 -1.014 . . . . 0.0 110.05 -179.809 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 40' ' ' ASP . . . . . . . . . . . . . 55.7 p-10 -85.59 175.44 8.78 Favored 'General case' 0 N--CA 1.49 1.573 0 O-C-N 121.424 -0.798 . . . . 0.0 110.453 -179.114 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 88.8 tttt -63.32 -41.96 98.95 Favored 'General case' 0 N--CA 1.491 1.581 0 O-C-N 121.528 -0.733 . . . . 0.0 109.196 179.905 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -53.5 -43.13 68.0 Favored 'General case' 0 N--CA 1.49 1.543 0 O-C-N 121.602 -0.686 . . . . 0.0 109.542 -179.65 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 43' ' ' HIS . . . . . . . . . . . . . 28.8 t-80 -63.21 -44.0 96.57 Favored 'General case' 0 N--CA 1.489 1.509 0 O-C-N 121.468 -0.77 . . . . 0.0 109.306 -179.851 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 84.5 mt -63.6 -39.87 95.48 Favored 'General case' 0 N--CA 1.491 1.575 0 O-C-N 121.52 -0.737 . . . . 0.0 109.306 179.982 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 97.1 mt-10 -59.65 -37.87 79.9 Favored 'General case' 0 N--CA 1.488 1.45 0 O-C-N 121.346 -0.846 . . . . 0.0 109.689 -179.782 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . -64.22 -52.01 47.82 Favored Glycine 0 N--CA 1.492 2.41 0 N-CA-C 109.588 -1.405 . . . . 0.0 109.588 -179.445 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 97.3 mttt -67.04 -32.61 73.92 Favored 'General case' 0 N--CA 1.49 1.54 0 O-C-N 121.395 -1.062 . . . . 0.0 109.376 179.299 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 48' ' ' LEU . . . . . 0.483 HD13 ' CD2' ' A' ' 76' ' ' LEU . 52.6 tp -58.07 -40.74 81.8 Favored 'General case' 0 C--N 1.301 -1.53 0 O-C-N 121.569 -0.707 . . . . 0.0 109.286 -179.341 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 49' ' ' ALA . . . . . . . . . . . . . . . -59.74 -39.43 84.71 Favored 'General case' 0 N--CA 1.488 1.468 0 O-C-N 121.395 -0.816 . . . . 0.0 109.442 -179.597 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 97.8 mt-10 -70.17 -39.21 75.41 Favored 'General case' 0 N--CA 1.49 1.565 0 O-C-N 121.452 -0.78 . . . . 0.0 109.616 179.797 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 51' ' ' TYR . . . . . 0.562 ' CZ ' HD13 ' A' ' 36' ' ' LEU . 4.4 m-85 -61.71 -48.61 79.99 Favored 'General case' 0 N--CA 1.492 1.627 0 O-C-N 121.361 -0.837 . . . . 0.0 109.547 -179.514 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 52' ' ' ILE . . . . . . . . . . . . . 95.4 mt -65.61 -44.45 93.71 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.444 0 O-C-N 121.346 -0.846 . . . . 0.0 109.359 -179.664 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 66.2 m -63.03 -42.07 99.69 Favored 'General case' 0 N--CA 1.488 1.465 0 O-C-N 121.557 -0.715 . . . . 0.0 109.637 -179.705 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 54' ' ' LEU . . . . . . . . . . . . . 56.0 tp -63.59 -42.25 98.28 Favored 'General case' 0 N--CA 1.489 1.48 0 O-C-N 121.497 -0.752 . . . . 0.0 109.329 -179.705 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -62.48 -41.4 98.76 Favored 'General case' 0 N--CA 1.489 1.505 0 O-C-N 121.523 -0.736 . . . . 0.0 109.477 -179.04 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 56' ' ' LYS . . . . . 0.479 ' O ' ' N ' ' A' ' 60' ' ' ALA . 97.8 mttt -64.93 -42.5 94.61 Favored 'General case' 0 C--N 1.302 -1.48 0 O-C-N 121.496 -0.752 . . . . 0.0 110.084 -179.797 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 58.4 tt0 -64.65 -42.03 95.71 Favored 'General case' 0 N--CA 1.49 1.534 0 O-C-N 121.118 -0.989 . . . . 0.0 109.314 -179.597 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 58' ' ' VAL . . . . . . . . . . . . . 71.6 t -68.46 -45.71 81.62 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.517 0 O-C-N 121.443 -0.785 . . . . 0.0 110.124 -179.834 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 59' ' ' TYR . . . . . 0.671 ' O ' ' HB3' ' A' ' 60' ' ' ALA . 53.8 t80 -110.39 -57.18 2.25 Favored 'General case' 0 N--CA 1.496 1.866 0 O-C-N 121.56 -0.713 . . . . 0.0 109.913 -178.818 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 60' ' ' ALA . . . . . 0.671 ' HB3' ' O ' ' A' ' 59' ' ' TYR . . . 82.98 145.22 0.07 Allowed 'General case' 0 N--CA 1.499 2.013 0 CA-C-O 121.27 0.557 . . . . 0.0 109.707 -179.757 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 61' ' ' ASN . . . . . . . . . . . . . 5.4 m120 59.49 33.46 22.22 Favored 'General case' 0 N--CA 1.491 1.61 0 N-CA-C 108.534 -0.913 . . . . 0.0 108.534 -179.253 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 62' ' ' VAL . . . . . . . . . . . . . 9.9 p -90.97 152.82 3.29 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.655 0 O-C-N 121.577 -0.702 . . . . 0.0 110.343 -179.524 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 96.9 mt-10 -113.43 132.5 55.61 Favored 'General case' 0 N--CA 1.494 1.727 0 N-CA-C 108.892 -0.781 . . . . 0.0 108.892 179.556 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 64' ' ' TYR . . . . . . . . . . . . . 52.4 p90 -142.83 162.22 36.04 Favored 'General case' 0 N--CA 1.489 1.516 0 O-C-N 121.432 -0.792 . . . . 0.0 109.428 -179.58 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 79.6 mm-40 -138.53 157.72 45.63 Favored 'General case' 0 N--CA 1.49 1.526 0 O-C-N 121.53 -0.731 . . . . 0.0 109.041 -179.946 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 66' ' ' VAL . . . . . . . . . . . . . 3.3 p -125.5 132.47 70.92 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.696 0 CA-C-O 121.648 0.737 . . . . 0.0 109.478 -179.6 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 67' ' ' ALA . . . . . 0.542 ' HB1' ' HD2' ' A' ' 68' ' ' PRO . . . -86.27 170.5 12.48 Favored Pre-proline 0 N--CA 1.489 1.501 0 O-C-N 121.527 -0.733 . . . . 0.0 109.381 -179.719 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 68' ' ' PRO . . . . . 0.542 ' HD2' ' HB1' ' A' ' 67' ' ' ALA . 37.1 Cg_exo -54.73 132.38 51.35 Favored 'Trans proline' 0 N--CA 1.494 1.534 0 C-N-CA 122.171 1.914 . . . . 0.0 112.209 179.776 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 69' ' ' VAL . . . . . 0.446 HG21 HD12 ' A' ' 76' ' ' LEU . 55.0 t -130.51 133.29 63.89 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.792 0 CA-C-O 121.479 0.657 . . . . 0.0 109.599 179.664 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -74.07 156.0 37.9 Favored 'General case' 0 N--CA 1.487 1.425 0 CA-C-O 121.635 0.731 . . . . 0.0 110.529 -179.711 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 92.2 m-20 -62.47 -39.78 94.53 Favored 'General case' 0 N--CA 1.492 1.628 0 O-C-N 121.545 -0.722 . . . . 0.0 109.92 -179.94 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 72' ' ' ASN . . . . . . . . . . . . . 90.9 m-20 -95.38 16.14 17.62 Favored 'General case' 0 N--CA 1.495 1.79 0 O-C-N 121.345 -0.847 . . . . 0.0 109.404 -179.396 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -59.06 143.47 48.4 Favored 'General case' 0 N--CA 1.491 1.624 0 O-C-N 121.364 -0.835 . . . . 0.0 110.311 -179.321 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 74' ' ' THR . . . . . . . . . . . . . 61.2 p -105.44 -1.0 25.5 Favored 'General case' 0 N--CA 1.494 1.735 0 N-CA-C 108.876 -0.787 . . . . 0.0 108.876 179.708 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 95.9 mt-10 -138.99 158.34 44.38 Favored 'General case' 0 N--CA 1.493 1.703 0 O-C-N 121.475 -0.766 . . . . 0.0 109.596 -179.734 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 76' ' ' LEU . . . . . 0.483 ' CD2' HD13 ' A' ' 48' ' ' LEU . 6.2 tp -124.78 133.49 53.12 Favored 'General case' 0 N--CA 1.492 1.632 0 O-C-N 121.641 -0.662 . . . . 0.0 109.419 -179.912 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 77' ' ' HIS . . . . . . . . . . . . . 80.8 m80 -112.13 121.12 44.07 Favored 'General case' 0 N--CA 1.491 1.623 0 N-CA-C 109.085 -0.709 . . . . 0.0 109.085 179.556 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -147.1 160.69 42.11 Favored 'General case' 0 N--CA 1.489 1.522 0 O-C-N 121.239 -0.913 . . . . 0.0 109.12 -179.977 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 95.6 mtt180 -126.63 141.97 51.69 Favored 'General case' 0 N--CA 1.494 1.767 0 CA-C-O 121.593 0.711 . . . . 0.0 109.966 -179.715 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 80' ' ' PHE . . . . . . . . . . . . . 42.9 m-85 -128.66 148.53 50.82 Favored 'General case' 0 N--CA 1.493 1.676 0 N-CA-C 109.041 -0.725 . . . . 0.0 109.041 179.819 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 88.3 tttt -104.54 117.07 33.25 Favored 'General case' 0 N--CA 1.492 1.66 0 O-C-N 121.591 -0.693 . . . . 0.0 109.443 -179.757 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 82' ' ' PHE . . . . . . . . . . . . . 65.0 m-85 -112.68 141.78 46.06 Favored 'General case' 0 N--CA 1.494 1.748 0 CA-C-O 121.55 0.691 . . . . 0.0 109.854 -179.889 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 1.4 tm-20 -66.42 -34.19 77.39 Favored 'General case' 0 N--CA 1.488 1.444 0 N-CA-C 109.042 -0.725 . . . . 0.0 109.042 179.484 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 84' ' ' VAL . . . . . 0.448 HG23 ' H ' ' A' ' 87' ' ' GLU . 31.5 m -135.07 161.3 40.21 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.734 0 CA-C-O 121.607 0.717 . . . . 0.0 109.724 -179.784 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 25.0 m -75.67 -20.55 58.35 Favored 'General case' 0 N--CA 1.491 1.576 0 O-C-N 121.586 -0.696 . . . . 0.0 109.61 -179.903 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 86' ' ' ALA . . . . . . . . . . . . . . . -62.09 -39.38 92.25 Favored 'General case' 0 N--CA 1.494 1.726 0 O-C-N 121.333 -0.854 . . . . 0.0 109.633 -179.468 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 87' ' ' GLU . . . . . 0.448 ' H ' HG23 ' A' ' 84' ' ' VAL . 72.8 mm-40 -67.96 -32.28 72.6 Favored 'General case' 0 C--N 1.299 -1.594 0 O-C-N 121.604 -0.685 . . . . 0.0 109.163 -179.814 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 88' ' ' LYS . . . . . . . . . . . . . 4.6 tmtt? -64.36 -49.83 70.09 Favored 'General case' 0 N--CA 1.49 1.539 0 O-C-N 121.288 -0.882 . . . . 0.0 109.069 -179.712 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 17.9 mt -63.64 -44.84 92.68 Favored 'General case' 0 N--CA 1.489 1.519 0 O-C-N 121.276 -0.89 . . . . 0.0 109.662 -179.68 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 90' ' ' ILE . . . . . . . . . . . . . 97.3 mt -66.41 -43.89 90.93 Favored 'Isoleucine or valine' 0 C--N 1.301 -1.521 0 O-C-N 121.579 -0.701 . . . . 0.0 109.425 -179.745 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 91' ' ' PHE . . . . . 0.41 ' O ' HG23 ' A' ' 95' ' ' THR . 81.9 t80 -61.55 -44.93 96.14 Favored 'General case' 0 N--CA 1.49 1.572 0 O-C-N 121.574 -0.704 . . . . 0.0 109.441 -179.588 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 92' ' ' GLU . . . . . . . . . . . . . 80.5 tt0 -62.13 -46.1 90.5 Favored 'General case' 0 N--CA 1.49 1.573 0 O-C-N 121.524 -0.735 . . . . 0.0 109.583 -179.627 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 93' ' ' LEU . . . . . . . . . . . . . 85.3 mt -63.67 -43.44 96.7 Favored 'General case' 0 N--CA 1.491 1.613 0 O-C-N 121.341 -0.849 . . . . 0.0 109.831 -179.537 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 94' ' ' LYS . . . . . . . . . . . . . 55.7 mtpt -65.05 -40.96 95.49 Favored 'General case' 0 C--N 1.302 -1.457 0 O-C-N 121.328 -0.857 . . . . 0.0 109.691 179.863 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 95' ' ' THR . . . . . 0.41 HG23 ' O ' ' A' ' 91' ' ' PHE . 20.6 p -65.27 -35.79 82.1 Favored 'General case' 0 N--CA 1.488 1.471 0 O-C-N 121.385 -0.822 . . . . 0.0 109.493 -179.743 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 96' ' ' ARG . . . . . . . . . . . . . 24.4 mmt180 -63.46 -42.37 98.61 Favored 'General case' 0 C--N 1.3 -1.562 0 O-C-N 121.436 -0.79 . . . . 0.0 109.4 179.638 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 97' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.3 -1.568 0 O-C-N 121.472 -0.767 . . . . 0.0 108.942 179.539 . . . . . . . . 0 0 . 1 . 018 nuclear nobuild core ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 26.2 t0 . . . . . 0 N--CA 1.495 1.792 0 CA-C-O 121.713 0.768 . . . . 0.0 110.716 . . . . . . . . . 0 0 . 1 . 018 nuclear nobuild core ' A' A ' 31' ' ' VAL . . . . . 0.441 HG12 ' N ' ' A' ' 32' ' ' ALA . 20.4 t -125.69 160.98 31.42 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.768 0 O-C-N 121.601 -0.687 . . . . 0.0 109.728 -179.97 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 32' ' ' ALA . . . . . 0.608 ' CB ' ' HZ2' ' A' ' 88' ' ' LYS . . . -128.64 148.61 50.82 Favored 'General case' 0 N--CA 1.495 1.822 0 O-C-N 121.567 -0.708 . . . . 0.0 110.088 -179.555 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 81.1 tt0 -104.24 135.57 45.47 Favored 'General case' 0 N--CA 1.491 1.589 0 O-C-N 121.62 -0.675 . . . . 0.0 109.404 -179.894 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 34' ' ' VAL . . . . . . . . . . . . . 56.0 t -124.98 130.7 73.18 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.816 0 O-C-N 121.617 -0.677 . . . . 0.0 109.188 179.765 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 72.4 m -133.28 121.7 22.81 Favored 'General case' 0 N--CA 1.491 1.588 0 N-CA-C 109.006 -0.739 . . . . 0.0 109.006 179.527 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 50.3 tp -122.03 137.65 54.73 Favored 'General case' 0 N--CA 1.496 1.833 0 CA-C-O 121.416 0.627 . . . . 0.0 109.36 -179.986 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 37' ' ' PHE . . . . . . . . . . . . . 97.0 m-85 -102.92 148.02 26.19 Favored 'General case' 0 N--CA 1.492 1.65 0 O-C-N 121.51 -0.744 . . . . 0.0 109.443 -179.863 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . -170.05 -172.14 36.25 Favored Glycine 0 N--CA 1.49 2.251 0 N-CA-C 109.923 -1.271 . . . . 0.0 109.923 -179.78 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 39' ' ' SER . . . . . 0.505 ' OG ' ' N ' ' A' ' 40' ' ' ASP . 91.9 p -106.55 -82.71 0.54 Allowed 'General case' 0 N--CA 1.497 1.885 0 O-C-N 121.331 -1.1 . . . . 0.0 109.942 -179.774 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 40' ' ' ASP . . . . . 0.505 ' N ' ' OG ' ' A' ' 39' ' ' SER . 30.6 t70 -83.9 161.18 20.93 Favored 'General case' 0 N--CA 1.492 1.639 0 O-C-N 121.248 -0.907 . . . . 0.0 110.773 -179.018 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 65.7 tttm -64.72 -37.05 86.27 Favored 'General case' 0 N--CA 1.492 1.63 0 O-C-N 121.512 -0.742 . . . . 0.0 109.969 179.59 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -56.36 -40.52 74.65 Favored 'General case' 0 N--CA 1.492 1.646 0 O-C-N 121.284 -0.885 . . . . 0.0 110.016 -179.202 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 43' ' ' HIS . . . . . . . . . . . . . 68.2 m80 -66.63 -41.36 88.42 Favored 'General case' 0 N--CA 1.49 1.56 0 O-C-N 121.208 -0.932 . . . . 0.0 109.686 -179.921 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 89.0 mt -63.95 -41.56 97.56 Favored 'General case' 0 N--CA 1.494 1.774 0 O-C-N 121.308 -0.87 . . . . 0.0 109.556 179.944 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 80.6 mm-40 -61.47 -42.06 98.2 Favored 'General case' 0 C--N 1.302 -1.492 0 O-C-N 121.347 -0.845 . . . . 0.0 109.432 -179.696 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . -63.05 -50.76 60.68 Favored Glycine 0 N--CA 1.492 2.414 0 N-CA-C 109.691 -1.363 . . . . 0.0 109.691 -179.655 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 64.7 mttp -65.64 -35.98 82.36 Favored 'General case' 0 N--CA 1.492 1.665 0 O-C-N 121.348 -1.09 . . . . 0.0 109.415 179.545 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 48' ' ' LEU . . . . . 0.501 HD13 ' CD2' ' A' ' 76' ' ' LEU . 53.8 tp -59.6 -38.68 81.88 Favored 'General case' 0 N--CA 1.493 1.714 0 O-C-N 121.538 -0.726 . . . . 0.0 109.498 -179.259 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 49' ' ' ALA . . . . . . . . . . . . . . . -53.15 -32.59 48.44 Favored 'General case' 0 N--CA 1.49 1.556 0 O-C-N 121.177 -0.952 . . . . 0.0 109.789 -179.434 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 73.6 mm-40 -65.31 -40.11 93.33 Favored 'General case' 0 N--CA 1.492 1.645 0 O-C-N 121.203 -0.936 . . . . 0.0 109.423 -179.882 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 51' ' ' TYR . . . . . 0.494 ' CE2' ' CG2' ' A' ' 95' ' ' THR . 31.6 m-85 -62.92 -41.68 99.54 Favored 'General case' 0 N--CA 1.49 1.573 0 O-C-N 121.326 -0.859 . . . . 0.0 109.931 -179.758 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 52' ' ' ILE . . . . . 0.473 HD12 ' CZ ' ' A' ' 64' ' ' TYR . 34.6 mm -63.98 -44.95 98.01 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.641 0 O-C-N 121.14 -0.975 . . . . 0.0 109.482 -179.35 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 76.1 p -65.81 -44.61 85.11 Favored 'General case' 0 N--CA 1.491 1.611 0 O-C-N 121.166 -0.959 . . . . 0.0 110.153 -179.706 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 54' ' ' LEU . . . . . . . . . . . . . 85.2 mt -65.43 -42.23 92.68 Favored 'General case' 0 N--CA 1.493 1.703 0 O-C-N 121.24 -0.913 . . . . 0.0 109.943 -179.636 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -61.16 -49.76 75.92 Favored 'General case' 0 N--CA 1.492 1.648 0 O-C-N 121.408 -0.808 . . . . 0.0 110.702 -178.893 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 56' ' ' LYS . . . . . . . . . . . . . 98.5 mttt -65.11 -43.87 90.58 Favored 'General case' 0 N--CA 1.492 1.627 0 O-C-N 121.188 -0.945 . . . . 0.0 110.056 -179.361 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 59.2 tt0 -65.94 -47.21 75.43 Favored 'General case' 0 N--CA 1.491 1.597 0 O-C-N 121.334 -0.854 . . . . 0.0 109.328 -179.9 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 58' ' ' VAL . . . . . . . . . . . . . 54.6 t -64.97 -45.42 94.73 Favored 'Isoleucine or valine' 0 C--N 1.302 -1.492 0 O-C-N 121.45 -0.781 . . . . 0.0 109.94 -179.926 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 59' ' ' TYR . . . . . . . . . . . . . 54.9 t80 -131.91 124.04 28.66 Favored 'General case' 0 N--CA 1.498 1.964 0 O-C-N 121.365 -0.834 . . . . 0.0 110.042 -179.204 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 60' ' ' ALA . . . . . 0.42 ' O ' ' OD1' ' A' ' 61' ' ' ASN . . . -66.43 148.38 51.96 Favored 'General case' 0 N--CA 1.491 1.59 0 O-C-N 121.688 -0.633 . . . . 0.0 110.902 -179.601 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 61' ' ' ASN . . . . . 0.42 ' OD1' ' O ' ' A' ' 60' ' ' ALA . 7.6 p-10 44.61 52.65 7.59 Favored 'General case' 0 N--CA 1.496 1.829 0 CA-C-O 121.717 0.77 . . . . 0.0 109.425 179.722 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 62' ' ' VAL . . . . . . . . . . . . . 15.0 p -79.09 140.22 17.18 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.499 0 O-C-N 121.635 -0.666 . . . . 0.0 109.911 -179.776 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 96.7 mt-10 -110.1 132.47 54.13 Favored 'General case' 0 N--CA 1.494 1.756 0 CA-C-O 121.58 0.705 . . . . 0.0 109.563 -179.57 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 64' ' ' TYR . . . . . 0.473 ' CZ ' HD12 ' A' ' 52' ' ' ILE . 53.0 p90 -147.99 164.53 33.49 Favored 'General case' 0 N--CA 1.489 1.476 0 O-C-N 121.378 -0.826 . . . . 0.0 109.52 -179.847 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 95.7 mt-10 -139.31 151.95 46.83 Favored 'General case' 0 N--CA 1.492 1.626 0 O-C-N 121.451 -0.781 . . . . 0.0 109.273 179.893 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 66' ' ' VAL . . . . . . . . . . . . . 3.1 p -123.91 130.55 73.84 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.768 0 CA-C-O 121.537 0.684 . . . . 0.0 109.657 -179.493 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 67' ' ' ALA . . . . . 0.609 ' HB1' ' HD2' ' A' ' 68' ' ' PRO . . . -76.7 172.35 9.87 Favored Pre-proline 0 C--N 1.303 -1.448 0 O-C-N 121.683 -0.636 . . . . 0.0 109.68 -179.85 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 68' ' ' PRO . . . . . 0.609 ' HD2' ' HB1' ' A' ' 67' ' ' ALA . 52.5 Cg_exo -54.8 139.07 77.85 Favored 'Trans proline' 0 N--CA 1.498 1.781 0 C-N-CA 122.57 2.18 . . . . 0.0 112.427 179.934 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 69' ' ' VAL . . . . . . . . . . . . . 60.1 t -128.96 132.32 67.46 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.924 0 O-C-N 121.593 -0.692 . . . . 0.0 109.572 179.702 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -87.02 163.49 17.02 Favored 'General case' 0 N--CA 1.489 1.503 0 O-C-N 121.413 -0.804 . . . . 0.0 109.881 -179.968 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 75.4 m-20 -63.25 -40.86 98.6 Favored 'General case' 0 N--CA 1.491 1.59 0 O-C-N 121.385 -0.822 . . . . 0.0 109.543 -179.917 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 72' ' ' ASN . . . . . . . . . . . . . 98.8 m-20 -99.31 19.35 15.62 Favored 'General case' 0 N--CA 1.493 1.71 0 O-C-N 121.423 -0.798 . . . . 0.0 109.372 -179.289 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -54.18 139.35 35.89 Favored 'General case' 0 N--CA 1.491 1.614 0 O-C-N 121.252 -0.905 . . . . 0.0 110.05 -179.279 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 74' ' ' THR . . . . . . . . . . . . . 81.6 p -107.78 -0.98 21.33 Favored 'General case' 0 N--CA 1.494 1.735 0 N-CA-C 108.879 -0.786 . . . . 0.0 108.879 179.6 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 17.3 pt-20 -141.99 160.04 41.02 Favored 'General case' 0 N--CA 1.495 1.813 0 O-C-N 121.208 -0.933 . . . . 0.0 109.34 179.327 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 76' ' ' LEU . . . . . 0.501 ' CD2' HD13 ' A' ' 48' ' ' LEU . 6.6 tp -130.02 130.43 44.96 Favored 'General case' 0 N--CA 1.492 1.657 0 N-CA-C 109.054 -0.721 . . . . 0.0 109.054 179.617 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 77' ' ' HIS . . . . . . . . . . . . . 59.0 t-80 -114.53 113.71 24.79 Favored 'General case' 0 N--CA 1.493 1.676 0 N-CA-C 109.043 -0.725 . . . . 0.0 109.043 179.912 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -135.95 159.37 41.88 Favored 'General case' 0 N--CA 1.493 1.698 0 O-C-N 121.427 -0.796 . . . . 0.0 109.328 -179.778 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 15.9 tpp180 -127.86 141.2 51.62 Favored 'General case' 0 N--CA 1.492 1.641 0 N-CA-C 109.243 -0.651 . . . . 0.0 109.243 -179.764 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 80' ' ' PHE . . . . . . . . . . . . . 52.8 m-85 -126.08 146.62 49.85 Favored 'General case' 0 N--CA 1.494 1.728 0 CA-C-O 121.448 0.642 . . . . 0.0 109.414 -179.883 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 3.3 ttmp? -109.35 127.58 54.44 Favored 'General case' 0 N--CA 1.49 1.53 0 O-C-N 121.753 -0.592 . . . . 0.0 109.551 -179.772 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 82' ' ' PHE . . . . . . . . . . . . . 70.5 m-85 -125.02 147.03 49.15 Favored 'General case' 0 N--CA 1.491 1.616 0 CA-C-O 121.531 0.681 . . . . 0.0 109.607 -179.75 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 83.9 tt0 -67.45 -37.14 82.51 Favored 'General case' 0 C--N 1.302 -1.498 0 O-C-N 121.525 -0.734 . . . . 0.0 109.738 -179.909 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 84' ' ' VAL . . . . . . . . . . . . . 30.1 m -137.02 162.5 34.12 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.876 0 O-C-N 121.258 -0.901 . . . . 0.0 110.467 -179.306 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 74.9 p -69.97 -16.05 63.13 Favored 'General case' 0 N--CA 1.49 1.555 0 O-C-N 121.783 -0.573 . . . . 0.0 110.036 179.747 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 86' ' ' ALA . . . . . . . . . . . . . . . -62.78 -40.85 98.57 Favored 'General case' 0 N--CA 1.495 1.825 0 O-C-N 121.108 -0.995 . . . . 0.0 109.735 -179.623 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 87' ' ' GLU . . . . . 0.53 ' N ' ' OE1' ' A' ' 87' ' ' GLU . 4.9 mp0 -70.2 -30.48 67.6 Favored 'General case' 0 N--CA 1.491 1.624 0 O-C-N 121.411 -0.806 . . . . 0.0 108.848 179.883 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 88' ' ' LYS . . . . . 0.608 ' HZ2' ' CB ' ' A' ' 32' ' ' ALA . 64.6 tttp -62.62 -47.49 83.53 Favored 'General case' 0 C--N 1.3 -1.567 0 O-C-N 121.221 -0.924 . . . . 0.0 109.314 -179.956 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 48.3 tp -64.71 -47.45 78.25 Favored 'General case' 0 N--CA 1.49 1.55 0 O-C-N 121.312 -0.867 . . . . 0.0 109.857 -179.38 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 90' ' ' ILE . . . . . . . . . . . . . 97.0 mt -66.58 -45.07 89.54 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.734 0 O-C-N 121.236 -0.915 . . . . 0.0 109.674 -179.533 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 91' ' ' PHE . . . . . . . . . . . . . 91.2 t80 -64.45 -45.35 87.83 Favored 'General case' 0 N--CA 1.491 1.588 0 O-C-N 121.581 -0.7 . . . . 0.0 110.021 -179.587 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 92' ' ' GLU . . . . . . . . . . . . . 47.1 tp10 -66.25 -37.37 85.34 Favored 'General case' 0 N--CA 1.49 1.544 0 O-C-N 121.334 -0.854 . . . . 0.0 109.63 -179.225 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 93' ' ' LEU . . . . . . . . . . . . . 6.2 tt -62.73 -44.26 96.66 Favored 'General case' 0 C--N 1.3 -1.561 0 O-C-N 121.219 -0.925 . . . . 0.0 109.819 -179.582 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 94' ' ' LYS . . . . . . . . . . . . . 68.0 mttm -65.29 -42.88 92.67 Favored 'General case' 0 N--CA 1.491 1.588 0 O-C-N 121.334 -0.853 . . . . 0.0 110.238 -179.633 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 95' ' ' THR . . . . . 0.494 ' CG2' ' CE2' ' A' ' 51' ' ' TYR . 19.7 p -65.2 -44.23 89.03 Favored 'General case' 0 N--CA 1.492 1.657 0 O-C-N 121.39 -0.819 . . . . 0.0 110.367 -179.048 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 96' ' ' ARG . . . . . . . . . . . . . 83.3 mtp180 -64.4 -39.53 94.03 Favored 'General case' 0 N--CA 1.491 1.597 0 O-C-N 121.176 -0.953 . . . . 0.0 109.659 -179.796 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 97' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 1.545 0 O-C-N 121.291 -0.88 . . . . 0.0 109.911 -179.687 . . . . . . . . 0 0 . 1 . 019 nuclear nobuild core ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 88.4 m-20 . . . . . 0 N--CA 1.497 1.9 0 N-CA-C 109.03 -0.73 . . . . 0.0 109.03 . . . . . . . . . 0 0 . 1 . 019 nuclear nobuild core ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 52.0 t -124.61 134.77 65.9 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.934 0 O-C-N 121.482 -0.761 . . . . 0.0 109.324 -179.946 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -110.14 154.93 22.62 Favored 'General case' 0 N--CA 1.495 1.805 0 CA-C-O 121.695 0.76 . . . . 0.0 109.515 -179.946 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 95.8 mt-10 -87.68 126.48 34.99 Favored 'General case' 0 N--CA 1.489 1.518 0 CA-C-O 121.585 0.707 . . . . 0.0 109.653 -179.621 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 34' ' ' VAL . . . . . . . . . . . . . 53.7 t -124.99 134.99 65.52 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.712 0 CA-C-O 121.748 0.785 . . . . 0.0 109.198 -179.626 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 6.0 p -134.81 140.49 45.91 Favored 'General case' 0 N--CA 1.491 1.58 0 N-CA-C 108.89 -0.781 . . . . 0.0 108.89 179.878 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 36' ' ' LEU . . . . . 0.64 HD13 ' N ' ' A' ' 37' ' ' PHE . 0.2 OUTLIER -121.0 124.04 43.89 Favored 'General case' 0 N--CA 1.494 1.761 0 CA-C-O 121.709 0.766 . . . . 0.0 109.131 -179.662 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 37' ' ' PHE . . . . . 0.64 ' N ' HD13 ' A' ' 36' ' ' LEU . 92.5 m-85 -99.79 146.02 27.05 Favored 'General case' 0 N--CA 1.492 1.656 0 O-C-N 121.506 -0.746 . . . . 0.0 109.777 179.872 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . -178.84 -169.31 39.3 Favored Glycine 0 N--CA 1.489 2.171 0 N-CA-C 109.837 -1.305 . . . . 0.0 109.837 -179.975 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 39' ' ' SER . . . . . 0.494 ' OG ' ' N ' ' A' ' 40' ' ' ASP . 3.0 t -82.23 -99.37 0.04 OUTLIER 'General case' 0 N--CA 1.491 1.606 0 O-C-N 121.634 -0.921 . . . . 0.0 109.91 -179.939 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 40' ' ' ASP . . . . . 0.494 ' N ' ' OG ' ' A' ' 39' ' ' SER . 97.4 m-20 -83.6 178.03 8.15 Favored 'General case' 0 N--CA 1.495 1.811 0 O-C-N 121.165 -0.959 . . . . 0.0 110.696 -179.464 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 87.9 tttt -63.62 -33.14 74.95 Favored 'General case' 0 N--CA 1.493 1.676 0 CA-C-O 121.404 0.621 . . . . 0.0 110.092 -179.795 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -60.53 -38.59 84.94 Favored 'General case' 0 N--CA 1.492 1.663 0 O-C-N 121.161 -0.962 . . . . 0.0 109.725 -179.533 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 43' ' ' HIS . . . . . . . . . . . . . 83.6 m-70 -68.43 -37.38 80.23 Favored 'General case' 0 N--CA 1.492 1.671 0 O-C-N 121.313 -0.867 . . . . 0.0 109.931 179.868 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 97.0 mt -63.61 -42.23 98.23 Favored 'General case' 0 N--CA 1.493 1.724 0 O-C-N 121.514 -0.741 . . . . 0.0 110.27 -178.953 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 98.0 mt-10 -69.69 -38.53 77.03 Favored 'General case' 0 C--N 1.299 -1.607 0 O-C-N 121.205 -0.934 . . . . 0.0 109.637 -179.852 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 46' ' ' GLY . . . . . 0.441 ' O ' ' OE1' ' A' ' 50' ' ' GLU . . . -62.78 -40.85 99.73 Favored Glycine 0 N--CA 1.493 2.435 0 N-CA-C 110.178 -1.169 . . . . 0.0 110.178 -179.644 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 56.7 mtpt -81.29 -21.75 39.1 Favored 'General case' 0 N--CA 1.489 1.485 0 O-C-N 121.365 -1.08 . . . . 0.0 109.316 179.905 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 57.6 tp -65.89 -38.15 88.0 Favored 'General case' 0 N--CA 1.492 1.668 0 O-C-N 121.542 -0.724 . . . . 0.0 109.787 179.838 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 49' ' ' ALA . . . . . . . . . . . . . . . -56.96 -34.74 68.35 Favored 'General case' 0 N--CA 1.493 1.725 0 O-C-N 121.359 -0.838 . . . . 0.0 109.861 -179.179 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 50' ' ' GLU . . . . . 0.564 ' OE1' ' N ' ' A' ' 50' ' ' GLU . 51.8 mp0 -67.28 -40.78 86.19 Favored 'General case' 0 C--N 1.299 -1.609 0 O-C-N 121.348 -0.845 . . . . 0.0 109.549 -179.909 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 51' ' ' TYR . . . . . 0.416 ' CZ ' ' CD2' ' A' ' 36' ' ' LEU . 3.9 m-85 -60.24 -42.83 96.12 Favored 'General case' 0 N--CA 1.492 1.665 0 O-C-N 121.407 -0.808 . . . . 0.0 109.821 -179.642 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 52' ' ' ILE . . . . . . . . . . . . . 95.7 mt -64.13 -42.67 96.3 Favored 'Isoleucine or valine' 0 C--N 1.298 -1.653 0 O-C-N 121.361 -0.837 . . . . 0.0 109.613 -179.676 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 48.4 m -52.92 -51.74 60.23 Favored 'General case' 0 N--CA 1.493 1.695 0 O-C-N 121.364 -0.835 . . . . 0.0 110.012 -178.951 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 54' ' ' LEU . . . . . 0.48 HD12 ' HD3' ' A' ' 94' ' ' LYS . 4.2 mm? -65.31 -40.74 94.14 Favored 'General case' 0 N--CA 1.493 1.713 0 O-C-N 121.255 -0.903 . . . . 0.0 110.076 179.807 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -64.73 -38.37 90.77 Favored 'General case' 0 C--N 1.3 -1.563 0 O-C-N 121.373 -0.83 . . . . 0.0 110.08 -179.336 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 56' ' ' LYS . . . . . . . . . . . . . 45.4 tttp -63.77 -42.74 97.72 Favored 'General case' 0 N--CA 1.489 1.521 0 O-C-N 121.283 -0.886 . . . . 0.0 109.68 -179.683 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 77.0 mt-30 -65.75 -43.71 88.13 Favored 'General case' 0 N--CA 1.494 1.745 0 O-C-N 121.37 -0.831 . . . . 0.0 109.687 -179.765 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 58' ' ' VAL . . . . . . . . . . . . . 79.7 t -65.33 -44.74 94.7 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.675 0 O-C-N 121.383 -0.823 . . . . 0.0 109.518 -179.948 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 59' ' ' TYR . . . . . 0.425 ' O ' ' O ' ' A' ' 60' ' ' ALA . 62.6 t80 -126.66 133.14 51.04 Favored 'General case' 0 N--CA 1.497 1.902 0 CA-C-O 121.866 0.841 . . . . 0.0 109.406 -179.793 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 60' ' ' ALA . . . . . 0.425 ' O ' ' O ' ' A' ' 59' ' ' TYR . . . -44.43 -100.01 0.0 OUTLIER 'General case' 0 N--CA 1.493 1.679 0 CA-C-O 121.645 0.736 . . . . 0.0 111.129 -179.229 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 61' ' ' ASN . . . . . . . . . . . . . 10.4 m120 -87.11 90.29 8.3 Favored 'General case' 0 N--CA 1.491 1.59 0 O-C-N 121.334 -0.854 . . . . 0.0 109.351 -179.051 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 62' ' ' VAL . . . . . . . . . . . . . 11.0 p -80.15 136.68 22.93 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.552 0 O-C-N 121.571 -0.706 . . . . 0.0 109.768 -179.978 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 84.8 tt0 -113.64 138.39 50.26 Favored 'General case' 0 N--CA 1.495 1.784 0 CA-C-O 121.623 0.725 . . . . 0.0 109.178 -179.854 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 64' ' ' TYR . . . . . . . . . . . . . 50.7 p90 -148.36 162.64 39.14 Favored 'General case' 0 N--CA 1.491 1.614 0 O-C-N 121.413 -0.804 . . . . 0.0 109.962 -179.499 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 49.3 tp10 -139.69 145.73 38.75 Favored 'General case' 0 N--CA 1.493 1.686 0 N-CA-C 108.789 -0.819 . . . . 0.0 108.789 179.623 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 66' ' ' VAL . . . . . . . . . . . . . 27.2 m -115.52 128.03 72.88 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.764 0 CA-C-O 121.768 0.795 . . . . 0.0 110.018 -179.26 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 67' ' ' ALA . . . . . 0.652 ' HB1' ' HD2' ' A' ' 68' ' ' PRO . . . -80.15 171.82 11.41 Favored Pre-proline 0 N--CA 1.488 1.446 0 N-CA-C 109.569 -0.53 . . . . 0.0 109.569 -179.85 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 68' ' ' PRO . . . . . 0.652 ' HD2' ' HB1' ' A' ' 67' ' ' ALA . 51.0 Cg_exo -51.68 129.5 30.11 Favored 'Trans proline' 0 N--CA 1.494 1.54 0 C-N-CA 122.428 2.085 . . . . 0.0 112.309 179.624 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 69' ' ' VAL . . . . . 0.406 HG21 HD12 ' A' ' 76' ' ' LEU . 51.0 t -131.51 134.1 61.05 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.794 0 CA-C-O 121.803 0.811 . . . . 0.0 109.899 179.911 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -73.01 153.07 41.05 Favored 'General case' 0 N--CA 1.49 1.541 0 CA-C-O 121.735 0.779 . . . . 0.0 110.335 -179.992 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 64.6 t0 -63.6 -36.1 82.7 Favored 'General case' 0 N--CA 1.49 1.563 0 CA-C-O 121.591 0.71 . . . . 0.0 109.322 179.308 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 72' ' ' ASN . . . . . . . . . . . . . 56.5 p30 -95.43 19.1 11.39 Favored 'General case' 0 N--CA 1.493 1.709 0 O-C-N 121.266 -0.897 . . . . 0.0 108.722 179.849 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -64.26 143.86 57.57 Favored 'General case' 0 N--CA 1.49 1.538 0 O-C-N 121.435 -0.791 . . . . 0.0 110.358 -179.715 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 74' ' ' THR . . . . . . . . . . . . . 6.3 p -106.18 -0.62 24.45 Favored 'General case' 0 N--CA 1.492 1.673 0 N-CA-C 108.589 -0.893 . . . . 0.0 108.589 179.268 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 80.9 tt0 -141.74 154.42 45.26 Favored 'General case' 0 N--CA 1.494 1.746 0 O-C-N 121.222 -0.924 . . . . 0.0 109.379 179.884 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 76' ' ' LEU . . . . . 0.406 HD12 HG21 ' A' ' 69' ' ' VAL . 6.7 tp -117.03 131.89 56.83 Favored 'General case' 0 N--CA 1.493 1.699 0 O-C-N 121.569 -0.707 . . . . 0.0 109.512 -179.814 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 77' ' ' HIS . . . . . . . . . . . . . 7.4 t-160 -105.66 108.33 19.79 Favored 'General case' 0 N--CA 1.493 1.703 0 N-CA-C 109.062 -0.718 . . . . 0.0 109.062 179.846 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -147.01 159.35 43.68 Favored 'General case' 0 N--CA 1.492 1.653 0 O-C-N 121.353 -0.842 . . . . 0.0 109.596 -179.413 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 89.7 mtm-85 -131.8 148.95 52.59 Favored 'General case' 0 N--CA 1.496 1.846 0 O-C-N 121.639 -0.663 . . . . 0.0 109.356 -179.917 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 80' ' ' PHE . . . . . . . . . . . . . 28.3 m-85 -121.61 147.43 45.86 Favored 'General case' 0 N--CA 1.5 2.049 0 CA-C-O 121.669 0.747 . . . . 0.0 109.599 -179.802 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 64.2 tttp -109.26 114.02 27.35 Favored 'General case' 0 N--CA 1.491 1.618 0 CA-C-O 121.732 0.777 . . . . 0.0 109.37 179.903 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 82' ' ' PHE . . . . . . . . . . . . . 82.7 m-85 -100.98 -109.25 0.22 Allowed 'General case' 0 N--CA 1.494 1.725 0 CA-C-O 121.635 0.731 . . . . 0.0 109.561 -179.973 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 47.3 tp10 -168.78 -37.96 0.02 OUTLIER 'General case' 0 N--CA 1.489 1.493 0 N-CA-C 108.539 -0.912 . . . . 0.0 108.539 179.926 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 84' ' ' VAL . . . . . 0.426 HG23 ' H ' ' A' ' 87' ' ' GLU . 27.3 m -133.77 161.94 40.24 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.909 0 O-C-N 121.471 -0.768 . . . . 0.0 109.63 -179.998 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 15.5 m -72.9 -19.63 61.24 Favored 'General case' 0 N--CA 1.491 1.597 0 O-C-N 121.464 -0.773 . . . . 0.0 109.274 179.825 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 86' ' ' ALA . . . . . . . . . . . . . . . -63.43 -39.52 94.7 Favored 'General case' 0 N--CA 1.492 1.634 0 O-C-N 121.215 -0.928 . . . . 0.0 109.714 -179.98 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 87' ' ' GLU . . . . . 0.426 ' H ' HG23 ' A' ' 84' ' ' VAL . 97.0 mt-10 -71.01 -32.26 69.01 Favored 'General case' 0 N--CA 1.493 1.691 0 O-C-N 121.334 -0.854 . . . . 0.0 109.37 179.731 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 88' ' ' LYS . . . . . . . . . . . . . 14.4 tmtt? -62.18 -48.01 81.97 Favored 'General case' 0 C--N 1.302 -1.49 0 O-C-N 121.33 -0.856 . . . . 0.0 110.013 -179.803 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 94.0 mt -64.97 -42.94 94.12 Favored 'General case' 0 N--CA 1.492 1.659 0 O-C-N 121.338 -0.851 . . . . 0.0 109.372 -179.68 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 90' ' ' ILE . . . . . . . . . . . . . 95.1 mt -65.36 -45.45 93.19 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.645 0 CA-C-O 121.737 0.779 . . . . 0.0 109.512 -179.91 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 91' ' ' PHE . . . . . . . . . . . . . 80.9 t80 -66.0 -44.07 85.9 Favored 'General case' 0 N--CA 1.49 1.568 0 CA-C-O 121.724 0.773 . . . . 0.0 109.845 -179.909 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 92' ' ' GLU . . . . . . . . . . . . . 48.4 tp10 -59.97 -38.7 83.28 Favored 'General case' 0 N--CA 1.491 1.61 0 O-C-N 121.445 -0.785 . . . . 0.0 109.469 -179.163 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 93' ' ' LEU . . . . . . . . . . . . . 5.5 tt -63.53 -44.35 94.48 Favored 'General case' 0 C--N 1.297 -1.679 0 O-C-N 121.38 -0.825 . . . . 0.0 109.865 179.974 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 94' ' ' LYS . . . . . 0.48 ' HD3' HD12 ' A' ' 54' ' ' LEU . 62.5 mttp -65.7 -41.64 92.13 Favored 'General case' 0 N--CA 1.492 1.674 0 O-C-N 121.433 -0.792 . . . . 0.0 109.77 -179.878 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 23.4 p -66.59 -38.6 87.38 Favored 'General case' 0 N--CA 1.493 1.688 0 O-C-N 121.315 -0.866 . . . . 0.0 109.653 -179.782 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 96' ' ' ARG . . . . . . . . . . . . . 25.1 mmt180 -65.14 -40.97 95.13 Favored 'General case' 0 N--CA 1.492 1.663 0 O-C-N 121.227 -0.921 . . . . 0.0 109.935 179.739 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 97' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.3 -1.578 0 O-C-N 121.323 -0.861 . . . . 0.0 109.839 -179.688 . . . . . . . . 0 0 . 1 . 020 nuclear nobuild core ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 51.1 p30 . . . . . 0 N--CA 1.488 1.466 0 N-CA-C 109.18 -0.674 . . . . 0.0 109.18 . . . . . . . . . 0 0 . 1 . 020 nuclear nobuild core ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 52.6 t -122.7 135.83 61.48 Favored 'Isoleucine or valine' 0 N--CA 1.502 2.142 0 O-C-N 121.403 -0.811 . . . . 0.0 109.775 -179.609 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -113.83 151.73 31.67 Favored 'General case' 0 N--CA 1.496 1.856 0 CA-C-O 121.42 0.629 . . . . 0.0 109.601 -179.967 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 40.3 tt0 -109.04 145.62 35.29 Favored 'General case' 0 N--CA 1.496 1.867 0 CA-C-O 121.499 0.666 . . . . 0.0 110.266 -179.312 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 34' ' ' VAL . . . . . . . . . . . . . 55.5 t -124.46 131.95 72.03 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.887 0 CA-C-O 121.487 0.661 . . . . 0.0 109.435 179.96 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 56.8 m -108.33 121.83 45.72 Favored 'General case' 0 N--CA 1.496 1.836 0 N-CA-C 109.264 -0.643 . . . . 0.0 109.264 179.542 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 36' ' ' LEU . . . . . 0.445 HD13 ' CZ ' ' A' ' 51' ' ' TYR . 49.5 tp -121.98 135.77 54.88 Favored 'General case' 0 N--CA 1.495 1.793 0 CA-C-O 121.595 0.712 . . . . 0.0 109.656 179.856 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 37' ' ' PHE . . . . . . . . . . . . . 86.1 t80 -113.17 138.12 50.43 Favored 'General case' 0 N--CA 1.494 1.73 0 CA-C-O 121.578 0.704 . . . . 0.0 109.69 -179.851 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 38' ' ' GLY . . . . . 0.45 ' N ' HD21 ' A' ' 44' ' ' LEU . . . -169.11 -170.51 33.79 Favored Glycine 0 N--CA 1.489 2.189 0 N-CA-C 110.15 -1.18 . . . . 0.0 110.15 -179.849 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 32.8 p -82.36 -108.9 0.03 OUTLIER 'General case' 0 N--CA 1.491 1.585 0 O-C-N 121.677 -0.896 . . . . 0.0 110.104 -179.69 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 40' ' ' ASP . . . . . . . . . . . . . 99.4 m-20 -81.05 175.13 10.94 Favored 'General case' 0 N--CA 1.493 1.72 0 O-C-N 121.192 -0.943 . . . . 0.0 110.698 -179.352 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 88.6 tttt -62.71 -41.98 99.42 Favored 'General case' 0 N--CA 1.491 1.624 0 CA-C-O 121.527 0.679 . . . . 0.0 109.966 -179.892 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -54.01 -46.29 71.73 Favored 'General case' 0 N--CA 1.492 1.662 0 O-C-N 121.394 -0.816 . . . . 0.0 109.796 -179.451 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 43' ' ' HIS . . . . . 0.669 ' CE1' ' HZ3' ' A' ' 47' ' ' LYS . 82.9 t60 -66.67 -42.65 86.24 Favored 'General case' 0 N--CA 1.493 1.682 0 O-C-N 121.283 -0.885 . . . . 0.0 109.72 179.829 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 44' ' ' LEU . . . . . 0.45 HD21 ' N ' ' A' ' 38' ' ' GLY . 37.0 mt -63.29 -41.26 98.97 Favored 'General case' 0 N--CA 1.496 1.851 0 O-C-N 121.333 -0.855 . . . . 0.0 109.877 -179.94 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 66.0 mm-40 -62.46 -38.23 88.97 Favored 'General case' 0 N--CA 1.49 1.565 0 O-C-N 121.439 -0.788 . . . . 0.0 109.623 -179.775 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . -59.3 -53.91 42.27 Favored Glycine 0 N--CA 1.494 2.504 0 N-CA-C 109.519 -1.432 . . . . 0.0 109.519 -179.884 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 47' ' ' LYS . . . . . 0.669 ' HZ3' ' CE1' ' A' ' 43' ' ' HIS . 47.6 mttp -66.47 -37.63 85.54 Favored 'General case' 0 N--CA 1.493 1.683 0 O-C-N 121.456 -1.026 . . . . 0.0 109.605 179.02 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 49.0 tp -51.84 -34.07 38.85 Favored 'General case' 0 N--CA 1.494 1.746 0 CA-C-O 121.657 0.742 . . . . 0.0 109.681 -179.373 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 49' ' ' ALA . . . . . . . . . . . . . . . -56.37 -34.46 66.67 Favored 'General case' 0 N--CA 1.491 1.612 0 O-C-N 121.354 -0.841 . . . . 0.0 109.635 -179.698 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 80.5 mm-40 -66.46 -43.16 86.26 Favored 'General case' 0 N--CA 1.495 1.79 0 O-C-N 121.259 -0.9 . . . . 0.0 109.974 -179.923 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 51' ' ' TYR . . . . . 0.445 ' CZ ' HD13 ' A' ' 36' ' ' LEU . 64.0 m-85 -64.1 -44.53 92.02 Favored 'General case' 0 N--CA 1.495 1.816 0 O-C-N 121.325 -0.859 . . . . 0.0 109.872 -179.727 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 52' ' ' ILE . . . . . . . . . . . . . 96.4 mt -65.18 -43.75 95.45 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.732 0 O-C-N 121.287 -0.883 . . . . 0.0 109.677 -179.987 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 60.9 m -61.86 -41.14 97.48 Favored 'General case' 0 N--CA 1.493 1.697 0 O-C-N 121.293 -0.879 . . . . 0.0 109.729 -179.844 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 54' ' ' LEU . . . . . . . . . . . . . 46.6 tp -63.79 -40.98 97.97 Favored 'General case' 0 N--CA 1.491 1.605 0 O-C-N 121.248 -0.907 . . . . 0.0 109.643 -179.988 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -60.12 -40.65 90.46 Favored 'General case' 0 N--CA 1.491 1.604 0 O-C-N 121.378 -0.826 . . . . 0.0 109.392 -179.355 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 56' ' ' LYS . . . . . . . . . . . . . 98.4 mttt -65.19 -41.52 94.48 Favored 'General case' 0 N--CA 1.491 1.582 0 O-C-N 121.456 -0.777 . . . . 0.0 109.551 179.587 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 67.5 tp60 -65.21 -46.33 81.12 Favored 'General case' 0 N--CA 1.493 1.709 0 O-C-N 121.32 -0.862 . . . . 0.0 109.919 -179.399 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 58' ' ' VAL . . . . . . . . . . . . . 88.0 t -65.23 -43.87 95.25 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.572 0 O-C-N 121.199 -0.938 . . . . 0.0 109.118 -179.979 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 59' ' ' TYR . . . . . . . . . . . . . 45.1 t80 -138.54 117.99 12.9 Favored 'General case' 0 N--CA 1.496 1.865 0 O-C-N 121.433 -0.792 . . . . 0.0 109.545 -179.806 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -69.39 149.11 48.73 Favored 'General case' 0 N--CA 1.492 1.64 0 CA-C-O 121.714 0.768 . . . . 0.0 110.625 -179.615 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 61' ' ' ASN . . . . . . . . . . . . . 8.8 t-20 60.09 39.35 19.76 Favored 'General case' 0 N--CA 1.491 1.613 0 CA-C-O 121.779 0.8 . . . . 0.0 109.472 179.806 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 62' ' ' VAL . . . . . . . . . . . . . 14.1 p -76.67 139.15 19.3 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.762 0 O-C-N 121.438 -0.789 . . . . 0.0 110.523 -179.967 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 96.0 mt-10 -106.05 136.09 46.34 Favored 'General case' 0 N--CA 1.497 1.891 0 CA-C-O 121.756 0.789 . . . . 0.0 109.594 179.944 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 64' ' ' TYR . . . . . . . . . . . . . 50.4 p90 -151.03 162.98 39.82 Favored 'General case' 0 N--CA 1.49 1.54 0 O-C-N 121.458 -0.776 . . . . 0.0 109.681 -179.478 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 79.8 mm-40 -139.5 152.45 46.97 Favored 'General case' 0 N--CA 1.495 1.78 0 O-C-N 121.408 -0.808 . . . . 0.0 109.643 179.853 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 66' ' ' VAL . . . . . . . . . . . . . 53.8 t -113.44 129.87 68.45 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.75 0 CA-C-O 121.718 0.771 . . . . 0.0 109.218 -179.679 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 67' ' ' ALA . . . . . 0.454 ' HB1' ' HD2' ' A' ' 68' ' ' PRO . . . -77.06 168.88 24.37 Favored Pre-proline 0 C--N 1.302 -1.486 0 O-C-N 121.727 -0.608 . . . . 0.0 109.766 -179.55 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 68' ' ' PRO . . . . . 0.454 ' HD2' ' HB1' ' A' ' 67' ' ' ALA . 27.8 Cg_exo -59.04 143.25 99.88 Favored 'Trans proline' 0 N--CA 1.493 1.483 0 C-N-CA 122.371 2.047 . . . . 0.0 112.354 179.557 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 69' ' ' VAL . . . . . 0.51 ' C ' ' H ' ' A' ' 71' ' ' ASP . 47.2 t -120.99 132.58 70.12 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.74 0 CA-C-O 121.676 0.751 . . . . 0.0 109.589 -179.856 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 70' ' ' ALA . . . . . 0.62 ' O ' ' N ' ' A' ' 72' ' ' ASN . . . -74.42 30.49 0.08 Allowed 'General case' 0 N--CA 1.491 1.602 0 O-C-N 121.576 -0.703 . . . . 0.0 109.453 179.861 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 71' ' ' ASP . . . . . 0.51 ' H ' ' C ' ' A' ' 69' ' ' VAL . 25.0 t0 55.6 -71.74 0.01 OUTLIER 'General case' 0 N--CA 1.493 1.7 0 CA-C-O 121.625 0.726 . . . . 0.0 110.728 179.658 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 72' ' ' ASN . . . . . 0.62 ' N ' ' O ' ' A' ' 70' ' ' ALA . 64.3 t30 -75.51 -2.15 27.58 Favored 'General case' 0 C--N 1.299 -1.628 0 O-C-N 121.299 -0.876 . . . . 0.0 109.429 -179.723 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -43.95 146.84 0.55 Allowed 'General case' 0 N--CA 1.496 1.843 0 O-C-N 121.306 -0.871 . . . . 0.0 110.125 179.974 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 74' ' ' THR . . . . . . . . . . . . . 5.0 p -96.74 0.15 49.09 Favored 'General case' 0 N--CA 1.492 1.658 0 O-C-N 121.385 -0.822 . . . . 0.0 108.965 -179.922 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 21.6 pt-20 -144.78 156.63 44.15 Favored 'General case' 0 N--CA 1.495 1.782 0 O-C-N 121.133 -0.979 . . . . 0.0 109.862 179.855 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 6.8 tt -126.4 133.26 51.33 Favored 'General case' 0 N--CA 1.492 1.644 0 CA-C-O 121.62 0.724 . . . . 0.0 109.267 -180.0 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 77' ' ' HIS . . . . . . . . . . . . . 73.8 m80 -105.76 129.37 53.97 Favored 'General case' 0 N--CA 1.495 1.819 0 O-C-N 121.626 -0.671 . . . . 0.0 109.639 -179.664 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -140.75 155.87 46.32 Favored 'General case' 0 N--CA 1.494 1.775 0 O-C-N 121.359 -0.838 . . . . 0.0 109.787 -179.774 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 95.7 mtt180 -128.04 147.16 50.51 Favored 'General case' 0 N--CA 1.497 1.876 0 CA-C-O 121.402 0.62 . . . . 0.0 109.83 -179.716 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 80' ' ' PHE . . . . . . . . . . . . . 83.8 m-85 -127.96 148.04 50.5 Favored 'General case' 0 N--CA 1.496 1.871 0 CA-C-O 121.451 0.643 . . . . 0.0 109.568 -179.851 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 63.4 tttp -111.37 127.35 55.63 Favored 'General case' 0 N--CA 1.494 1.739 0 N-CA-C 109.207 -0.664 . . . . 0.0 109.207 179.94 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 82' ' ' PHE . . . . . . . . . . . . . 78.0 m-85 -122.54 145.04 48.69 Favored 'General case' 0 N--CA 1.494 1.746 0 CA-C-O 121.875 0.845 . . . . 0.0 109.649 -179.782 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 32.4 mm-40 -69.46 -32.76 71.89 Favored 'General case' 0 C--N 1.299 -1.608 0 O-C-N 121.751 -0.593 . . . . 0.0 109.638 -179.815 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 84' ' ' VAL . . . . . . . . . . . . . 3.2 m -130.61 157.28 42.98 Favored 'Isoleucine or valine' 0 N--CA 1.499 1.999 0 CA-C-O 121.915 0.864 . . . . 0.0 110.397 -179.427 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 85' ' ' SER . . . . . 0.497 ' O ' ' N ' ' A' ' 88' ' ' LYS . 38.9 t -67.63 -40.2 84.65 Favored 'General case' 0 N--CA 1.492 1.626 0 CA-C-O 121.535 0.683 . . . . 0.0 110.213 179.645 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 86' ' ' ALA . . . . . 0.423 ' C ' ' O ' ' A' ' 85' ' ' SER . . . -40.85 -44.24 2.22 Favored 'General case' 0 N--CA 1.496 1.845 0 O-C-N 121.397 -0.815 . . . . 0.0 110.356 -179.042 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 98.2 mt-10 -66.03 -30.14 70.63 Favored 'General case' 0 C--N 1.299 -1.62 0 O-C-N 121.279 -0.888 . . . . 0.0 110.08 179.895 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 88' ' ' LYS . . . . . 0.497 ' N ' ' O ' ' A' ' 85' ' ' SER . 65.0 tttp -63.38 -46.8 84.8 Favored 'General case' 0 N--CA 1.494 1.727 0 O-C-N 121.068 -1.02 . . . . 0.0 110.062 -179.904 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 89' ' ' LEU . . . . . 0.511 HD22 ' N ' ' A' ' 89' ' ' LEU . 3.6 mm? -63.37 -47.58 81.49 Favored 'General case' 0 N--CA 1.493 1.723 0 O-C-N 121.23 -0.919 . . . . 0.0 110.128 -179.2 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 90' ' ' ILE . . . . . 0.499 ' N ' HD12 ' A' ' 90' ' ' ILE . 1.3 mp -69.19 -43.69 81.3 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.636 0 O-C-N 121.271 -0.893 . . . . 0.0 109.521 179.634 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 91' ' ' PHE . . . . . . . . . . . . . 62.2 t80 -60.37 -46.41 90.04 Favored 'General case' 0 C--N 1.298 -1.651 0 O-C-N 121.456 -0.778 . . . . 0.0 109.869 -179.116 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 92' ' ' GLU . . . . . 0.495 ' OE2' ' NZ ' ' A' ' 88' ' ' LYS . 97.1 mt-10 -67.74 -37.95 82.85 Favored 'General case' 0 N--CA 1.49 1.561 0 O-C-N 121.395 -0.816 . . . . 0.0 109.998 179.903 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 93' ' ' LEU . . . . . . . . . . . . . 6.4 tt -64.05 -46.82 82.71 Favored 'General case' 0 N--CA 1.49 1.575 0 O-C-N 121.129 -0.982 . . . . 0.0 110.156 -179.708 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 94' ' ' LYS . . . . . . . . . . . . . 96.1 mttt -66.91 -45.45 77.89 Favored 'General case' 0 N--CA 1.495 1.794 0 O-C-N 121.383 -0.823 . . . . 0.0 110.2 179.996 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 21.5 p -67.44 -41.47 84.71 Favored 'General case' 0 N--CA 1.492 1.665 0 O-C-N 121.23 -0.919 . . . . 0.0 109.61 -179.698 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 96' ' ' ARG . . . . . 0.435 ' CG ' ' O ' ' A' ' 92' ' ' GLU . 8.0 mmp_? -64.38 -43.81 93.3 Favored 'General case' 0 N--CA 1.49 1.565 0 O-C-N 121.221 -0.924 . . . . 0.0 109.698 179.825 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 97' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.3 -1.55 0 CA-C-O 121.771 0.796 . . . . 0.0 109.204 179.767 . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 96.9 mtp . . . . . 0 N--CA 1.49 1.562 0 N-CA-C 108.731 -0.841 . . . . 0.0 108.731 . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 48.2 t -63.72 143.46 57.82 Favored 'General case' 0 N--CA 1.492 1.669 0 CA-C-O 121.811 0.815 . . . . 0.0 110.326 -179.532 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 3' ' ' ASN . . . . . . . . . . . . . 3.5 m120 -64.48 -40.51 95.8 Favored 'General case' 0 N--CA 1.491 1.576 0 N-CA-C 109.462 -0.57 . . . . 0.0 109.462 -179.732 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 15.1 pt20 -82.04 142.66 32.15 Favored 'General case' 0 N--CA 1.494 1.744 0 CA-C-O 121.687 0.756 . . . . 0.0 110.31 -179.253 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 62.6 p -78.08 165.61 23.79 Favored 'General case' 0 N--CA 1.489 1.518 0 CA-C-O 121.767 0.794 . . . . 0.0 110.544 -179.449 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 2.5 p -178.75 72.14 0.02 OUTLIER 'General case' 0 N--CA 1.492 1.639 0 CA-C-O 121.533 0.682 . . . . 0.0 109.257 179.613 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 7' ' ' VAL . . . . . 0.422 ' O ' HG23 ' A' ' 7' ' ' VAL . 24.5 m -88.68 128.97 40.53 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.866 0 CA-C-O 121.727 0.775 . . . . 0.0 109.719 179.94 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 81.2 tt0 -90.06 113.16 24.82 Favored 'General case' 0 N--CA 1.494 1.772 0 CA-C-O 121.761 0.791 . . . . 0.0 109.638 -179.617 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 59.6 t-20 -96.23 -67.4 0.85 Allowed 'General case' 0 N--CA 1.495 1.791 0 N-CA-C 109.278 -0.638 . . . . 0.0 109.278 179.857 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 97.7 mt-10 41.53 -120.9 0.49 Allowed 'General case' 0 N--CA 1.494 1.757 0 CA-C-O 121.515 0.674 . . . . 0.0 110.421 -179.695 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 35.3 m -79.87 140.83 16.16 Favored 'Isoleucine or valine' 0 C--N 1.304 -1.383 0 CA-C-O 121.876 0.846 . . . . 0.0 110.512 -179.061 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 12' ' ' CYS . . . . . 0.415 ' O ' ' O ' ' A' ' 13' ' ' GLU . 4.9 p -145.66 155.88 43.29 Favored 'General case' 0 N--CA 1.49 1.542 0 CA-C-O 121.803 0.811 . . . . 0.0 109.705 179.547 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 13' ' ' GLU . . . . . 0.415 ' O ' ' O ' ' A' ' 12' ' ' CYS . 97.7 mt-10 42.35 -167.89 0.01 OUTLIER 'General case' 0 N--CA 1.491 1.599 0 CA-C-O 121.807 0.813 . . . . 0.0 110.956 179.94 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 14' ' ' ALA . . . . . 0.507 ' O ' ' N ' ' A' ' 16' ' ' GLY . . . 62.24 133.26 0.01 OUTLIER 'General case' 0 N--CA 1.489 1.492 0 CA-C-O 121.586 0.707 . . . . 0.0 110.467 -179.906 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 34.9 m 45.32 16.64 0.02 OUTLIER 'General case' 0 N--CA 1.491 1.591 0 CA-C-O 121.432 0.634 . . . . 0.0 109.531 -179.963 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 16' ' ' GLY . . . . . 0.507 ' N ' ' O ' ' A' ' 14' ' ' ALA . . . -84.41 -3.7 88.39 Favored Glycine 0 N--CA 1.493 2.461 0 N-CA-C 109.343 -1.503 . . . . 0.0 109.343 -179.931 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 37.8 m 44.45 25.92 0.15 Allowed 'General case' 0 N--CA 1.493 1.722 0 O-C-N 121.9 -0.765 . . . . 0.0 109.674 -179.87 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -65.0 99.95 0.39 Allowed 'General case' 0 N--CA 1.49 1.538 0 CA-C-O 121.727 0.775 . . . . 0.0 109.947 -179.968 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 79.8 175.81 48.52 Favored Glycine 0 N--CA 1.49 2.249 0 N-CA-C 110.739 -0.944 . . . . 0.0 110.739 179.02 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 49.0 tp10 -155.79 -34.63 0.09 Allowed 'General case' 0 N--CA 1.49 1.533 0 N-CA-C 108.778 -0.823 . . . . 0.0 108.778 179.654 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 21' ' ' ILE . . . . . . . . . . . . . 38.1 pt -87.35 139.56 17.15 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.95 0 CA-C-O 121.93 0.871 . . . . 0.0 110.521 -179.491 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . -84.81 129.52 9.28 Favored Glycine 0 N--CA 1.489 2.182 0 N-CA-C 110.164 -1.174 . . . . 0.0 110.164 -179.379 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 23' ' ' PHE . . . . . . . . . . . . . 92.4 t80 -148.01 -33.36 0.25 Allowed 'General case' 0 N--CA 1.493 1.696 0 O-C-N 121.846 -0.796 . . . . 0.0 109.077 179.544 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 8.9 pt -80.27 164.03 3.25 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.81 0 CA-C-O 121.748 0.785 . . . . 0.0 110.774 -179.652 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 25' ' ' ILE . . . . . . . . . . . . . 96.2 mt -72.88 132.96 32.68 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.337 0 CA-C-O 121.733 0.778 . . . . 0.0 110.421 -179.248 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 71.4 ttp85 -55.19 132.22 47.12 Favored 'General case' 0 N--CA 1.49 1.534 0 CA-C-O 121.817 0.817 . . . . 0.0 110.272 -179.33 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 16.7 pt-20 -67.2 144.05 56.2 Favored 'General case' 0 N--CA 1.49 1.551 0 CA-C-O 121.762 0.791 . . . . 0.0 110.357 -179.478 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . -177.19 175.65 47.73 Favored Glycine 0 N--CA 1.489 2.2 0 N-CA-C 110.147 -1.181 . . . . 0.0 110.147 179.856 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 37.1 p-10 -68.15 -21.02 64.93 Favored 'General case' 0 N--CA 1.49 1.571 0 O-C-N 121.806 -0.82 . . . . 0.0 109.572 -179.748 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 83.3 m-20 -90.37 9.05 30.47 Favored 'General case' 0 N--CA 1.494 1.76 0 O-C-N 121.505 -0.747 . . . . 0.0 109.005 179.83 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 51.3 t -124.8 136.1 61.83 Favored 'Isoleucine or valine' 0 N--CA 1.499 2.016 0 CA-C-O 121.728 0.775 . . . . 0.0 109.712 179.886 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -123.9 148.1 47.12 Favored 'General case' 0 N--CA 1.496 1.861 0 CA-C-O 121.86 0.838 . . . . 0.0 109.913 -179.961 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 96.7 mt-10 -104.42 142.01 35.33 Favored 'General case' 0 N--CA 1.496 1.85 0 CA-C-O 121.737 0.78 . . . . 0.0 109.984 -179.702 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 34' ' ' VAL . . . . . . . . . . . . . 55.5 t -125.89 132.84 70.24 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.769 0 CA-C-O 121.638 0.732 . . . . 0.0 109.331 -179.967 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 45.5 t -126.24 110.73 13.76 Favored 'General case' 0 N--CA 1.494 1.761 0 CA-C-O 121.678 0.752 . . . . 0.0 109.61 179.778 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 36' ' ' LEU . . . . . 0.544 HD13 ' OH ' ' A' ' 51' ' ' TYR . 51.4 tp -121.98 146.64 46.96 Favored 'General case' 0 N--CA 1.497 1.886 0 CA-C-O 121.818 0.818 . . . . 0.0 109.512 179.827 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 37' ' ' PHE . . . . . . . . . . . . . 41.7 p90 -141.87 155.77 45.53 Favored 'General case' 0 N--CA 1.492 1.648 0 CA-C-O 121.781 0.801 . . . . 0.0 110.293 -179.714 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . -166.66 -155.41 8.94 Favored Glycine 0 N--CA 1.491 2.312 0 N-CA-C 110.482 -1.047 . . . . 0.0 110.482 -179.579 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 39' ' ' SER . . . . . 0.491 ' OG ' ' CG ' ' A' ' 43' ' ' HIS . 74.3 p -63.24 -41.88 99.13 Favored 'General case' 0 N--CA 1.496 1.862 0 O-C-N 122.027 -0.69 . . . . 0.0 110.129 -179.103 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 40' ' ' ASP . . . . . . . . . . . . . 53.3 p-10 -171.62 -168.18 0.58 Allowed 'General case' 0 N--CA 1.491 1.586 0 CA-C-O 121.788 0.804 . . . . 0.0 110.01 179.769 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 28.3 tptp -62.43 -45.55 92.59 Favored 'General case' 0 C--N 1.303 -1.452 0 O-C-N 121.727 -0.608 . . . . 0.0 110.09 -179.265 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -50.41 -51.57 45.23 Favored 'General case' 0 N--CA 1.494 1.773 0 O-C-N 121.68 -0.637 . . . . 0.0 110.533 -178.358 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 43' ' ' HIS . . . . . 0.491 ' CG ' ' OG ' ' A' ' 39' ' ' SER . 23.0 m-70 -67.01 -37.35 84.01 Favored 'General case' 0 N--CA 1.495 1.782 0 O-C-N 121.441 -0.787 . . . . 0.0 110.115 -179.242 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 18.0 mt -63.58 -40.3 96.6 Favored 'General case' 0 N--CA 1.493 1.702 0 O-C-N 121.358 -0.839 . . . . 0.0 109.427 -179.467 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 96.0 mt-10 -61.56 -42.21 98.5 Favored 'General case' 0 N--CA 1.489 1.511 0 N-CA-C 109.036 -0.727 . . . . 0.0 109.036 -179.857 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . -64.55 -48.08 77.04 Favored Glycine 0 N--CA 1.494 2.542 0 N-CA-C 109.584 -1.406 . . . . 0.0 109.584 179.931 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 63.0 mttp -66.97 -33.9 76.59 Favored 'General case' 0 N--CA 1.493 1.698 0 O-C-N 121.712 -0.876 . . . . 0.0 108.995 179.641 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 58.7 tp -59.46 -40.23 86.21 Favored 'General case' 0 C--N 1.303 -1.423 0 N-CA-C 109.503 -0.555 . . . . 0.0 109.503 -178.965 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 49' ' ' ALA . . . . . . . . . . . . . . . -55.97 -39.97 72.56 Favored 'General case' 0 N--CA 1.491 1.618 0 O-C-N 121.563 -0.71 . . . . 0.0 109.23 -179.468 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 97.8 mt-10 -68.33 -39.75 81.83 Favored 'General case' 0 N--CA 1.492 1.659 0 O-C-N 121.62 -0.675 . . . . 0.0 109.419 179.791 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 51' ' ' TYR . . . . . 0.576 ' CE2' ' CG2' ' A' ' 95' ' ' THR . 4.3 m-85 -59.13 -40.69 86.24 Favored 'General case' 0 N--CA 1.494 1.763 0 O-C-N 121.536 -0.727 . . . . 0.0 109.145 -179.432 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 52' ' ' ILE . . . . . 0.565 ' CG2' ' HZ2' ' A' ' 56' ' ' LYS . 95.5 mt -63.98 -42.52 96.01 Favored 'Isoleucine or valine' 0 C--N 1.301 -1.518 0 N-CA-C 109.134 -0.691 . . . . 0.0 109.134 -179.844 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 49.4 m -53.23 -45.99 68.94 Favored 'General case' 0 N--CA 1.493 1.695 0 O-C-N 121.714 -0.616 . . . . 0.0 109.463 -179.0 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 54' ' ' LEU . . . . . 0.407 ' N ' ' CD2' ' A' ' 54' ' ' LEU . 4.0 mm? -64.73 -39.81 94.26 Favored 'General case' 0 C--N 1.3 -1.556 0 O-C-N 121.763 -0.586 . . . . 0.0 109.453 179.168 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -59.13 -49.48 77.73 Favored 'General case' 0 N--CA 1.49 1.573 0 CA-C-O 121.202 0.525 . . . . 0.0 109.769 -179.019 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 56' ' ' LYS . . . . . 0.565 ' HZ2' ' CG2' ' A' ' 52' ' ' ILE . 62.2 mttp -64.6 -39.66 94.11 Favored 'General case' 0 N--CA 1.49 1.564 0 O-C-N 121.6 -0.688 . . . . 0.0 109.359 179.715 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 51.5 tt0 -62.15 -49.19 76.85 Favored 'General case' 0 N--CA 1.489 1.494 0 O-C-N 121.73 -0.606 . . . . 0.0 109.375 -179.433 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 58' ' ' VAL . . . . . . . . . . . . . 72.8 t -66.49 -44.45 90.34 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.587 0 O-C-N 121.761 -0.587 . . . . 0.0 109.795 -179.731 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 59' ' ' TYR . . . . . . . . . . . . . 51.3 t80 -135.75 125.19 24.96 Favored 'General case' 0 N--CA 1.498 1.946 0 CA-C-O 121.918 0.866 . . . . 0.0 110.024 -179.421 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -71.45 144.77 49.61 Favored 'General case' 0 N--CA 1.492 1.629 0 CA-C-O 121.57 0.7 . . . . 0.0 110.73 -179.588 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 61' ' ' ASN . . . . . . . . . . . . . 10.7 m120 57.29 37.44 28.18 Favored 'General case' 0 N--CA 1.493 1.702 0 CA-C-O 121.544 0.688 . . . . 0.0 109.156 179.603 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 62' ' ' VAL . . . . . . . . . . . . . 10.3 p -67.63 138.73 22.13 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.509 0 CA-C-O 121.709 0.766 . . . . 0.0 110.194 -179.643 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 97.3 mt-10 -108.91 142.74 39.09 Favored 'General case' 0 N--CA 1.495 1.813 0 CA-C-O 121.726 0.774 . . . . 0.0 109.671 -179.466 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 64' ' ' TYR . . . . . . . . . . . . . 49.9 p90 -151.22 161.91 41.86 Favored 'General case' 0 N--CA 1.492 1.639 0 CA-C-O 121.936 0.874 . . . . 0.0 110.486 -179.993 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 80.5 tt0 -144.24 145.55 32.12 Favored 'General case' 0 N--CA 1.493 1.721 0 CA-C-O 121.511 0.672 . . . . 0.0 109.426 179.959 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 66' ' ' VAL . . . . . . . . . . . . . 30.8 m -120.71 129.99 75.04 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.903 0 CA-C-O 121.999 0.904 . . . . 0.0 110.266 -179.646 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 67' ' ' ALA . . . . . 0.558 ' HB1' ' HD2' ' A' ' 68' ' ' PRO . . . -78.57 170.74 14.82 Favored Pre-proline 0 C--N 1.301 -1.501 0 CA-C-N 115.976 -0.556 . . . . 0.0 109.506 179.925 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 68' ' ' PRO . . . . . 0.558 ' HD2' ' HB1' ' A' ' 67' ' ' ALA . 46.7 Cg_exo -54.58 134.11 60.29 Favored 'Trans proline' 0 N--CA 1.496 1.621 0 C-N-CA 122.578 2.186 . . . . 0.0 113.276 179.752 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 69' ' ' VAL . . . . . . . . . . . . . 64.9 t -134.76 132.85 54.21 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.939 0 CA-C-O 121.661 0.743 . . . . 0.0 109.93 179.445 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -82.37 163.7 21.54 Favored 'General case' 0 N--CA 1.49 1.569 0 CA-C-O 121.619 0.723 . . . . 0.0 109.516 179.343 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 49.8 t0 -64.92 -40.69 95.44 Favored 'General case' 0 N--CA 1.489 1.486 0 O-C-N 121.721 -0.612 . . . . 0.0 109.645 -179.53 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 72' ' ' ASN . . . . . . . . . . . . . 95.0 m-20 -97.87 21.81 10.08 Favored 'General case' 0 N--CA 1.495 1.819 0 N-CA-C 108.97 -0.752 . . . . 0.0 108.97 -179.586 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 73' ' ' ALA . . . . . 0.462 ' C ' ' H ' ' A' ' 75' ' ' GLU . . . -62.36 -36.55 82.59 Favored 'General case' 0 N--CA 1.494 1.767 0 O-C-N 121.649 -0.657 . . . . 0.0 109.411 -179.826 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 74' ' ' THR . . . . . . . . . . . . . 2.0 m 67.78 -6.37 0.71 Allowed 'General case' 0 N--CA 1.491 1.606 0 N-CA-C 109.432 -0.581 . . . . 0.0 109.432 -179.965 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 75' ' ' GLU . . . . . 0.498 ' OE1' ' CE1' ' A' ' 77' ' ' HIS . 2.9 pp20? -137.85 145.98 42.88 Favored 'General case' 0 N--CA 1.495 1.82 0 CA-C-O 121.93 0.872 . . . . 0.0 110.336 -179.873 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 2.0 tp -121.06 128.92 53.08 Favored 'General case' 0 N--CA 1.49 1.56 0 CA-C-O 121.586 0.708 . . . . 0.0 109.451 -179.928 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 77' ' ' HIS . . . . . 0.498 ' CE1' ' OE1' ' A' ' 75' ' ' GLU . 30.6 m80 -106.09 114.48 28.65 Favored 'General case' 0 N--CA 1.495 1.788 0 CA-C-O 121.672 0.749 . . . . 0.0 109.213 179.913 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -135.07 154.62 51.63 Favored 'General case' 0 N--CA 1.495 1.78 0 CA-C-O 121.899 0.857 . . . . 0.0 110.227 -179.675 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 94.6 mtt-85 -129.46 146.22 51.33 Favored 'General case' 0 N--CA 1.496 1.829 0 CA-C-O 121.536 0.684 . . . . 0.0 109.585 -179.956 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 80' ' ' PHE . . . . . . . . . . . . . 67.9 m-85 -126.34 144.49 50.79 Favored 'General case' 0 N--CA 1.498 1.942 0 CA-C-O 121.803 0.811 . . . . 0.0 109.965 -179.876 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 21.6 ttpp -115.17 121.46 43.06 Favored 'General case' 0 N--CA 1.494 1.746 0 CA-C-O 121.719 0.771 . . . . 0.0 109.565 -179.792 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 82' ' ' PHE . . . . . . . . . . . . . 83.5 m-85 -115.32 -129.42 0.3 Allowed 'General case' 0 N--CA 1.496 1.859 0 CA-C-O 121.532 0.682 . . . . 0.0 109.613 -179.876 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 78.8 tt0 -140.46 -33.29 0.56 Allowed 'General case' 0 N--CA 1.493 1.71 0 N-CA-C 108.841 -0.8 . . . . 0.0 108.841 -179.54 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 84' ' ' VAL . . . . . . . . . . . . . 27.5 m -135.79 159.8 39.49 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.894 0 CA-C-O 121.891 0.853 . . . . 0.0 109.852 179.953 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 38.0 m -63.37 -34.92 78.76 Favored 'General case' 0 N--CA 1.49 1.536 0 CA-C-O 121.319 0.58 . . . . 0.0 109.907 -179.567 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 86' ' ' ALA . . . . . . . . . . . . . . . -50.22 -45.94 54.28 Favored 'General case' 0 N--CA 1.491 1.577 0 O-C-N 121.526 -0.734 . . . . 0.0 109.676 -178.911 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 87' ' ' GLU . . . . . 0.56 ' OE1' ' N ' ' A' ' 87' ' ' GLU . 0.0 OUTLIER -52.12 -37.81 55.46 Favored 'General case' 0 N--CA 1.493 1.695 0 O-C-N 121.56 -0.712 . . . . 0.0 109.654 -179.103 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 88' ' ' LYS . . . . . . . . . . . . . 88.7 tttt -64.13 -46.1 85.61 Favored 'General case' 0 N--CA 1.49 1.527 0 O-C-N 121.675 -0.64 . . . . 0.0 109.526 -179.609 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 89' ' ' LEU . . . . . 0.531 HD22 ' N ' ' A' ' 89' ' ' LEU . 4.0 mm? -63.94 -45.31 89.74 Favored 'General case' 0 N--CA 1.492 1.664 0 O-C-N 121.651 -0.655 . . . . 0.0 110.427 -179.252 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 90' ' ' ILE . . . . . . . . . . . . . 37.1 mm -70.2 -45.28 76.38 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.665 0 O-C-N 121.773 -0.58 . . . . 0.0 109.684 -179.641 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 91' ' ' PHE . . . . . . . . . . . . . 83.9 t80 -64.51 -45.33 87.69 Favored 'General case' 0 N--CA 1.492 1.66 0 O-C-N 121.648 -0.658 . . . . 0.0 109.896 179.84 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 92' ' ' GLU . . . . . . . . . . . . . 46.5 tp10 -66.48 -38.0 86.33 Favored 'General case' 0 N--CA 1.491 1.595 0 O-C-N 121.726 -0.609 . . . . 0.0 109.533 -178.949 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 93' ' ' LEU . . . . . . . . . . . . . 5.5 tt -62.68 -49.17 76.17 Favored 'General case' 0 C--N 1.303 -1.44 0 O-C-N 121.572 -0.705 . . . . 0.0 109.952 -179.301 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 94' ' ' LYS . . . . . . . . . . . . . 49.6 mtmt -69.67 -40.96 76.11 Favored 'General case' 0 N--CA 1.49 1.551 0 O-C-N 121.647 -0.658 . . . . 0.0 109.746 -179.87 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 95' ' ' THR . . . . . 0.576 ' CG2' ' CE2' ' A' ' 51' ' ' TYR . 98.9 m -61.61 -46.9 87.85 Favored 'General case' 0 N--CA 1.491 1.621 0 O-C-N 121.657 -0.652 . . . . 0.0 109.594 -178.917 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 96' ' ' ARG . . . . . . . . . . . . . 78.8 mtp85 -65.8 -40.36 91.83 Favored 'General case' 0 N--CA 1.492 1.669 0 O-C-N 121.687 -0.633 . . . . 0.0 109.338 179.67 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 97' ' ' ALA . . . . . 0.479 ' O ' ' N ' ' A' ' 101' ' ' LEU . . . -64.66 -36.27 83.72 Favored 'General case' 0 N--CA 1.489 1.484 0 N-CA-C 109.023 -0.732 . . . . 0.0 109.023 -179.813 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 98' ' ' LEU . . . . . 0.617 ' O ' HD23 ' A' ' 98' ' ' LEU . 3.6 tt -62.13 -47.83 82.82 Favored 'General case' 0 N--CA 1.488 1.427 0 CA-C-O 121.489 0.661 . . . . 0.0 109.238 -179.342 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 99' ' ' ALA . . . . . . . . . . . . . . . -74.89 -40.92 60.65 Favored 'General case' 0 N--CA 1.491 1.618 0 O-C-N 121.562 -0.711 . . . . 0.0 109.856 -179.749 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 100' ' ' ARG . . . . . 0.409 ' O ' ' C ' ' A' ' 101' ' ' LEU . 83.4 mmt-85 -80.52 -10.15 59.75 Favored 'General case' 0 N--CA 1.491 1.583 0 N-CA-C 109.273 -0.64 . . . . 0.0 109.273 -179.158 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 101' ' ' LEU . . . . . 0.479 ' N ' ' O ' ' A' ' 97' ' ' ALA . 90.5 mt 40.35 59.71 1.99 Allowed 'General case' 0 N--CA 1.493 1.717 0 CA-C-O 121.438 0.637 . . . . 0.0 109.879 -179.914 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 102' ' ' GLU . . . . . . . . . . . . . 18.0 pt-20 -90.16 -5.34 56.57 Favored 'General case' 0 N--CA 1.492 1.674 0 N-CA-C 108.966 -0.754 . . . . 0.0 108.966 179.975 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 103' ' ' HIS . . . . . . . . . . . . . 78.2 t60 -77.29 136.4 38.49 Favored 'General case' 0 N--CA 1.493 1.697 0 CA-C-O 121.735 0.779 . . . . 0.0 110.125 -179.479 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 104' ' ' HIS . . . . . 0.598 ' NE2' ' CD2' ' A' ' 105' ' ' HIS . 71.6 t60 59.73 168.91 0.07 Allowed 'General case' 0 N--CA 1.49 1.532 0 CA-C-O 121.633 0.73 . . . . 0.0 110.308 179.664 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 105' ' ' HIS . . . . . 0.598 ' CD2' ' NE2' ' A' ' 104' ' ' HIS . 34.3 p80 -84.75 -147.86 0.1 Allowed 'General case' 0 N--CA 1.489 1.511 0 CA-C-O 121.473 0.654 . . . . 0.0 109.932 -179.452 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 106' ' ' HIS . . . . . 0.668 ' CD2' ' H ' ' A' ' 108' ' ' HIS . 81.8 t60 -63.71 158.5 21.43 Favored 'General case' 0 N--CA 1.49 1.558 0 CA-C-O 121.889 0.852 . . . . 0.0 111.049 -178.668 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 107' ' ' HIS . . . . . 0.409 ' N ' ' CG ' ' A' ' 106' ' ' HIS . 73.2 m80 -61.47 -45.7 93.17 Favored 'General case' 0 N--CA 1.487 1.407 0 N-CA-C 109.243 -0.651 . . . . 0.0 109.243 -179.778 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 108' ' ' HIS . . . . . 0.668 ' H ' ' CD2' ' A' ' 106' ' ' HIS . 74.1 m80 . . . . . 0 N--CA 1.496 1.868 0 CA-C-O 118.253 -0.88 . . . . 0.0 109.52 -179.787 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 4.0 mpp? . . . . . 0 N--CA 1.488 1.432 0 N-CA-C 108.607 -0.886 . . . . 0.0 108.607 . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . 0.413 ' O ' ' OD1' ' A' ' 3' ' ' ASN . 46.3 t -140.93 150.34 43.01 Favored 'General case' 0 N--CA 1.495 1.822 0 O-C-N 121.326 -0.859 . . . . 0.0 109.809 -179.96 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 3' ' ' ASN . . . . . 0.413 ' OD1' ' O ' ' A' ' 2' ' ' SER . 7.1 p-10 44.08 46.41 7.14 Favored 'General case' 0 N--CA 1.495 1.784 0 CA-C-O 121.659 0.742 . . . . 0.0 109.693 -179.905 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 14.0 pt20 -71.35 138.85 49.55 Favored 'General case' 0 N--CA 1.492 1.642 0 CA-C-O 121.847 0.832 . . . . 0.0 110.265 -179.865 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 5' ' ' THR . . . . . 0.513 ' O ' ' SG ' ' A' ' 6' ' ' CYS . 2.8 p -84.67 -169.23 2.53 Favored 'General case' 0 N--CA 1.49 1.547 0 CA-C-O 121.639 0.733 . . . . 0.0 110.345 -179.414 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 6' ' ' CYS . . . . . 0.513 ' SG ' ' O ' ' A' ' 5' ' ' THR . 20.7 p 38.83 93.86 0.01 OUTLIER 'General case' 0 N--CA 1.495 1.79 0 CA-C-O 121.88 0.848 . . . . 0.0 110.365 179.975 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 7' ' ' VAL . . . . . 0.593 HG22 ' H ' ' A' ' 9' ' ' ASN . 7.3 p -80.16 128.79 38.38 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.451 0 CA-C-O 121.853 0.835 . . . . 0.0 109.99 -179.526 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 97.1 mt-10 -88.55 -8.18 55.21 Favored 'General case' 0 N--CA 1.495 1.781 0 O-C-N 121.408 -0.807 . . . . 0.0 109.404 179.987 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 9' ' ' ASN . . . . . 0.593 ' H ' HG22 ' A' ' 7' ' ' VAL . 49.5 t30 -150.69 107.23 3.5 Favored 'General case' 0 N--CA 1.496 1.846 0 O-C-N 120.966 -1.084 . . . . 0.0 109.484 -179.977 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 17.3 pt-20 -57.2 -157.6 0.0 OUTLIER 'General case' 0 N--CA 1.495 1.797 0 CA-C-O 121.829 0.823 . . . . 0.0 111.116 -179.219 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 7.7 p -64.67 136.26 26.86 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.626 0 CA-C-O 121.934 0.873 . . . . 0.0 110.75 -179.204 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 12' ' ' CYS . . . . . 0.564 ' O ' ' N ' ' A' ' 14' ' ' ALA . 0.7 OUTLIER -60.86 -50.65 72.57 Favored 'General case' 0 N--CA 1.492 1.65 0 O-C-N 121.655 -0.653 . . . . 0.0 110.148 -179.802 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 13' ' ' GLU . . . . . 0.421 ' C ' ' O ' ' A' ' 12' ' ' CYS . 84.6 tt0 36.44 -89.01 0.01 OUTLIER 'General case' 0 N--CA 1.499 2.013 0 CA-C-O 121.726 0.774 . . . . 0.0 110.845 -179.418 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 14' ' ' ALA . . . . . 0.564 ' N ' ' O ' ' A' ' 12' ' ' CYS . . . -72.23 -178.58 2.53 Favored 'General case' 0 C--N 1.302 -1.477 0 CA-C-O 121.972 0.891 . . . . 0.0 110.793 -179.242 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 86.9 m -62.34 -38.1 88.19 Favored 'General case' 0 N--CA 1.489 1.513 0 CA-C-O 121.561 0.696 . . . . 0.0 109.284 179.835 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 78.19 0.01 75.55 Favored Glycine 0 N--CA 1.491 2.345 0 N-CA-C 109.404 -1.478 . . . . 0.0 109.404 -179.845 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 21.8 p -156.23 155.74 32.91 Favored 'General case' 0 N--CA 1.491 1.584 0 O-C-N 121.178 -1.189 . . . . 0.0 109.968 -179.94 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . 40.8 -161.48 0.01 OUTLIER 'General case' 0 N--CA 1.496 1.836 0 CA-C-O 121.812 0.815 . . . . 0.0 111.176 179.554 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 154.02 -69.28 0.3 Allowed Glycine 0 N--CA 1.492 2.396 0 N-CA-C 109.144 -1.582 . . . . 0.0 109.144 -179.298 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 68.3 tt0 44.25 -122.31 0.85 Allowed 'General case' 0 N--CA 1.495 1.808 0 O-C-N 121.565 -0.962 . . . . 0.0 109.851 179.901 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 21' ' ' ILE . . . . . . . . . . . . . 93.2 mt -107.43 -29.31 2.64 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.531 0 N-CA-C 108.711 -0.848 . . . . 0.0 108.711 179.893 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 157.57 -156.81 27.61 Favored Glycine 0 N--CA 1.493 2.434 0 C-N-CA 119.453 -1.356 . . . . 0.0 110.515 179.838 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 23' ' ' PHE . . . . . . . . . . . . . 61.2 m-85 -79.32 136.38 37.0 Favored 'General case' 0 N--CA 1.491 1.612 0 O-C-N 121.447 -1.031 . . . . 0.0 110.373 -179.289 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 24' ' ' ILE . . . . . 0.693 HG23 HG12 ' A' ' 25' ' ' ILE . 12.3 tt -87.49 170.24 1.29 Allowed 'Isoleucine or valine' 0 N--CA 1.492 1.647 0 O-C-N 121.529 -0.732 . . . . 0.0 109.645 179.899 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 25' ' ' ILE . . . . . 0.693 HG12 HG23 ' A' ' 24' ' ' ILE . 20.4 pt 33.5 69.03 0.06 OUTLIER 'Isoleucine or valine' 0 N--CA 1.501 2.086 0 CA-C-O 122.243 1.02 . . . . 0.0 110.276 -179.839 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 26' ' ' ARG . . . . . 0.443 ' O ' ' O ' ' A' ' 25' ' ' ILE . 17.5 ptm180 -48.61 179.25 0.0 OUTLIER 'General case' 0 C--N 1.301 -1.519 0 CA-C-O 122.008 0.909 . . . . 0.0 110.776 -179.09 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 27' ' ' GLU . . . . . 0.501 ' OE1' ' N ' ' A' ' 27' ' ' GLU . 58.5 mp0 -73.57 60.73 0.68 Allowed 'General case' 0 N--CA 1.488 1.444 0 CA-C-O 121.818 0.818 . . . . 0.0 109.502 -179.578 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . -80.49 172.01 54.33 Favored Glycine 0 N--CA 1.488 2.158 0 N-CA-C 110.498 -1.041 . . . . 0.0 110.498 -179.895 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 98.9 m-20 -70.84 -10.95 60.6 Favored 'General case' 0 N--CA 1.492 1.64 0 O-C-N 121.592 -0.946 . . . . 0.0 109.574 179.632 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 30' ' ' ASP . . . . . 0.445 ' OD1' ' N ' ' A' ' 30' ' ' ASP . 29.3 p-10 -92.04 9.82 31.7 Favored 'General case' 0 N--CA 1.493 1.701 0 O-C-N 121.087 -1.008 . . . . 0.0 108.945 179.782 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 31' ' ' VAL . . . . . 0.444 HG12 ' N ' ' A' ' 32' ' ' ALA . 17.2 t -117.21 161.24 16.14 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.97 0 O-C-N 121.551 -0.718 . . . . 0.0 109.658 -179.78 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 32' ' ' ALA . . . . . 0.444 ' N ' HG12 ' A' ' 31' ' ' VAL . . . -135.92 151.61 50.15 Favored 'General case' 0 N--CA 1.492 1.63 0 O-C-N 121.514 -0.741 . . . . 0.0 109.436 -179.652 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 33' ' ' GLU . . . . . 0.496 ' OE1' ' NE2' ' A' ' 77' ' ' HIS . 80.4 mm-40 -100.2 142.7 31.32 Favored 'General case' 0 N--CA 1.493 1.71 0 CA-C-O 121.877 0.846 . . . . 0.0 110.035 -179.597 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 34' ' ' VAL . . . . . . . . . . . . . 52.3 t -128.87 135.48 62.11 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.802 0 CA-C-O 121.629 0.728 . . . . 0.0 109.146 -179.915 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 79.8 p -142.4 120.87 12.43 Favored 'General case' 0 N--CA 1.492 1.638 0 O-C-N 121.258 -0.901 . . . . 0.0 109.05 179.779 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 51.0 tp -122.38 136.27 54.86 Favored 'General case' 0 N--CA 1.497 1.887 0 CA-C-O 121.449 0.642 . . . . 0.0 109.587 -179.9 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 37' ' ' PHE . . . . . . . . . . . . . 91.0 t80 -108.48 131.01 55.23 Favored 'General case' 0 N--CA 1.495 1.787 0 CA-C-O 121.61 0.719 . . . . 0.0 109.468 -179.997 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . -172.09 -159.18 17.9 Favored Glycine 0 N--CA 1.488 2.16 0 N-CA-C 109.951 -1.26 . . . . 0.0 109.951 -179.639 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 39' ' ' SER . . . . . 0.449 ' OG ' ' N ' ' A' ' 40' ' ' ASP . 39.7 t -75.78 -146.94 0.03 OUTLIER 'General case' 0 N--CA 1.494 1.771 0 O-C-N 121.645 -0.914 . . . . 0.0 111.042 -179.061 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 40' ' ' ASP . . . . . 0.449 ' N ' ' OG ' ' A' ' 39' ' ' SER . 97.9 m-20 -52.07 175.98 0.02 OUTLIER 'General case' 0 N--CA 1.493 1.706 0 CA-C-O 122.162 0.982 . . . . 0.0 111.24 -178.696 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 38.0 ttmt -62.29 -42.82 99.68 Favored 'General case' 0 N--CA 1.491 1.577 0 O-C-N 121.633 -0.667 . . . . 0.0 109.575 179.608 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -53.46 -44.7 69.13 Favored 'General case' 0 N--CA 1.492 1.63 0 O-C-N 121.337 -0.852 . . . . 0.0 109.569 -179.558 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 43' ' ' HIS . . . . . . . . . . . . . 86.6 t60 -63.17 -43.36 98.49 Favored 'General case' 0 N--CA 1.493 1.694 0 O-C-N 121.277 -0.89 . . . . 0.0 109.62 179.892 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 97.5 mt -64.43 -39.88 94.68 Favored 'General case' 0 N--CA 1.493 1.723 0 O-C-N 121.413 -0.804 . . . . 0.0 109.713 -179.871 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 96.1 mt-10 -60.73 -38.55 85.5 Favored 'General case' 0 N--CA 1.491 1.603 0 O-C-N 121.203 -0.936 . . . . 0.0 109.833 -179.719 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . -62.34 -52.06 52.03 Favored Glycine 0 N--CA 1.494 2.507 0 N-CA-C 109.698 -1.361 . . . . 0.0 109.698 179.951 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 97.3 mttt -67.59 -37.21 82.25 Favored 'General case' 0 N--CA 1.492 1.644 0 O-C-N 121.32 -1.106 . . . . 0.0 109.739 179.157 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 48' ' ' LEU . . . . . 0.5 ' O ' ' N ' ' A' ' 51' ' ' TYR . 20.7 tp -61.62 -40.13 93.74 Favored 'General case' 0 C--N 1.299 -1.595 0 O-C-N 121.532 -0.73 . . . . 0.0 109.427 -179.177 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 49' ' ' ALA . . . . . 0.426 ' C ' ' O ' ' A' ' 48' ' ' LEU . . . -40.44 -33.24 0.24 Allowed 'General case' 0 N--CA 1.497 1.91 0 CA-C-O 121.617 0.723 . . . . 0.0 109.955 -179.588 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 72.8 mm-40 -68.69 -38.53 80.38 Favored 'General case' 0 N--CA 1.491 1.608 0 O-C-N 121.32 -0.862 . . . . 0.0 109.658 179.513 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 51' ' ' TYR . . . . . 0.5 ' N ' ' O ' ' A' ' 48' ' ' LEU . 21.3 m-85 -62.04 -45.31 94.11 Favored 'General case' 0 N--CA 1.494 1.74 0 O-C-N 121.224 -0.923 . . . . 0.0 109.79 -179.761 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 52' ' ' ILE . . . . . . . . . . . . . 97.2 mt -65.24 -44.16 95.17 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.658 0 O-C-N 121.347 -0.845 . . . . 0.0 109.857 -179.658 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 68.9 m -62.52 -45.02 94.9 Favored 'General case' 0 N--CA 1.494 1.729 0 O-C-N 121.163 -0.96 . . . . 0.0 109.713 -179.642 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 54' ' ' LEU . . . . . 0.442 HD12 HG22 ' A' ' 95' ' ' THR . 88.2 mt -65.87 -39.38 90.66 Favored 'General case' 0 N--CA 1.492 1.646 0 O-C-N 121.371 -0.831 . . . . 0.0 109.784 179.883 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -61.37 -38.82 88.37 Favored 'General case' 0 N--CA 1.49 1.565 0 O-C-N 121.352 -0.842 . . . . 0.0 109.666 -179.522 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 56' ' ' LYS . . . . . . . . . . . . . 56.6 mtpt -64.43 -42.53 95.96 Favored 'General case' 0 N--CA 1.491 1.599 0 O-C-N 121.246 -0.909 . . . . 0.0 109.565 179.68 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 19.3 mm100 -68.54 -41.8 79.32 Favored 'General case' 0 N--CA 1.49 1.532 0 O-C-N 121.286 -0.884 . . . . 0.0 109.521 -179.897 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 58' ' ' VAL . . . . . . . . . . . . . 75.0 t -64.76 -45.57 94.74 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.638 0 O-C-N 121.285 -0.884 . . . . 0.0 109.755 179.809 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 59' ' ' TYR . . . . . . . . . . . . . 51.2 t80 -135.09 121.69 20.7 Favored 'General case' 0 N--CA 1.497 1.909 0 O-C-N 121.339 -0.85 . . . . 0.0 109.77 -179.588 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -68.04 144.51 55.08 Favored 'General case' 0 N--CA 1.492 1.673 0 CA-C-O 121.645 0.736 . . . . 0.0 110.764 -179.585 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 61' ' ' ASN . . . . . . . . . . . . . 55.9 t-20 57.75 41.33 25.3 Favored 'General case' 0 N--CA 1.489 1.508 0 CA-C-O 121.906 0.86 . . . . 0.0 108.98 179.659 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 62' ' ' VAL . . . . . . . . . . . . . 7.4 p -70.76 138.66 21.4 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.516 0 CA-C-O 121.772 0.796 . . . . 0.0 110.321 -179.67 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 97.1 mt-10 -111.19 136.74 49.82 Favored 'General case' 0 N--CA 1.494 1.749 0 CA-C-O 121.611 0.719 . . . . 0.0 109.466 -179.849 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 64' ' ' TYR . . . . . . . . . . . . . 52.4 p90 -147.6 161.3 41.41 Favored 'General case' 0 N--CA 1.489 1.485 0 O-C-N 121.432 -0.792 . . . . 0.0 109.767 -179.549 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 83.1 tt0 -144.56 150.16 37.04 Favored 'General case' 0 N--CA 1.49 1.57 0 N-CA-C 108.935 -0.765 . . . . 0.0 108.935 -179.992 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 66' ' ' VAL . . . . . . . . . . . . . 57.3 t -111.48 129.67 66.4 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.89 0 CA-C-O 121.752 0.787 . . . . 0.0 109.83 -179.705 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 67' ' ' ALA . . . . . 0.514 ' HB1' ' HD2' ' A' ' 68' ' ' PRO . . . -79.45 170.54 15.59 Favored Pre-proline 0 N--CA 1.486 1.369 0 O-C-N 121.698 -0.626 . . . . 0.0 109.589 -179.487 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 68' ' ' PRO . . . . . 0.514 ' HD2' ' HB1' ' A' ' 67' ' ' ALA . 51.3 Cg_exo -54.72 119.11 5.91 Favored 'Trans proline' 0 N--CA 1.496 1.651 0 C-N-CA 122.412 2.075 . . . . 0.0 112.448 179.64 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 69' ' ' VAL . . . . . . . . . . . . . 74.7 t -131.98 133.28 61.01 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.946 0 O-C-N 121.469 -0.769 . . . . 0.0 109.653 179.634 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -78.61 158.07 28.55 Favored 'General case' 0 N--CA 1.493 1.684 0 CA-C-O 121.757 0.789 . . . . 0.0 110.253 179.869 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 56.6 m-20 -64.09 -37.04 85.99 Favored 'General case' 0 N--CA 1.493 1.684 0 O-C-N 121.58 -0.7 . . . . 0.0 109.39 -179.807 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 72' ' ' ASN . . . . . . . . . . . . . 8.3 t-20 -103.91 28.9 6.26 Favored 'General case' 0 N--CA 1.495 1.79 0 O-C-N 121.333 -0.855 . . . . 0.0 108.925 -179.703 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 73' ' ' ALA . . . . . 0.5 ' O ' ' N ' ' A' ' 75' ' ' GLU . . . -72.96 -10.07 59.4 Favored 'General case' 0 N--CA 1.493 1.677 0 O-C-N 121.292 -0.88 . . . . 0.0 108.729 179.622 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 74' ' ' THR . . . . . . . . . . . . . 68.4 p 49.69 10.59 0.04 OUTLIER 'General case' 0 N--CA 1.493 1.722 0 O-C-N 121.424 -0.797 . . . . 0.0 109.489 -179.726 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 75' ' ' GLU . . . . . 0.5 ' N ' ' O ' ' A' ' 73' ' ' ALA . 80.8 tt0 -153.82 153.04 31.4 Favored 'General case' 0 C--N 1.302 -1.487 0 O-C-N 121.2 -0.937 . . . . 0.0 109.165 179.618 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 5.7 tt -132.38 134.99 45.82 Favored 'General case' 0 N--CA 1.49 1.546 0 O-C-N 121.608 -0.683 . . . . 0.0 109.324 179.971 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 77' ' ' HIS . . . . . 0.496 ' NE2' ' OE1' ' A' ' 33' ' ' GLU . 74.5 t60 -118.75 126.22 51.4 Favored 'General case' 0 N--CA 1.494 1.758 0 CA-C-O 121.74 0.781 . . . . 0.0 109.46 -179.853 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -144.13 163.87 32.32 Favored 'General case' 0 N--CA 1.492 1.661 0 O-C-N 121.389 -0.82 . . . . 0.0 109.408 -179.719 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 84.5 mtt85 -126.01 144.95 50.51 Favored 'General case' 0 N--CA 1.495 1.792 0 N-CA-C 109.226 -0.657 . . . . 0.0 109.226 -179.877 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 80' ' ' PHE . . . . . . . . . . . . . 64.9 m-85 -128.93 152.0 49.04 Favored 'General case' 0 N--CA 1.495 1.798 0 CA-C-O 121.616 0.722 . . . . 0.0 109.374 -179.717 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 65.0 tttm -106.07 137.72 43.5 Favored 'General case' 0 N--CA 1.492 1.655 0 CA-C-O 121.603 0.716 . . . . 0.0 110.007 -179.507 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 82' ' ' PHE . . . . . . . . . . . . . 80.7 m-85 -133.13 -123.46 0.18 Allowed 'General case' 0 N--CA 1.494 1.768 0 N-CA-C 109.201 -0.666 . . . . 0.0 109.201 179.846 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 49.5 tp10 -153.65 -36.89 0.1 Allowed 'General case' 0 N--CA 1.488 1.442 0 O-C-N 121.225 -0.922 . . . . 0.0 108.704 179.959 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 84' ' ' VAL . . . . . . . . . . . . . 27.8 m -135.89 162.49 36.55 Favored 'Isoleucine or valine' 0 N--CA 1.499 1.991 0 O-C-N 121.329 -0.857 . . . . 0.0 110.155 -179.745 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 77.8 p -69.66 -19.95 63.59 Favored 'General case' 0 N--CA 1.492 1.635 0 O-C-N 121.496 -0.753 . . . . 0.0 109.482 179.618 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 86' ' ' ALA . . . . . . . . . . . . . . . -62.72 -37.6 87.15 Favored 'General case' 0 N--CA 1.492 1.63 0 O-C-N 121.253 -0.905 . . . . 0.0 109.521 179.983 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 80.4 mm-40 -71.8 -27.13 62.73 Favored 'General case' 0 N--CA 1.491 1.596 0 O-C-N 121.348 -0.845 . . . . 0.0 109.109 179.572 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 88' ' ' LYS . . . . . . . . . . . . . 36.8 ttmt -63.41 -50.61 69.14 Favored 'General case' 0 N--CA 1.49 1.544 0 O-C-N 121.258 -0.901 . . . . 0.0 109.726 -179.592 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 89' ' ' LEU . . . . . 0.5 HD22 ' N ' ' A' ' 89' ' ' LEU . 4.0 mm? -65.41 -44.22 88.09 Favored 'General case' 0 N--CA 1.493 1.72 0 O-C-N 121.349 -0.845 . . . . 0.0 109.893 -179.72 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 90' ' ' ILE . . . . . 0.4 ' O ' ' CB ' ' A' ' 94' ' ' LYS . 96.0 mt -66.63 -43.62 90.3 Favored 'Isoleucine or valine' 0 C--N 1.299 -1.616 0 O-C-N 121.296 -0.877 . . . . 0.0 109.625 -179.94 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 91' ' ' PHE . . . . . 0.582 ' O ' HG23 ' A' ' 95' ' ' THR . 82.5 t80 -61.67 -46.74 88.45 Favored 'General case' 0 N--CA 1.49 1.57 0 O-C-N 121.257 -0.902 . . . . 0.0 109.9 -179.619 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 92' ' ' GLU . . . . . . . . . . . . . 8.8 tm-20 -68.19 -51.77 41.87 Favored 'General case' 0 N--CA 1.491 1.611 0 O-C-N 121.345 -0.847 . . . . 0.0 109.996 -179.463 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 93' ' ' LEU . . . . . 0.631 ' O ' HD23 ' A' ' 93' ' ' LEU . 3.1 tt -63.64 -46.67 84.6 Favored 'General case' 0 C--N 1.3 -1.586 0 O-C-N 121.173 -0.954 . . . . 0.0 109.659 -179.101 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 94' ' ' LYS . . . . . 0.4 ' CB ' ' O ' ' A' ' 90' ' ' ILE . 55.1 tttp -63.32 -47.27 82.92 Favored 'General case' 0 N--CA 1.491 1.61 0 O-C-N 121.205 -0.935 . . . . 0.0 110.09 -179.072 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 95' ' ' THR . . . . . 0.582 HG23 ' O ' ' A' ' 91' ' ' PHE . 60.0 p -67.68 -42.09 82.65 Favored 'General case' 0 C--N 1.299 -1.595 0 O-C-N 121.258 -0.901 . . . . 0.0 109.465 -179.854 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 96' ' ' ARG . . . . . . . . . . . . . 12.1 tpt180 -65.47 -41.54 93.23 Favored 'General case' 0 C--N 1.3 -1.553 0 O-C-N 121.313 -0.867 . . . . 0.0 109.322 -179.853 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 97' ' ' ALA . . . . . . . . . . . . . . . -57.92 -40.19 79.81 Favored 'General case' 0 N--CA 1.489 1.517 0 O-C-N 121.366 -0.834 . . . . 0.0 109.245 -179.762 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 98' ' ' LEU . . . . . 0.622 ' O ' HD23 ' A' ' 98' ' ' LEU . 2.2 tt -64.04 -42.75 96.96 Favored 'General case' 0 N--CA 1.493 1.678 0 CA-C-O 121.945 0.878 . . . . 0.0 109.454 -179.695 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 99' ' ' ALA . . . . . . . . . . . . . . . -58.11 -48.92 78.72 Favored 'General case' 0 N--CA 1.493 1.694 0 O-C-N 121.144 -0.972 . . . . 0.0 110.313 -179.056 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 100' ' ' ARG . . . . . . . . . . . . . 18.5 ptp180 -80.55 -19.39 45.78 Favored 'General case' 0 C--N 1.299 -1.604 0 O-C-N 121.313 -0.867 . . . . 0.0 109.537 -179.775 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 101' ' ' LEU . . . . . . . . . . . . . 50.5 tp -96.0 126.54 41.31 Favored 'General case' 0 N--CA 1.494 1.731 0 O-C-N 121.251 -0.906 . . . . 0.0 110.028 -179.452 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 102' ' ' GLU . . . . . . . . . . . . . 78.9 mm-40 -61.31 153.63 26.04 Favored 'General case' 0 N--CA 1.489 1.475 0 CA-C-O 122.021 0.915 . . . . 0.0 110.621 -179.7 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 103' ' ' HIS . . . . . . . . . . . . . 86.3 t60 -58.99 -42.25 89.59 Favored 'General case' 0 N--CA 1.489 1.522 0 O-C-N 121.637 -0.664 . . . . 0.0 110.051 -179.768 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 104' ' ' HIS . . . . . 0.405 ' O ' ' CG ' ' A' ' 104' ' ' HIS . 56.6 p-80 -86.13 121.05 28.19 Favored 'General case' 0 N--CA 1.492 1.673 0 O-C-N 121.118 -0.989 . . . . 0.0 110.355 -179.137 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 105' ' ' HIS . . . . . . . . . . . . . 56.7 t-80 -151.38 -75.93 0.14 Allowed 'General case' 0 N--CA 1.493 1.695 0 O-C-N 121.554 -0.716 . . . . 0.0 109.178 179.867 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 106' ' ' HIS . . . . . 0.429 ' CG ' ' N ' ' A' ' 107' ' ' HIS . 54.1 t-80 -153.16 164.36 38.19 Favored 'General case' 0 N--CA 1.494 1.77 0 O-C-N 121.167 -0.958 . . . . 0.0 109.997 179.904 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 107' ' ' HIS . . . . . 0.44 ' O ' ' O ' ' A' ' 108' ' ' HIS . 78.7 m80 -62.36 -41.29 98.5 Favored 'General case' 0 N--CA 1.495 1.788 0 O-C-N 121.512 -0.743 . . . . 0.0 110.008 -179.995 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 108' ' ' HIS . . . . . 0.44 ' O ' ' O ' ' A' ' 107' ' ' HIS . 86.4 t60 . . . . . 0 N--CA 1.494 1.729 0 CA-C-O 118.006 -0.997 . . . . 0.0 110.04 -179.463 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 96.8 mmm . . . . . 0 N--CA 1.49 1.565 0 CA-C-O 121.48 0.657 . . . . 0.0 109.801 . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 80.7 p -69.15 -16.48 63.65 Favored 'General case' 0 N--CA 1.489 1.488 0 O-C-N 121.492 -0.755 . . . . 0.0 109.556 -179.935 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 3' ' ' ASN . . . . . . . . . . . . . 98.9 m-20 -63.11 -40.88 98.92 Favored 'General case' 0 N--CA 1.49 1.566 0 O-C-N 121.365 -0.835 . . . . 0.0 109.551 -179.985 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 3.9 tm0? -155.27 101.85 2.24 Favored 'General case' 0 N--CA 1.492 1.641 0 O-C-N 121.219 -0.926 . . . . 0.0 109.012 179.673 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 35.2 m -66.71 133.85 51.03 Favored 'General case' 0 N--CA 1.489 1.481 0 O-C-N 121.479 -0.763 . . . . 0.0 110.453 -179.45 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 6' ' ' CYS . . . . . 0.456 ' O ' ' SG ' ' A' ' 6' ' ' CYS . 29.3 p -137.86 118.38 13.88 Favored 'General case' 0 N--CA 1.494 1.768 0 N-CA-C 108.793 -0.817 . . . . 0.0 108.793 179.495 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 7' ' ' VAL . . . . . . . . . . . . . 16.5 m -110.18 131.51 61.01 Favored 'Isoleucine or valine' 0 N--CA 1.499 2.01 0 O-C-N 121.504 -0.748 . . . . 0.0 109.808 -179.397 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 60.2 mp0 -62.0 136.1 57.82 Favored 'General case' 0 N--CA 1.489 1.475 0 O-C-N 121.626 -0.671 . . . . 0.0 109.712 -179.557 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 14.0 m120 -82.86 150.74 26.36 Favored 'General case' 0 N--CA 1.489 1.517 0 O-C-N 121.441 -0.787 . . . . 0.0 110.091 -179.46 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 10' ' ' GLU . . . . . 0.474 ' N ' ' CD ' ' A' ' 10' ' ' GLU . 0.9 OUTLIER -145.06 96.59 2.87 Favored 'General case' 0 N--CA 1.49 1.569 0 O-C-N 121.306 -0.871 . . . . 0.0 108.768 179.658 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 35.0 m -100.46 130.41 49.76 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.916 0 O-C-N 121.412 -0.805 . . . . 0.0 109.719 -179.663 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 17.1 p -148.31 32.32 0.81 Allowed 'General case' 0 N--CA 1.492 1.664 0 N-CA-C 108.381 -0.97 . . . . 0.0 108.381 179.908 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 79.5 mm-40 -68.83 148.17 50.67 Favored 'General case' 0 N--CA 1.49 1.561 0 O-C-N 121.559 -0.713 . . . . 0.0 110.302 -179.227 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -65.27 147.7 52.98 Favored 'General case' 0 N--CA 1.491 1.596 0 O-C-N 121.577 -0.702 . . . . 0.0 110.598 -179.546 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 7.5 t -60.58 -39.05 86.62 Favored 'General case' 0 N--CA 1.491 1.617 0 O-C-N 121.409 -0.807 . . . . 0.0 109.805 179.774 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 75.11 20.98 78.92 Favored Glycine 0 N--CA 1.49 2.285 0 N-CA-C 109.828 -1.309 . . . . 0.0 109.828 -179.941 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 41.0 m 52.48 52.7 13.62 Favored 'General case' 0 N--CA 1.492 1.626 0 O-C-N 121.235 -1.156 . . . . 0.0 109.675 -179.811 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . 40.97 -102.02 0.03 OUTLIER 'General case' 0 N--CA 1.493 1.704 0 CA-C-O 121.431 0.634 . . . . 0.0 110.78 179.423 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -70.23 148.44 45.81 Favored Glycine 0 N--CA 1.489 2.169 0 N-CA-C 110.626 -0.99 . . . . 0.0 110.626 -178.915 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 20' ' ' GLU . . . . . 0.542 ' O ' ' N ' ' A' ' 22' ' ' GLY . 53.6 tp10 -169.59 99.46 0.33 Allowed 'General case' 0 N--CA 1.488 1.429 0 O-C-N 121.57 -0.959 . . . . 0.0 108.886 179.011 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 21' ' ' ILE . . . . . . . . . . . . . 92.4 mt 48.77 -88.28 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.493 1.691 0 O-C-N 121.5 -0.75 . . . . 0.0 110.027 -179.946 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 22' ' ' GLY . . . . . 0.542 ' N ' ' O ' ' A' ' 20' ' ' GLU . . . 53.12 94.25 0.01 OUTLIER Glycine 0 N--CA 1.492 2.42 0 N-CA-C 110.006 -1.238 . . . . 0.0 110.006 -179.956 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 23' ' ' PHE . . . . . 0.529 ' O ' ' N ' ' A' ' 25' ' ' ILE . 82.5 m-85 -75.97 144.84 40.75 Favored 'General case' 0 N--CA 1.489 1.485 0 O-C-N 121.283 -1.128 . . . . 0.0 110.347 -179.788 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 97.5 mt 48.91 -87.6 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.49 1.536 0 O-C-N 121.891 -0.506 . . . . 0.0 110.076 179.853 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 25' ' ' ILE . . . . . 0.764 HD11 ' CD ' ' A' ' 65' ' ' GLU . 1.9 pt -77.51 141.08 16.05 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.347 0 C-N-CA 118.745 -1.182 . . . . 0.0 109.892 -178.547 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 17.9 ptp180 -91.74 157.1 17.11 Favored 'General case' 0 N--CA 1.496 1.851 0 CA-C-O 121.906 0.86 . . . . 0.0 110.981 179.001 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 96.7 mt-10 -63.81 153.88 35.24 Favored 'General case' 0 N--CA 1.495 1.806 0 CA-C-O 121.612 0.72 . . . . 0.0 110.841 -179.586 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 28' ' ' GLY . . . . . 0.407 ' O ' HG23 ' A' ' 31' ' ' VAL . . . 92.36 175.66 41.91 Favored Glycine 0 N--CA 1.492 2.377 0 N-CA-C 110.296 -1.122 . . . . 0.0 110.296 179.436 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 18.8 t0 72.45 64.62 0.12 Allowed 'General case' 0 N--CA 1.495 1.783 0 O-C-N 121.959 -0.73 . . . . 0.0 110.157 179.928 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 96.3 m-20 54.6 70.63 0.6 Allowed 'General case' 0 N--CA 1.493 1.702 0 O-C-N 121.674 -0.641 . . . . 0.0 109.688 179.438 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 31' ' ' VAL . . . . . 0.407 HG23 ' O ' ' A' ' 28' ' ' GLY . 49.9 t -120.24 135.63 59.88 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.773 0 N-CA-C 109.112 -0.699 . . . . 0.0 109.112 -179.829 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -118.48 147.91 43.13 Favored 'General case' 0 N--CA 1.492 1.63 0 N-CA-C 109.267 -0.642 . . . . 0.0 109.267 -179.79 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 97.3 mt-10 -105.49 133.92 49.46 Favored 'General case' 0 N--CA 1.492 1.67 0 O-C-N 121.593 -0.692 . . . . 0.0 109.519 -179.74 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 34' ' ' VAL . . . . . . . . . . . . . 48.6 t -123.06 133.44 69.06 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.734 0 N-CA-C 108.771 -0.826 . . . . 0.0 108.771 179.929 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 77.9 p -128.52 122.96 32.33 Favored 'General case' 0 N--CA 1.491 1.588 0 N-CA-C 108.719 -0.845 . . . . 0.0 108.719 -179.944 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 44.9 tp -117.81 132.58 56.43 Favored 'General case' 0 N--CA 1.496 1.858 0 N-CA-C 108.905 -0.776 . . . . 0.0 108.905 179.808 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 37' ' ' PHE . . . . . . . . . . . . . 91.2 t80 -112.98 132.33 55.4 Favored 'General case' 0 N--CA 1.493 1.688 0 O-C-N 121.676 -0.64 . . . . 0.0 109.287 -179.638 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 38' ' ' GLY . . . . . 0.405 ' N ' HD21 ' A' ' 44' ' ' LEU . . . -168.45 -162.79 21.24 Favored Glycine 0 N--CA 1.487 2.074 0 C-N-CA 119.693 -1.241 . . . . 0.0 110.164 -179.667 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 39' ' ' SER . . . . . 0.515 ' OG ' ' N ' ' A' ' 40' ' ' ASP . 30.0 t -62.65 -128.33 0.0 OUTLIER 'General case' 0 N--CA 1.49 1.55 0 O-C-N 121.667 -0.902 . . . . 0.0 110.766 -179.264 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 40' ' ' ASP . . . . . 0.515 ' N ' ' OG ' ' A' ' 39' ' ' SER . 98.5 m-20 -73.52 175.77 6.74 Favored 'General case' 0 N--CA 1.488 1.467 0 O-C-N 121.398 -0.814 . . . . 0.0 110.134 -179.197 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 88.5 tttt -63.18 -39.97 96.19 Favored 'General case' 0 C--N 1.305 -1.361 0 N-CA-C 109.05 -0.722 . . . . 0.0 109.05 179.512 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -54.81 -46.02 74.47 Favored 'General case' 0 N--CA 1.488 1.468 0 O-C-N 121.352 -0.843 . . . . 0.0 109.416 -179.944 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 43' ' ' HIS . . . . . . . . . . . . . 15.3 t-80 -61.24 -41.56 97.09 Favored 'General case' 0 C--N 1.303 -1.426 0 O-C-N 121.29 -0.881 . . . . 0.0 109.263 179.653 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 44' ' ' LEU . . . . . 0.405 HD21 ' N ' ' A' ' 38' ' ' GLY . 96.5 mt -64.41 -39.59 94.13 Favored 'General case' 0 N--CA 1.49 1.526 0 O-C-N 121.459 -0.776 . . . . 0.0 109.656 -179.929 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 97.2 mt-10 -59.39 -41.15 88.71 Favored 'General case' 0 N--CA 1.488 1.462 0 O-C-N 121.178 -0.951 . . . . 0.0 109.847 -179.69 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . -62.81 -46.72 93.04 Favored Glycine 0 N--CA 1.49 2.285 0 N-CA-C 109.162 -1.575 . . . . 0.0 109.162 179.75 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 25.6 mtpp -67.29 -33.12 74.63 Favored 'General case' 0 N--CA 1.488 1.46 0 O-C-N 121.505 -0.997 . . . . 0.0 109.356 179.224 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 44.0 tp -57.55 -38.33 74.57 Favored 'General case' 0 N--CA 1.488 1.467 0 O-C-N 121.518 -0.739 . . . . 0.0 109.399 -179.056 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 49' ' ' ALA . . . . . . . . . . . . . . . -52.15 -40.48 61.47 Favored 'General case' 0 C--N 1.302 -1.46 0 O-C-N 121.26 -0.9 . . . . 0.0 109.998 -179.682 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 75.9 mt-10 -68.01 -40.96 82.88 Favored 'General case' 0 N--CA 1.491 1.586 0 O-C-N 121.138 -0.977 . . . . 0.0 109.629 179.955 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 51' ' ' TYR . . . . . 0.471 ' OH ' ' N ' ' A' ' 99' ' ' ALA . 8.1 m-85 -61.98 -44.9 95.78 Favored 'General case' 0 N--CA 1.49 1.525 0 O-C-N 121.441 -0.787 . . . . 0.0 109.232 179.934 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 52' ' ' ILE . . . . . . . . . . . . . 96.0 mt -63.97 -43.19 97.6 Favored 'Isoleucine or valine' 0 C--N 1.303 -1.422 0 O-C-N 121.513 -0.742 . . . . 0.0 109.771 -179.816 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 79.9 p -59.49 -39.89 85.24 Favored 'General case' 0 N--CA 1.49 1.562 0 O-C-N 121.147 -0.971 . . . . 0.0 110.028 -179.193 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 54' ' ' LEU . . . . . . . . . . . . . 95.0 mt -63.26 -41.84 99.09 Favored 'General case' 0 N--CA 1.489 1.478 0 O-C-N 121.154 -0.967 . . . . 0.0 109.122 179.8 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 55' ' ' ALA . . . . . 0.417 ' HB2' ' CE1' ' A' ' 91' ' ' PHE . . . -64.11 -41.5 97.23 Favored 'General case' 0 N--CA 1.488 1.437 0 O-C-N 121.42 -0.8 . . . . 0.0 109.502 179.911 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 56' ' ' LYS . . . . . . . . . . . . . 56.5 mtpt -65.37 -43.7 89.95 Favored 'General case' 0 N--CA 1.489 1.514 0 O-C-N 121.377 -0.827 . . . . 0.0 109.461 179.728 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 60.7 tt0 -67.34 -43.76 80.73 Favored 'General case' 0 N--CA 1.488 1.456 0 O-C-N 121.408 -0.807 . . . . 0.0 109.377 -179.762 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 58' ' ' VAL . . . . . 0.475 ' CG1' ' OE1' ' A' ' 87' ' ' GLU . 53.6 t -64.63 -45.61 94.88 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.405 0 O-C-N 121.461 -0.774 . . . . 0.0 109.523 179.999 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 59' ' ' TYR . . . . . . . . . . . . . 56.6 t80 -131.98 123.27 27.01 Favored 'General case' 0 N--CA 1.497 1.902 0 O-C-N 121.479 -0.763 . . . . 0.0 109.619 -179.536 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -70.51 144.44 51.36 Favored 'General case' 0 N--CA 1.491 1.612 0 O-C-N 121.544 -0.722 . . . . 0.0 110.898 -179.436 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 61' ' ' ASN . . . . . . . . . . . . . 11.2 t-20 57.94 40.96 25.21 Favored 'General case' 0 N--CA 1.491 1.591 0 O-C-N 121.525 -0.734 . . . . 0.0 109.115 179.594 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 62' ' ' VAL . . . . . . . . . . . . . 11.5 p -75.98 132.32 33.32 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.501 0 O-C-N 121.595 -0.691 . . . . 0.0 110.046 -179.718 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 97.4 mt-10 -90.91 150.74 21.39 Favored 'General case' 0 N--CA 1.492 1.652 0 O-C-N 121.437 -0.789 . . . . 0.0 109.638 -179.89 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 64' ' ' TYR . . . . . 0.45 ' C ' ' OE1' ' A' ' 65' ' ' GLU . 53.9 p90 -156.4 164.07 38.72 Favored 'General case' 0 N--CA 1.49 1.544 0 O-C-N 121.175 -0.953 . . . . 0.0 110.207 -179.729 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 65' ' ' GLU . . . . . 0.764 ' CD ' HD11 ' A' ' 25' ' ' ILE . 1.8 pm0 -152.61 156.64 39.67 Favored 'General case' 0 N--CA 1.49 1.529 0 N-CA-C 108.634 -0.876 . . . . 0.0 108.634 -179.465 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 66' ' ' VAL . . . . . . . . . . . . . 2.6 p -123.19 129.57 74.85 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.86 0 CA-C-O 121.533 0.683 . . . . 0.0 109.465 -179.82 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 67' ' ' ALA . . . . . 0.467 ' HB1' ' HD2' ' A' ' 68' ' ' PRO . . . -75.96 160.68 77.99 Favored Pre-proline 0 N--CA 1.488 1.469 0 O-C-N 121.607 -0.683 . . . . 0.0 109.333 -179.78 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 68' ' ' PRO . . . . . 0.467 ' HD2' ' HB1' ' A' ' 67' ' ' ALA . 21.4 Cg_endo -59.76 111.83 1.08 Allowed 'Trans proline' 0 N--CA 1.495 1.61 0 C-N-CA 122.831 2.354 . . . . 0.0 111.738 179.905 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 69' ' ' VAL . . . . . . . . . . . . . 56.0 t -124.66 134.61 66.35 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.917 0 N-CA-C 109.136 -0.69 . . . . 0.0 109.136 179.987 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -67.02 149.83 50.08 Favored 'General case' 0 C--N 1.304 -1.41 0 O-C-N 121.527 -0.733 . . . . 0.0 110.27 -179.625 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 71' ' ' ASP . . . . . 0.547 ' OD1' ' N ' ' A' ' 72' ' ' ASN . 48.2 p-10 -64.75 -29.51 70.49 Favored 'General case' 0 N--CA 1.488 1.456 0 O-C-N 121.565 -0.709 . . . . 0.0 109.566 179.797 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 72' ' ' ASN . . . . . 0.547 ' N ' ' OD1' ' A' ' 71' ' ' ASP . 10.7 m120 -90.27 8.28 34.04 Favored 'General case' 0 N--CA 1.49 1.548 0 O-C-N 121.299 -0.876 . . . . 0.0 108.959 -179.942 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -68.76 148.75 49.88 Favored 'General case' 0 N--CA 1.49 1.564 0 O-C-N 121.506 -0.746 . . . . 0.0 110.464 -179.613 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 74' ' ' THR . . . . . . . . . . . . . 12.7 p -100.27 3.71 43.68 Favored 'General case' 0 N--CA 1.494 1.764 0 O-C-N 121.451 -0.78 . . . . 0.0 109.471 179.821 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 22.2 pt-20 -142.28 160.96 39.22 Favored 'General case' 0 N--CA 1.495 1.819 0 O-C-N 121.137 -0.977 . . . . 0.0 109.55 179.796 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 9.9 tp -127.55 135.03 49.76 Favored 'General case' 0 N--CA 1.493 1.717 0 O-C-N 121.636 -0.665 . . . . 0.0 109.285 -179.88 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 77' ' ' HIS . . . . . . . . . . . . . 75.1 m80 -108.4 128.63 54.94 Favored 'General case' 0 N--CA 1.494 1.768 0 N-CA-C 109.16 -0.681 . . . . 0.0 109.16 179.699 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -151.79 154.57 36.49 Favored 'General case' 0 N--CA 1.489 1.506 0 O-C-N 121.258 -0.901 . . . . 0.0 109.369 179.992 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 79' ' ' ARG . . . . . 0.455 ' O ' ' OE2' ' A' ' 65' ' ' GLU . 84.5 mtt85 -128.74 150.43 50.28 Favored 'General case' 0 N--CA 1.493 1.724 0 N-CA-C 109.311 -0.626 . . . . 0.0 109.311 -179.834 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 80' ' ' PHE . . . . . . . . . . . . . 83.1 m-85 -130.58 147.75 52.3 Favored 'General case' 0 N--CA 1.494 1.774 0 O-C-N 121.609 -0.682 . . . . 0.0 109.22 -179.742 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 49.5 mttm -113.67 139.05 49.38 Favored 'General case' 0 N--CA 1.495 1.819 0 N-CA-C 109.173 -0.676 . . . . 0.0 109.173 179.833 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 82' ' ' PHE . . . . . . . . . . . . . 79.2 m-85 -133.19 158.8 41.95 Favored 'General case' 0 N--CA 1.495 1.786 0 CA-C-O 121.496 0.665 . . . . 0.0 109.872 -179.582 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 81.7 tt0 -65.52 -37.66 87.42 Favored 'General case' 0 C--N 1.303 -1.423 0 O-C-N 121.543 -0.723 . . . . 0.0 109.559 179.953 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 84' ' ' VAL . . . . . . . . . . . . . 35.7 m -136.08 159.56 38.89 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.961 0 O-C-N 121.378 -0.826 . . . . 0.0 110.282 -179.549 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 85' ' ' SER . . . . . 0.509 ' O ' ' N ' ' A' ' 88' ' ' LYS . 38.6 t -64.77 -38.95 92.71 Favored 'General case' 0 N--CA 1.49 1.556 0 O-C-N 121.791 -0.568 . . . . 0.0 110.191 -179.946 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 86' ' ' ALA . . . . . . . . . . . . . . . -40.8 -39.46 1.12 Allowed 'General case' 0 N--CA 1.494 1.767 0 O-C-N 121.607 -0.683 . . . . 0.0 110.24 -179.353 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 87' ' ' GLU . . . . . 0.475 ' OE1' ' CG1' ' A' ' 58' ' ' VAL . 79.5 mm-40 -66.02 -34.03 77.16 Favored 'General case' 0 N--CA 1.488 1.432 0 O-C-N 121.508 -0.745 . . . . 0.0 109.477 179.751 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 88' ' ' LYS . . . . . 0.509 ' N ' ' O ' ' A' ' 85' ' ' SER . 88.5 tttt -62.15 -44.9 95.61 Favored 'General case' 0 N--CA 1.489 1.509 0 O-C-N 121.297 -0.877 . . . . 0.0 109.936 -179.988 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 50.7 tp -62.56 -50.35 71.68 Favored 'General case' 0 N--CA 1.489 1.483 0 O-C-N 121.271 -0.893 . . . . 0.0 110.234 -178.905 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 90' ' ' ILE . . . . . 0.543 ' N ' HD12 ' A' ' 90' ' ' ILE . 1.4 mp -69.27 -45.42 79.27 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.567 0 O-C-N 121.302 -0.874 . . . . 0.0 109.853 -179.684 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 91' ' ' PHE . . . . . 0.417 ' CE1' ' HB2' ' A' ' 55' ' ' ALA . 69.7 t80 -62.59 -44.66 95.76 Favored 'General case' 0 N--CA 1.489 1.51 0 O-C-N 121.388 -0.82 . . . . 0.0 110.168 -179.551 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 92' ' ' GLU . . . . . 0.515 ' OE2' ' NH2' ' A' ' 96' ' ' ARG . 83.0 tt0 -62.36 -38.74 90.71 Favored 'General case' 0 C--N 1.305 -1.369 0 O-C-N 121.358 -0.839 . . . . 0.0 109.95 -179.36 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 93' ' ' LEU . . . . . . . . . . . . . 39.3 mt -63.2 -44.4 95.43 Favored 'General case' 0 N--CA 1.49 1.55 0 O-C-N 121.209 -0.932 . . . . 0.0 109.97 -179.574 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 94' ' ' LYS . . . . . . . . . . . . . 60.9 mttp -66.32 -44.15 84.19 Favored 'General case' 0 N--CA 1.488 1.467 0 O-C-N 121.183 -0.948 . . . . 0.0 110.128 -179.993 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 34.3 p -68.31 -35.82 78.39 Favored 'General case' 0 N--CA 1.487 1.423 0 O-C-N 121.338 -0.851 . . . . 0.0 109.714 -179.654 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 96' ' ' ARG . . . . . 0.515 ' NH2' ' OE2' ' A' ' 92' ' ' GLU . 19.3 tpp180 -68.08 -39.53 82.91 Favored 'General case' 0 N--CA 1.488 1.467 0 O-C-N 121.197 -0.94 . . . . 0.0 108.773 179.608 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 97' ' ' ALA . . . . . . . . . . . . . . . -56.59 -48.04 78.27 Favored 'General case' 0 N--CA 1.486 1.372 0 O-C-N 121.337 -0.852 . . . . 0.0 109.097 179.935 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 98' ' ' LEU . . . . . . . . . . . . . 91.7 mt -63.94 -41.43 97.61 Favored 'General case' 0 N--CA 1.486 1.366 0 O-C-N 121.487 -0.758 . . . . 0.0 109.436 179.559 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 99' ' ' ALA . . . . . 0.471 ' N ' ' OH ' ' A' ' 51' ' ' TYR . . . -64.49 -32.42 74.04 Favored 'General case' 0 N--CA 1.489 1.479 0 O-C-N 121.471 -0.768 . . . . 0.0 109.875 -179.837 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 100' ' ' ARG . . . . . . . . . . . . . 5.9 mmp_? -88.96 1.51 55.35 Favored 'General case' 0 N--CA 1.491 1.6 0 O-C-N 121.243 -0.911 . . . . 0.0 109.089 -179.978 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 101' ' ' LEU . . . . . . . . . . . . . 57.2 tp -63.28 -42.72 99.14 Favored 'General case' 0 C--N 1.304 -1.404 0 O-C-N 121.51 -0.744 . . . . 0.0 109.662 -179.912 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 102' ' ' GLU . . . . . . . . . . . . . 99.0 mt-10 -96.35 120.7 37.14 Favored 'General case' 0 N--CA 1.495 1.778 0 O-C-N 121.216 -0.928 . . . . 0.0 109.787 -179.484 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 103' ' ' HIS . . . . . . . . . . . . . 82.6 t60 -99.41 68.89 1.64 Allowed 'General case' 0 N--CA 1.494 1.761 0 O-C-N 121.468 -0.77 . . . . 0.0 109.73 -179.752 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 104' ' ' HIS . . . . . 0.439 ' O ' ' O ' ' A' ' 105' ' ' HIS . 73.6 m-70 -88.3 -13.69 40.18 Favored 'General case' 0 N--CA 1.49 1.552 0 N-CA-C 108.837 -0.801 . . . . 0.0 108.837 179.413 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 105' ' ' HIS . . . . . 0.439 ' O ' ' O ' ' A' ' 104' ' ' HIS . 86.6 t60 56.59 154.97 0.01 OUTLIER 'General case' 0 N--CA 1.493 1.722 0 CA-C-O 121.597 0.713 . . . . 0.0 110.705 179.285 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 106' ' ' HIS . . . . . . . . . . . . . 76.1 m80 -78.22 132.36 37.52 Favored 'General case' 0 N--CA 1.491 1.601 0 O-C-N 121.504 -0.747 . . . . 0.0 110.445 -179.28 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 107' ' ' HIS . . . . . . . . . . . . . 58.9 t-80 -66.6 -42.57 86.7 Favored 'General case' 0 N--CA 1.489 1.495 0 O-C-N 121.525 -0.734 . . . . 0.0 109.168 179.485 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 108' ' ' HIS . . . . . 0.479 ' CG ' ' O ' ' A' ' 108' ' ' HIS . 81.9 t60 . . . . . 0 N--CA 1.489 1.49 0 CA-C-O 118.016 -0.992 . . . . 0.0 109.86 -179.975 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 97.4 mmm . . . . . 0 N--CA 1.489 1.505 0 N-CA-C 109.073 -0.714 . . . . 0.0 109.073 . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 28.0 t -65.19 141.55 58.63 Favored 'General case' 0 N--CA 1.489 1.483 0 O-C-N 121.452 -0.78 . . . . 0.0 110.191 -179.425 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 3' ' ' ASN . . . . . 0.416 ' OD1' ' N ' ' A' ' 4' ' ' GLN . 48.4 p30 -70.01 -14.1 62.53 Favored 'General case' 0 N--CA 1.49 1.553 0 O-C-N 121.451 -0.781 . . . . 0.0 109.52 179.816 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 4' ' ' GLN . . . . . 0.416 ' N ' ' OD1' ' A' ' 3' ' ' ASN . 65.6 tp60 -160.55 90.74 0.88 Allowed 'General case' 0 N--CA 1.49 1.571 0 O-C-N 121.054 -1.029 . . . . 0.0 108.989 179.65 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 27.6 m -64.55 135.17 55.72 Favored 'General case' 0 N--CA 1.491 1.597 0 O-C-N 121.344 -0.847 . . . . 0.0 110.007 -179.383 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 37.2 m -93.9 133.85 36.89 Favored 'General case' 0 N--CA 1.495 1.789 0 O-C-N 121.227 -0.921 . . . . 0.0 110.116 -179.581 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 7' ' ' VAL . . . . . . . . . . . . . 7.1 p -147.89 -28.8 0.1 Allowed 'Isoleucine or valine' 0 N--CA 1.494 1.767 0 N-CA-C 108.493 -0.929 . . . . 0.0 108.493 179.406 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 83.2 tt0 -163.18 121.65 2.03 Favored 'General case' 0 N--CA 1.489 1.516 0 O-C-N 121.466 -0.771 . . . . 0.0 109.736 179.675 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 99.0 m-20 -64.3 -39.1 93.24 Favored 'General case' 0 N--CA 1.49 1.528 0 O-C-N 121.456 -0.777 . . . . 0.0 109.653 179.661 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 31.1 tp10 -51.76 150.53 3.94 Favored 'General case' 0 N--CA 1.493 1.705 0 O-C-N 121.387 -0.821 . . . . 0.0 110.488 -178.894 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 4.3 t 61.98 86.23 0.05 OUTLIER 'Isoleucine or valine' 0 N--CA 1.496 1.831 0 O-C-N 121.702 -0.624 . . . . 0.0 109.784 -179.963 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 8.8 t -102.47 -173.64 2.38 Favored 'General case' 0 N--CA 1.496 1.844 0 O-C-N 121.483 -0.761 . . . . 0.0 109.867 -179.863 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 97.8 mt-10 -80.09 3.85 19.09 Favored 'General case' 0 N--CA 1.489 1.487 0 O-C-N 121.434 -0.791 . . . . 0.0 109.225 179.634 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -74.84 -6.32 48.4 Favored 'General case' 0 N--CA 1.489 1.523 0 O-C-N 121.516 -0.74 . . . . 0.0 109.398 179.917 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 92.8 m -63.5 -36.57 84.22 Favored 'General case' 0 C--N 1.305 -1.359 0 O-C-N 121.337 -0.852 . . . . 0.0 108.923 179.631 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 108.46 -142.28 15.99 Favored Glycine 0 N--CA 1.5 2.901 0 N-CA-C 109.082 -1.607 . . . . 0.0 109.082 179.941 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 18.6 t -72.64 129.84 39.19 Favored 'General case' 0 C--N 1.301 -1.508 0 N-CA-C 106.58 -1.637 . . . . 0.0 106.58 178.743 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -73.87 135.52 43.36 Favored 'General case' 0 N--CA 1.496 1.825 0 C-N-CA 118.645 -1.222 . . . . 0.0 111.058 -176.976 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -90.65 108.43 3.56 Favored Glycine 0 N--CA 1.491 2.357 0 N-CA-C 109.691 -1.364 . . . . 0.0 109.691 179.546 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 22.3 pt-20 -85.93 17.38 3.51 Favored 'General case' 0 N--CA 1.49 1.57 0 O-C-N 121.351 -1.087 . . . . 0.0 109.089 179.538 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 21' ' ' ILE . . . . . 0.473 ' O ' ' N ' ' A' ' 23' ' ' PHE . 38.3 pt -80.95 14.43 0.44 Allowed 'Isoleucine or valine' 0 N--CA 1.489 1.519 0 O-C-N 121.469 -0.769 . . . . 0.0 109.332 179.921 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . -42.18 94.51 0.01 OUTLIER Glycine 0 N--CA 1.493 2.482 0 N-CA-C 110.491 -1.043 . . . . 0.0 110.491 -179.406 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 23' ' ' PHE . . . . . 0.473 ' N ' ' O ' ' A' ' 21' ' ' ILE . 0.1 OUTLIER -153.35 -141.16 0.1 Allowed 'General case' 0 N--CA 1.495 1.78 0 O-C-N 121.029 -1.277 . . . . 0.0 109.829 179.756 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 96.6 mt -59.81 139.84 18.8 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.444 0 O-C-N 121.433 -0.792 . . . . 0.0 110.224 -179.184 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 25' ' ' ILE . . . . . . . . . . . . . 97.1 mt -64.32 137.27 25.16 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.521 0 O-C-N 121.561 -0.712 . . . . 0.0 110.367 -179.086 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 63.3 ttm-85 -59.29 143.26 49.86 Favored 'General case' 0 N--CA 1.494 1.757 0 CA-C-O 121.61 0.719 . . . . 0.0 110.466 -179.253 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 96.7 mt-10 -58.56 131.14 49.91 Favored 'General case' 0 N--CA 1.491 1.621 0 O-C-N 121.603 -0.685 . . . . 0.0 110.408 -179.673 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 28' ' ' GLY . . . . . 0.424 ' O ' ' O ' ' A' ' 29' ' ' ASP . . . 177.64 173.2 42.91 Favored Glycine 0 N--CA 1.492 2.387 0 N-CA-C 109.511 -1.435 . . . . 0.0 109.511 179.683 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 29' ' ' ASP . . . . . 0.424 ' O ' ' O ' ' A' ' 28' ' ' GLY . 98.9 m-20 45.02 -172.38 0.01 OUTLIER 'General case' 0 N--CA 1.496 1.852 0 O-C-N 121.46 -1.024 . . . . 0.0 111.0 179.452 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 99.6 m-20 -82.74 88.43 6.74 Favored 'General case' 0 N--CA 1.49 1.543 0 O-C-N 121.602 -0.686 . . . . 0.0 109.44 -179.468 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 31' ' ' VAL . . . . . 0.443 HG22 ' N ' ' A' ' 32' ' ' ALA . 9.2 p -86.16 161.34 2.98 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.635 0 O-C-N 121.34 -0.85 . . . . 0.0 109.608 -179.67 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 32' ' ' ALA . . . . . 0.443 ' N ' HG22 ' A' ' 31' ' ' VAL . . . -143.61 139.42 29.63 Favored 'General case' 0 N--CA 1.493 1.721 0 O-C-N 121.294 -0.879 . . . . 0.0 109.016 179.835 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 83.7 tt0 -101.38 142.75 32.33 Favored 'General case' 0 N--CA 1.494 1.755 0 O-C-N 121.403 -0.81 . . . . 0.0 109.132 179.989 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 34' ' ' VAL . . . . . . . . . . . . . 52.4 t -122.54 131.56 72.97 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.905 0 N-CA-C 108.905 -0.776 . . . . 0.0 108.905 179.812 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 35.3 m -111.17 123.41 50.15 Favored 'General case' 0 N--CA 1.494 1.735 0 N-CA-C 108.658 -0.867 . . . . 0.0 108.658 179.904 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 26.3 mt -119.23 149.41 41.81 Favored 'General case' 0 N--CA 1.497 1.887 0 O-C-N 121.501 -0.75 . . . . 0.0 109.649 -179.436 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 37' ' ' PHE . . . . . . . . . . . . . 97.0 m-85 -128.74 147.36 50.76 Favored 'General case' 0 N--CA 1.493 1.717 0 N-CA-C 109.083 -0.71 . . . . 0.0 109.083 -179.405 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . -177.79 -177.65 46.75 Favored Glycine 0 N--CA 1.487 2.091 0 N-CA-C 109.474 -1.45 . . . . 0.0 109.474 -179.865 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 8.7 p -87.48 -81.64 0.23 Allowed 'General case' 0 N--CA 1.489 1.498 0 O-C-N 121.387 -1.066 . . . . 0.0 109.824 -179.911 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 40' ' ' ASP . . . . . . . . . . . . . 52.4 p30 -87.78 168.51 12.89 Favored 'General case' 0 N--CA 1.493 1.724 0 O-C-N 121.464 -0.772 . . . . 0.0 110.399 -179.445 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 88.6 tttt -65.93 -36.63 83.9 Favored 'General case' 0 N--CA 1.49 1.555 0 O-C-N 121.674 -0.641 . . . . 0.0 110.188 179.883 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -57.64 -41.62 81.76 Favored 'General case' 0 N--CA 1.492 1.629 0 O-C-N 121.272 -0.893 . . . . 0.0 110.155 -179.106 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 43' ' ' HIS . . . . . . . . . . . . . 80.0 t60 -63.39 -42.13 98.79 Favored 'General case' 0 N--CA 1.489 1.516 0 O-C-N 121.169 -0.957 . . . . 0.0 109.42 -179.788 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 95.3 mt -63.47 -40.54 97.39 Favored 'General case' 0 N--CA 1.489 1.514 0 O-C-N 121.399 -0.813 . . . . 0.0 109.827 -179.671 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 74.5 mt-10 -62.75 -39.68 94.9 Favored 'General case' 0 N--CA 1.488 1.437 0 O-C-N 121.239 -0.913 . . . . 0.0 109.759 -179.639 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . -65.01 -45.17 93.1 Favored Glycine 0 N--CA 1.49 2.287 0 N-CA-C 109.671 -1.372 . . . . 0.0 109.671 -179.844 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 16.9 tptm -64.95 -36.03 83.07 Favored 'General case' 0 N--CA 1.489 1.509 0 O-C-N 121.27 -1.135 . . . . 0.0 109.236 179.882 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 60.8 tp -61.73 -39.5 91.74 Favored 'General case' 0 N--CA 1.488 1.451 0 O-C-N 121.339 -0.851 . . . . 0.0 109.345 -179.707 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 49' ' ' ALA . . . . . . . . . . . . . . . -54.03 -34.01 58.81 Favored 'General case' 0 N--CA 1.488 1.468 0 O-C-N 121.336 -0.852 . . . . 0.0 109.823 -179.627 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 79.3 mm-40 -65.31 -41.04 94.46 Favored 'General case' 0 N--CA 1.491 1.599 0 O-C-N 121.226 -0.921 . . . . 0.0 109.713 -179.981 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 10.8 m-85 -60.78 -39.67 89.72 Favored 'General case' 0 N--CA 1.491 1.581 0 O-C-N 121.487 -0.758 . . . . 0.0 109.552 -179.631 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 52' ' ' ILE . . . . . 0.522 HD12 ' CE1' ' A' ' 64' ' ' TYR . 34.1 mm -63.59 -43.51 98.25 Favored 'Isoleucine or valine' 0 C--N 1.301 -1.536 0 O-C-N 121.39 -0.819 . . . . 0.0 109.491 -179.484 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 53' ' ' SER . . . . . 0.481 ' O ' ' NE2' ' A' ' 57' ' ' GLN . 71.1 m -60.32 -51.7 68.4 Favored 'General case' 0 N--CA 1.492 1.674 0 O-C-N 121.081 -1.012 . . . . 0.0 110.136 -179.488 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 54' ' ' LEU . . . . . 0.444 ' N ' HD12 ' A' ' 54' ' ' LEU . 10.4 mp -65.07 -41.68 94.86 Favored 'General case' 0 N--CA 1.491 1.587 0 O-C-N 121.166 -0.958 . . . . 0.0 109.418 179.785 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -64.67 -39.38 93.57 Favored 'General case' 0 N--CA 1.488 1.428 0 O-C-N 121.282 -0.886 . . . . 0.0 109.731 -179.692 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 56' ' ' LYS . . . . . . . . . . . . . 50.9 tttp -64.08 -45.17 89.91 Favored 'General case' 0 C--N 1.305 -1.36 0 O-C-N 121.237 -0.915 . . . . 0.0 109.393 -179.94 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 57' ' ' GLN . . . . . 0.534 ' OE1' ' N ' ' A' ' 57' ' ' GLN . 0.8 OUTLIER -65.73 -43.78 87.99 Favored 'General case' 0 N--CA 1.488 1.439 0 O-C-N 121.418 -0.801 . . . . 0.0 109.508 -179.853 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 58' ' ' VAL . . . . . . . . . . . . . 56.0 t -63.35 -45.81 97.14 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.39 0 O-C-N 121.25 -0.906 . . . . 0.0 109.453 -179.801 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 59' ' ' TYR . . . . . . . . . . . . . 71.4 t80 -137.79 119.11 14.65 Favored 'General case' 0 N--CA 1.494 1.752 0 O-C-N 121.334 -0.854 . . . . 0.0 109.578 -179.502 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -69.75 153.53 43.24 Favored 'General case' 0 N--CA 1.493 1.682 0 O-C-N 121.563 -0.71 . . . . 0.0 110.538 -179.486 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 61' ' ' ASN . . . . . . . . . . . . . 98.2 m-20 57.73 36.44 26.57 Favored 'General case' 0 N--CA 1.494 1.746 0 O-C-N 121.752 -0.592 . . . . 0.0 109.671 179.897 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 62' ' ' VAL . . . . . . . . . . . . . 12.3 p -72.65 138.45 21.44 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.583 0 O-C-N 121.436 -0.79 . . . . 0.0 109.858 179.933 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 83.1 tt0 -115.61 142.19 47.07 Favored 'General case' 0 N--CA 1.497 1.921 0 O-C-N 121.571 -0.705 . . . . 0.0 109.313 -179.878 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 64' ' ' TYR . . . . . 0.522 ' CE1' HD12 ' A' ' 52' ' ' ILE . 51.4 p90 -148.29 161.27 41.86 Favored 'General case' 0 N--CA 1.493 1.709 0 O-C-N 121.365 -0.834 . . . . 0.0 109.539 -179.866 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 51.1 tp10 -141.0 147.76 39.21 Favored 'General case' 0 N--CA 1.495 1.799 0 N-CA-C 108.687 -0.857 . . . . 0.0 108.687 179.911 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 66' ' ' VAL . . . . . . . . . . . . . 28.8 m -117.82 129.08 74.77 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.805 0 CA-C-O 121.688 0.756 . . . . 0.0 109.953 -179.472 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 67' ' ' ALA . . . . . 0.625 ' HB1' ' HD2' ' A' ' 68' ' ' PRO . . . -70.65 171.81 7.44 Favored Pre-proline 0 N--CA 1.49 1.558 0 O-C-N 121.657 -0.652 . . . . 0.0 109.61 -179.417 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 68' ' ' PRO . . . . . 0.625 ' HD2' ' HB1' ' A' ' 67' ' ' ALA . 73.2 Cg_exo -50.86 129.89 29.2 Favored 'Trans proline' 0 N--CA 1.497 1.7 0 C-N-CA 122.355 2.037 . . . . 0.0 112.399 179.891 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 69' ' ' VAL . . . . . . . . . . . . . 54.4 t -131.04 134.42 61.53 Favored 'Isoleucine or valine' 0 N--CA 1.499 2.016 0 O-C-N 121.455 -0.778 . . . . 0.0 109.247 179.814 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -83.36 159.73 21.78 Favored 'General case' 0 N--CA 1.491 1.577 0 O-C-N 121.434 -0.792 . . . . 0.0 109.897 -179.913 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 53.3 t0 -64.12 -36.08 82.85 Favored 'General case' 0 N--CA 1.491 1.604 0 O-C-N 121.5 -0.75 . . . . 0.0 109.662 179.562 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 72' ' ' ASN . . . . . . . . . . . . . 55.7 p30 -96.67 17.33 16.69 Favored 'General case' 0 N--CA 1.495 1.778 0 O-C-N 121.235 -0.916 . . . . 0.0 109.237 -179.726 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -61.88 144.23 55.23 Favored 'General case' 0 N--CA 1.492 1.64 0 O-C-N 121.414 -0.804 . . . . 0.0 110.167 -179.641 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 74' ' ' THR . . . . . . . . . . . . . 71.8 p -101.79 -3.07 28.69 Favored 'General case' 0 N--CA 1.496 1.826 0 O-C-N 121.48 -0.763 . . . . 0.0 109.467 179.703 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 17.0 pt-20 -148.62 158.69 44.31 Favored 'General case' 0 N--CA 1.494 1.744 0 O-C-N 121.145 -0.972 . . . . 0.0 109.361 179.624 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 5.7 tt -131.7 134.52 46.0 Favored 'General case' 0 N--CA 1.496 1.829 0 O-C-N 121.521 -0.737 . . . . 0.0 109.237 -179.981 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 77' ' ' HIS . . . . . . . . . . . . . 98.2 m-70 -103.28 130.59 50.58 Favored 'General case' 0 N--CA 1.494 1.738 0 N-CA-C 109.255 -0.646 . . . . 0.0 109.255 -179.642 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -142.53 155.01 44.98 Favored 'General case' 0 N--CA 1.494 1.725 0 O-C-N 121.286 -0.884 . . . . 0.0 109.517 -179.726 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 83.9 mtp180 -127.95 148.11 50.5 Favored 'General case' 0 N--CA 1.494 1.745 0 N-CA-C 108.957 -0.757 . . . . 0.0 108.957 -179.86 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 80' ' ' PHE . . . . . . . . . . . . . 62.4 m-85 -129.33 147.83 51.2 Favored 'General case' 0 N--CA 1.496 1.862 0 O-C-N 121.555 -0.716 . . . . 0.0 109.285 -179.572 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 70.9 mmtt -112.6 104.1 12.18 Favored 'General case' 0 N--CA 1.496 1.827 0 N-CA-C 108.79 -0.818 . . . . 0.0 108.79 -179.996 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 82' ' ' PHE . . . . . . . . . . . . . 68.1 m-85 -98.91 148.92 23.47 Favored 'General case' 0 N--CA 1.492 1.636 0 O-C-N 121.591 -0.693 . . . . 0.0 109.871 -179.263 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 82.9 tt0 -65.4 -36.82 85.13 Favored 'General case' 0 N--CA 1.488 1.431 0 O-C-N 121.48 -0.762 . . . . 0.0 109.904 -179.648 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 84' ' ' VAL . . . . . . . . . . . . . 27.4 m -133.49 156.86 42.13 Favored 'Isoleucine or valine' 0 N--CA 1.499 2.021 0 O-C-N 121.333 -0.854 . . . . 0.0 110.073 -179.582 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 27.1 t -70.15 -17.43 63.18 Favored 'General case' 0 N--CA 1.488 1.443 0 O-C-N 121.573 -0.704 . . . . 0.0 109.529 179.899 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 86' ' ' ALA . . . . . . . . . . . . . . . -62.43 -41.17 98.52 Favored 'General case' 0 N--CA 1.49 1.528 0 O-C-N 121.256 -0.902 . . . . 0.0 109.537 -179.722 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 98.9 mt-10 -65.59 -33.51 76.07 Favored 'General case' 0 C--N 1.302 -1.475 0 O-C-N 121.458 -0.776 . . . . 0.0 109.024 179.642 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 88' ' ' LYS . . . . . . . . . . . . . 88.2 tttt -62.98 -43.96 97.36 Favored 'General case' 0 C--N 1.303 -1.433 0 O-C-N 121.449 -0.782 . . . . 0.0 109.979 179.836 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 96.3 mt -62.42 -48.11 81.13 Favored 'General case' 0 N--CA 1.488 1.427 0 O-C-N 121.193 -0.942 . . . . 0.0 109.884 -179.04 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 90' ' ' ILE . . . . . 0.53 ' N ' HD12 ' A' ' 90' ' ' ILE . 1.4 mp -70.58 -44.44 76.8 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.599 0 O-C-N 121.3 -0.875 . . . . 0.0 109.312 179.639 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 91' ' ' PHE . . . . . 0.456 ' O ' HG23 ' A' ' 95' ' ' THR . 70.6 t80 -59.13 -44.56 92.03 Favored 'General case' 0 C--N 1.299 -1.606 0 O-C-N 121.461 -0.774 . . . . 0.0 109.883 -179.196 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 92' ' ' GLU . . . . . . . . . . . . . 42.8 tp10 -63.18 -59.09 5.22 Favored 'General case' 0 N--CA 1.49 1.527 0 O-C-N 121.26 -0.9 . . . . 0.0 110.3 -179.322 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 93' ' ' LEU . . . . . 0.445 ' N ' HD12 ' A' ' 93' ' ' LEU . 8.8 mp -63.1 -42.67 99.63 Favored 'General case' 0 N--CA 1.492 1.65 0 O-C-N 121.315 -0.866 . . . . 0.0 109.954 -179.347 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 94' ' ' LYS . . . . . . . . . . . . . 64.2 tttp -62.86 -45.29 93.27 Favored 'General case' 0 C--N 1.301 -1.505 0 O-C-N 121.298 -0.876 . . . . 0.0 109.834 -179.682 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 95' ' ' THR . . . . . 0.456 HG23 ' O ' ' A' ' 91' ' ' PHE . 22.0 p -65.97 -43.03 89.08 Favored 'General case' 0 N--CA 1.488 1.452 0 O-C-N 121.117 -0.989 . . . . 0.0 109.354 179.709 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 96' ' ' ARG . . . . . . . . . . . . . 93.0 mtt-85 -64.35 -38.51 91.29 Favored 'General case' 0 N--CA 1.487 1.381 0 O-C-N 121.278 -0.889 . . . . 0.0 109.02 179.36 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 97' ' ' ALA . . . . . . . . . . . . . . . -63.01 -39.89 96.11 Favored 'General case' 0 C--N 1.304 -1.388 0 O-C-N 121.537 -0.727 . . . . 0.0 109.182 179.756 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 98' ' ' LEU . . . . . . . . . . . . . 6.3 tt -63.46 -45.84 88.97 Favored 'General case' 0 N--CA 1.487 1.382 0 O-C-N 121.395 -0.815 . . . . 0.0 109.201 179.702 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 99' ' ' ALA . . . . . . . . . . . . . . . -68.63 -37.69 79.93 Favored 'General case' 0 C--N 1.302 -1.48 0 O-C-N 121.522 -0.736 . . . . 0.0 109.251 179.568 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 100' ' ' ARG . . . . . 0.421 ' O ' ' O ' ' A' ' 101' ' ' LEU . 8.2 tpt180 -73.69 -16.27 61.21 Favored 'General case' 0 C--N 1.304 -1.395 0 O-C-N 121.539 -0.726 . . . . 0.0 109.308 -179.816 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 101' ' ' LEU . . . . . 0.498 ' O ' ' N ' ' A' ' 103' ' ' HIS . 47.0 tp 58.78 146.61 0.01 OUTLIER 'General case' 0 N--CA 1.488 1.425 0 CA-C-O 121.663 0.744 . . . . 0.0 110.455 -179.983 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 102' ' ' GLU . . . . . . . . . . . . . 47.1 tp10 -53.08 87.33 0.0 OUTLIER 'General case' 0 N--CA 1.489 1.521 0 CA-C-O 121.451 0.643 . . . . 0.0 109.764 -179.684 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 103' ' ' HIS . . . . . 0.498 ' N ' ' O ' ' A' ' 101' ' ' LEU . 86.4 t60 -66.54 -40.05 88.88 Favored 'General case' 0 C--N 1.301 -1.529 0 CA-C-O 121.52 0.676 . . . . 0.0 109.512 179.406 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 104' ' ' HIS . . . . . 0.449 ' O ' ' O ' ' A' ' 105' ' ' HIS . 75.4 m80 -51.1 126.78 17.35 Favored 'General case' 0 N--CA 1.489 1.498 0 O-C-N 121.317 -0.864 . . . . 0.0 110.348 -179.083 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 105' ' ' HIS . . . . . 0.449 ' O ' ' O ' ' A' ' 104' ' ' HIS . 79.0 m80 43.86 -171.17 0.01 OUTLIER 'General case' 0 N--CA 1.493 1.715 0 CA-C-O 121.788 0.804 . . . . 0.0 110.606 179.431 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 106' ' ' HIS . . . . . 0.414 ' CG ' ' O ' ' A' ' 105' ' ' HIS . 98.5 m-70 -155.04 37.3 0.4 Allowed 'General case' 0 N--CA 1.488 1.475 0 N-CA-C 108.277 -1.008 . . . . 0.0 108.277 -179.947 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 107' ' ' HIS . . . . . . . . . . . . . 1.7 p80 -67.81 141.23 56.57 Favored 'General case' 0 N--CA 1.489 1.523 0 O-C-N 121.413 -0.804 . . . . 0.0 110.171 -179.103 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 108' ' ' HIS . . . . . . . . . . . . . 58.8 t-80 . . . . . 0 N--CA 1.492 1.628 0 CA-C-O 118.014 -0.993 . . . . 0.0 109.839 -179.987 . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 41.5 tpp . . . . . 0 N--CA 1.49 1.537 0 CA-C-O 121.541 0.686 . . . . 0.0 109.3 . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 40.1 t -67.95 146.0 54.0 Favored 'General case' 0 N--CA 1.491 1.598 0 CA-C-O 121.495 0.664 . . . . 0.0 110.188 -179.727 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 3' ' ' ASN . . . . . . . . . . . . . 11.9 m120 -63.91 -39.61 94.57 Favored 'General case' 0 N--CA 1.489 1.524 0 N-CA-C 109.217 -0.66 . . . . 0.0 109.217 -179.667 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 4' ' ' GLN . . . . . 0.468 ' O ' ' NE2' ' A' ' 4' ' ' GLN . 5.1 pp0? -95.25 139.25 31.84 Favored 'General case' 0 N--CA 1.494 1.733 0 CA-C-O 121.707 0.765 . . . . 0.0 109.793 -179.769 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 5' ' ' THR . . . . . 0.446 ' O ' ' SG ' ' A' ' 6' ' ' CYS . 11.7 m -101.67 -46.46 4.94 Favored 'General case' 0 N--CA 1.492 1.636 0 N-CA-C 109.13 -0.693 . . . . 0.0 109.13 -179.822 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 6' ' ' CYS . . . . . 0.446 ' SG ' ' O ' ' A' ' 5' ' ' THR . 25.2 m -153.22 168.03 27.33 Favored 'General case' 0 N--CA 1.494 1.746 0 CA-C-O 121.675 0.75 . . . . 0.0 109.899 179.994 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 7' ' ' VAL . . . . . 0.422 HG12 ' H ' ' A' ' 9' ' ' ASN . 14.6 t -76.8 130.53 36.16 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.576 0 CA-C-O 121.706 0.765 . . . . 0.0 110.317 -179.035 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 8' ' ' GLU . . . . . 0.508 ' N ' ' OE1' ' A' ' 8' ' ' GLU . 57.3 mp0 -80.27 20.93 0.63 Allowed 'General case' 0 N--CA 1.49 1.533 0 N-CA-C 109.441 -0.577 . . . . 0.0 109.441 -179.848 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 9' ' ' ASN . . . . . 0.437 ' O ' ' O ' ' A' ' 10' ' ' GLU . 13.3 m120 56.44 34.89 25.04 Favored 'General case' 0 N--CA 1.493 1.712 0 CA-C-O 121.322 0.582 . . . . 0.0 109.495 179.616 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 10' ' ' GLU . . . . . 0.482 ' OE1' ' N ' ' A' ' 10' ' ' GLU . 56.9 mp0 47.73 177.94 0.01 OUTLIER 'General case' 0 N--CA 1.49 1.55 0 CA-C-O 121.658 0.742 . . . . 0.0 111.129 179.512 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 32.9 m -84.17 135.58 24.54 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.516 0 CA-C-O 121.644 0.735 . . . . 0.0 110.234 -179.083 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 52.6 m 50.4 100.83 0.01 OUTLIER 'General case' 0 N--CA 1.491 1.582 0 CA-C-O 121.735 0.779 . . . . 0.0 110.003 179.984 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 13' ' ' GLU . . . . . 0.406 ' OE1' ' N ' ' A' ' 13' ' ' GLU . 59.1 mp0 -69.88 126.92 31.14 Favored 'General case' 0 N--CA 1.488 1.433 0 CA-C-O 121.765 0.793 . . . . 0.0 110.405 -179.643 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -174.26 -68.16 0.01 OUTLIER 'General case' 0 C--N 1.303 -1.445 0 N-CA-C 109.272 -0.64 . . . . 0.0 109.272 179.517 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 10.5 t -82.77 135.24 35.04 Favored 'General case' 0 N--CA 1.494 1.745 0 CA-C-O 121.704 0.764 . . . . 0.0 110.232 -179.215 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . -157.07 114.57 0.62 Allowed Glycine 0 N--CA 1.489 2.209 0 N-CA-C 110.206 -1.157 . . . . 0.0 110.206 -179.946 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 52.3 t -85.24 84.29 7.72 Favored 'General case' 0 N--CA 1.493 1.721 0 O-C-N 121.776 -0.838 . . . . 0.0 109.682 179.74 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -68.74 140.72 55.36 Favored 'General case' 0 N--CA 1.492 1.655 0 CA-C-O 121.732 0.777 . . . . 0.0 110.415 -179.728 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -70.3 120.38 9.29 Favored Glycine 0 N--CA 1.489 2.232 0 N-CA-C 110.44 -1.064 . . . . 0.0 110.44 -179.448 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 82.5 tt0 -172.03 -23.65 0.01 OUTLIER 'General case' 0 N--CA 1.488 1.465 0 O-C-N 121.974 -0.721 . . . . 0.0 109.215 179.397 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 21' ' ' ILE . . . . . . . . . . . . . 35.4 pt -81.27 141.95 14.46 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.858 0 CA-C-O 121.713 0.768 . . . . 0.0 110.326 -179.853 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . -88.64 123.11 6.63 Favored Glycine 0 N--CA 1.492 2.383 0 N-CA-C 110.542 -1.023 . . . . 0.0 110.542 -179.153 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 23' ' ' PHE . . . . . 0.422 ' O ' ' CD1' ' A' ' 23' ' ' PHE . 53.2 p90 -111.93 132.0 55.03 Favored 'General case' 0 N--CA 1.495 1.806 0 CA-C-O 121.894 0.855 . . . . 0.0 109.741 179.347 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 24' ' ' ILE . . . . . 0.527 ' O ' ' N ' ' A' ' 26' ' ' ARG . 96.4 mt -85.16 -85.64 0.08 OUTLIER 'Isoleucine or valine' 0 N--CA 1.49 1.55 0 CA-C-N 116.032 -0.531 . . . . 0.0 109.576 -179.513 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 25' ' ' ILE . . . . . 0.687 HG22 ' O ' ' A' ' 25' ' ' ILE . 96.2 mt 47.2 10.54 0.03 OUTLIER 'Isoleucine or valine' 0 N--CA 1.495 1.782 0 CA-C-O 121.409 0.623 . . . . 0.0 109.596 -179.554 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 26' ' ' ARG . . . . . 0.527 ' N ' ' O ' ' A' ' 24' ' ' ILE . 41.2 ttm180 -107.05 127.2 53.25 Favored 'General case' 0 N--CA 1.491 1.625 0 O-C-N 121.269 -0.895 . . . . 0.0 110.139 179.839 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 26.0 tt0 57.07 40.44 28.46 Favored 'General case' 0 N--CA 1.491 1.623 0 CA-C-O 121.627 0.727 . . . . 0.0 109.586 179.237 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . -83.24 9.88 59.93 Favored Glycine 0 N--CA 1.494 2.541 0 N-CA-C 109.61 -1.396 . . . . 0.0 109.61 -179.999 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 98.7 m-20 57.09 24.95 10.23 Favored 'General case' 0 N--CA 1.494 1.769 0 CA-C-O 121.439 0.638 . . . . 0.0 109.428 -179.887 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 44.2 p30 -162.82 26.34 0.1 Allowed 'General case' 0 N--CA 1.493 1.7 0 N-CA-C 109.007 -0.738 . . . . 0.0 109.007 178.647 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 31' ' ' VAL . . . . . 0.434 ' CG1' HH21 ' A' ' 79' ' ' ARG . 93.3 t -118.71 134.56 61.93 Favored 'Isoleucine or valine' 0 N--CA 1.499 2.016 0 CA-C-O 121.712 0.768 . . . . 0.0 109.452 -179.822 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -98.88 157.2 16.47 Favored 'General case' 0 N--CA 1.494 1.745 0 CA-C-O 121.787 0.803 . . . . 0.0 110.409 -179.019 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 33' ' ' GLU . . . . . 0.424 ' OE1' ' CD ' ' A' ' 79' ' ' ARG . 48.9 tp10 -108.03 126.0 52.22 Favored 'General case' 0 N--CA 1.493 1.7 0 CA-C-O 121.716 0.769 . . . . 0.0 110.13 -179.186 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 34' ' ' VAL . . . . . . . . . . . . . 54.0 t -124.24 133.62 68.85 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.875 0 CA-C-O 121.629 0.728 . . . . 0.0 109.626 179.635 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 74.0 p -137.03 126.91 25.72 Favored 'General case' 0 N--CA 1.494 1.752 0 CA-C-O 121.854 0.835 . . . . 0.0 110.042 179.276 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 40.0 tp -117.41 132.41 56.58 Favored 'General case' 0 N--CA 1.49 1.527 0 CA-C-O 121.665 0.745 . . . . 0.0 109.788 179.74 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 37' ' ' PHE . . . . . . . . . . . . . 90.7 t80 -109.04 131.1 55.4 Favored 'General case' 0 N--CA 1.493 1.707 0 CA-C-O 121.868 0.842 . . . . 0.0 109.582 179.99 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . -173.14 -164.23 28.15 Favored Glycine 0 N--CA 1.487 2.061 0 N-CA-C 109.867 -1.293 . . . . 0.0 109.867 -179.689 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 22.9 t -62.55 -147.56 0.0 OUTLIER 'General case' 0 N--CA 1.49 1.534 0 O-C-N 121.891 -0.77 . . . . 0.0 110.726 -179.237 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 40' ' ' ASP . . . . . . . . . . . . . 44.6 p-10 -55.94 174.77 0.11 Allowed 'General case' 0 N--CA 1.488 1.444 0 CA-C-O 121.771 0.795 . . . . 0.0 110.807 -178.812 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 88.7 tttt -62.53 -41.16 98.69 Favored 'General case' 0 N--CA 1.49 1.554 0 CA-C-O 121.225 0.536 . . . . 0.0 109.868 -179.075 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -53.67 -46.83 70.76 Favored 'General case' 0 N--CA 1.492 1.647 0 O-C-N 121.897 -0.502 . . . . 0.0 109.978 -178.965 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 43' ' ' HIS . . . . . . . . . . . . . 59.1 t-80 -62.96 -40.8 98.78 Favored 'General case' 0 C--N 1.302 -1.476 0 O-C-N 121.749 -0.595 . . . . 0.0 109.462 -179.619 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 95.1 mt -63.33 -39.99 96.08 Favored 'General case' 0 N--CA 1.491 1.592 0 O-C-N 121.805 -0.559 . . . . 0.0 109.546 -179.702 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 95.1 mt-10 -61.28 -41.02 96.24 Favored 'General case' 0 N--CA 1.49 1.555 0 N-CA-C 109.262 -0.644 . . . . 0.0 109.262 -179.756 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . -61.17 -42.5 99.8 Favored Glycine 0 N--CA 1.492 2.376 0 N-CA-C 109.65 -1.38 . . . . 0.0 109.65 -179.725 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 71.2 mmtt -81.53 -21.14 38.76 Favored 'General case' 0 N--CA 1.492 1.647 0 O-C-N 121.702 -0.881 . . . . 0.0 108.953 -179.801 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 44.9 tp -63.41 -40.15 96.42 Favored 'General case' 0 N--CA 1.489 1.504 0 CA-C-O 121.308 0.575 . . . . 0.0 109.48 -179.694 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 49' ' ' ALA . . . . . . . . . . . . . . . -49.89 -38.16 34.52 Favored 'General case' 0 N--CA 1.492 1.628 0 O-C-N 121.846 -0.534 . . . . 0.0 109.933 -178.635 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 50' ' ' GLU . . . . . 0.458 ' OE1' ' N ' ' A' ' 50' ' ' GLU . 56.5 mp0 -68.01 -43.14 79.5 Favored 'General case' 0 N--CA 1.491 1.581 0 O-C-N 121.635 -0.666 . . . . 0.0 109.777 -179.929 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 10.0 m-85 -63.07 -45.48 91.97 Favored 'General case' 0 N--CA 1.492 1.635 0 N-CA-C 109.58 -0.526 . . . . 0.0 109.58 -179.337 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 52' ' ' ILE . . . . . . . . . . . . . 92.0 mt -64.97 -42.75 95.57 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.531 0 N-CA-C 109.331 -0.618 . . . . 0.0 109.331 -179.746 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 49.6 m -57.43 -41.31 80.21 Favored 'General case' 0 N--CA 1.495 1.776 0 O-C-N 121.815 -0.553 . . . . 0.0 109.608 -179.151 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 54' ' ' LEU . . . . . 0.635 HD22 ' NZ ' ' A' ' 94' ' ' LYS . 82.6 mt -63.35 -40.21 96.64 Favored 'General case' 0 N--CA 1.491 1.584 0 N-CA-C 109.336 -0.616 . . . . 0.0 109.336 179.964 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 55' ' ' ALA . . . . . 0.477 ' HB2' ' CE1' ' A' ' 91' ' ' PHE . . . -59.26 -42.77 91.96 Favored 'General case' 0 N--CA 1.489 1.484 0 N-CA-C 109.194 -0.669 . . . . 0.0 109.194 -179.417 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 56' ' ' LYS . . . . . . . . . . . . . 64.1 tttp -65.46 -41.02 93.85 Favored 'General case' 0 N--CA 1.486 1.339 0 CA-C-O 121.265 0.555 . . . . 0.0 109.624 179.984 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 16.5 tt0 -64.07 -43.75 94.5 Favored 'General case' 0 N--CA 1.491 1.58 0 O-C-N 121.76 -0.587 . . . . 0.0 109.587 -179.274 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 58' ' ' VAL . . . . . . . . . . . . . 72.1 t -65.38 -44.89 94.45 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.563 0 N-CA-C 109.561 -0.533 . . . . 0.0 109.561 -179.708 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 59' ' ' TYR . . . . . 0.417 ' O ' ' O ' ' A' ' 60' ' ' ALA . 58.4 t80 -127.12 132.33 50.61 Favored 'General case' 0 N--CA 1.498 1.945 0 CA-C-O 121.812 0.815 . . . . 0.0 109.611 -179.595 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 60' ' ' ALA . . . . . 0.417 ' O ' ' O ' ' A' ' 59' ' ' TYR . . . -42.34 -97.0 0.0 OUTLIER 'General case' 0 N--CA 1.491 1.593 0 CA-C-O 121.378 0.608 . . . . 0.0 110.739 -179.281 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 61' ' ' ASN . . . . . . . . . . . . . 20.2 t-20 -85.05 92.62 8.4 Favored 'General case' 0 N--CA 1.491 1.581 0 CA-C-O 121.713 0.768 . . . . 0.0 109.856 -178.74 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 62' ' ' VAL . . . . . . . . . . . . . 10.9 p -99.45 133.71 41.27 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.717 0 CA-C-O 121.801 0.81 . . . . 0.0 110.037 179.995 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 81.0 tt0 -105.13 143.7 32.95 Favored 'General case' 0 N--CA 1.49 1.546 0 CA-C-O 121.702 0.763 . . . . 0.0 109.283 179.979 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 64' ' ' TYR . . . . . . . . . . . . . 51.0 p90 -151.96 161.15 43.1 Favored 'General case' 0 C--N 1.303 -1.443 0 CA-C-O 121.962 0.887 . . . . 0.0 110.493 -179.594 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 47.7 tp10 -147.18 146.95 30.04 Favored 'General case' 0 N--CA 1.49 1.57 0 CA-C-O 121.729 0.776 . . . . 0.0 109.32 179.83 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 66' ' ' VAL . . . . . . . . . . . . . 88.4 t -102.57 125.13 56.91 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.707 0 CA-C-O 121.866 0.841 . . . . 0.0 109.935 -179.926 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 67' ' ' ALA . . . . . 0.598 ' HB1' ' HD2' ' A' ' 68' ' ' PRO . . . -76.97 171.08 13.36 Favored Pre-proline 0 C--N 1.304 -1.41 0 CA-C-O 121.227 0.536 . . . . 0.0 109.935 -179.72 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 68' ' ' PRO . . . . . 0.598 ' HD2' ' HB1' ' A' ' 67' ' ' ALA . 51.1 Cg_exo -54.48 137.32 72.38 Favored 'Trans proline' 0 N--CA 1.496 1.62 0 C-N-CA 122.965 2.443 . . . . 0.0 113.057 -179.923 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 69' ' ' VAL . . . . . 0.453 ' C ' ' H ' ' A' ' 71' ' ' ASP . 73.2 t -128.39 131.91 68.57 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.928 0 CA-C-O 121.848 0.832 . . . . 0.0 110.087 179.963 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 70' ' ' ALA . . . . . 0.646 ' O ' ' N ' ' A' ' 72' ' ' ASN . . . -74.8 34.25 0.1 Allowed 'General case' 0 N--CA 1.491 1.6 0 CA-C-N 116.154 -0.475 . . . . 0.0 109.963 179.811 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 71' ' ' ASP . . . . . 0.453 ' H ' ' C ' ' A' ' 69' ' ' VAL . 66.4 t0 54.78 -72.52 0.01 OUTLIER 'General case' 0 N--CA 1.493 1.708 0 CA-C-O 121.448 0.642 . . . . 0.0 109.969 179.693 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 72' ' ' ASN . . . . . 0.783 ' O ' HG23 ' A' ' 74' ' ' THR . 63.8 t30 -84.67 12.54 6.99 Favored 'General case' 0 C--N 1.301 -1.533 0 N-CA-C 108.626 -0.879 . . . . 0.0 108.626 179.941 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 73' ' ' ALA . . . . . 0.512 ' HB2' ' HB3' ' A' ' 70' ' ' ALA . . . -52.16 -6.53 0.05 OUTLIER 'General case' 0 N--CA 1.497 1.902 0 N-CA-C 109.503 -0.554 . . . . 0.0 109.503 179.95 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 74' ' ' THR . . . . . 0.783 HG23 ' O ' ' A' ' 72' ' ' ASN . 70.4 p 51.03 11.59 0.1 Allowed 'General case' 0 C--N 1.304 -1.411 0 CA-C-O 121.469 0.652 . . . . 0.0 109.296 -179.771 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 75' ' ' GLU . . . . . 0.49 ' H ' ' C ' ' A' ' 73' ' ' ALA . 81.9 tt0 -149.63 151.98 34.66 Favored 'General case' 0 C--N 1.302 -1.457 0 CA-C-O 121.666 0.746 . . . . 0.0 109.446 179.582 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 7.2 tt -128.31 131.08 48.67 Favored 'General case' 0 N--CA 1.489 1.493 0 CA-C-O 121.796 0.807 . . . . 0.0 109.798 179.848 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 77' ' ' HIS . . . . . . . . . . . . . 98.3 m-70 -101.91 128.87 48.11 Favored 'General case' 0 N--CA 1.495 1.781 0 CA-C-O 121.906 0.86 . . . . 0.0 109.92 -180.0 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -136.0 152.2 50.69 Favored 'General case' 0 N--CA 1.491 1.595 0 CA-C-O 121.674 0.749 . . . . 0.0 109.88 179.991 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 79' ' ' ARG . . . . . 0.434 HH21 ' CG1' ' A' ' 31' ' ' VAL . 50.1 mmm-85 -127.7 144.53 51.07 Favored 'General case' 0 N--CA 1.494 1.74 0 CA-C-O 121.755 0.788 . . . . 0.0 109.544 -179.25 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 80' ' ' PHE . . . . . . . . . . . . . 82.1 m-85 -130.6 150.78 51.64 Favored 'General case' 0 N--CA 1.494 1.741 0 CA-C-O 121.571 0.7 . . . . 0.0 109.819 -179.385 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 63.1 tttm -114.96 127.9 55.96 Favored 'General case' 0 N--CA 1.495 1.793 0 CA-C-O 121.722 0.772 . . . . 0.0 110.041 -179.514 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 82' ' ' PHE . . . . . . . . . . . . . 81.1 m-85 -129.37 143.9 51.03 Favored 'General case' 0 N--CA 1.496 1.852 0 CA-C-O 121.732 0.777 . . . . 0.0 109.904 179.579 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 6.8 pt-20 -69.39 -34.27 74.27 Favored 'General case' 0 N--CA 1.489 1.491 0 N-CA-C 109.487 -0.56 . . . . 0.0 109.487 -179.672 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 84' ' ' VAL . . . . . . . . . . . . . 26.8 m -131.37 161.03 41.86 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.924 0 CA-C-O 121.885 0.85 . . . . 0.0 110.29 -179.629 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 33.6 m -76.54 -17.48 59.22 Favored 'General case' 0 N--CA 1.492 1.653 0 CA-C-N 116.055 -0.521 . . . . 0.0 109.91 -179.209 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 86' ' ' ALA . . . . . . . . . . . . . . . -62.71 -40.83 98.38 Favored 'General case' 0 N--CA 1.491 1.61 0 N-CA-C 109.129 -0.693 . . . . 0.0 109.129 -179.435 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 97.4 mt-10 -71.69 -32.16 67.54 Favored 'General case' 0 N--CA 1.49 1.541 0 N-CA-C 109.112 -0.699 . . . . 0.0 109.112 179.889 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 88' ' ' LYS . . . . . . . . . . . . . 88.0 tttt -62.84 -47.58 82.76 Favored 'General case' 0 N--CA 1.489 1.506 0 O-C-N 121.789 -0.569 . . . . 0.0 109.51 -179.711 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 96.9 mt -63.76 -45.54 89.33 Favored 'General case' 0 N--CA 1.491 1.587 0 O-C-N 121.745 -0.597 . . . . 0.0 110.151 -179.1 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 90' ' ' ILE . . . . . . . . . . . . . 96.9 mt -68.32 -43.96 84.07 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.636 0 CA-C-O 121.399 0.619 . . . . 0.0 109.41 -179.717 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 91' ' ' PHE . . . . . 0.477 ' CE1' ' HB2' ' A' ' 55' ' ' ALA . 40.3 t80 -61.78 -46.95 87.37 Favored 'General case' 0 N--CA 1.489 1.486 0 N-CA-C 109.28 -0.637 . . . . 0.0 109.28 -179.512 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 92' ' ' GLU . . . . . . . . . . . . . 95.4 mt-10 -67.32 -33.76 75.94 Favored 'General case' 0 N--CA 1.489 1.477 0 N-CA-C 109.142 -0.688 . . . . 0.0 109.142 179.751 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 93' ' ' LEU . . . . . . . . . . . . . 49.4 tp -63.75 -45.68 88.74 Favored 'General case' 0 N--CA 1.487 1.379 0 CA-C-O 121.373 0.606 . . . . 0.0 109.42 -179.559 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 94' ' ' LYS . . . . . 0.635 ' NZ ' HD22 ' A' ' 54' ' ' LEU . 7.9 mtpm? -66.98 -44.02 81.51 Favored 'General case' 0 N--CA 1.489 1.515 0 O-C-N 121.749 -0.595 . . . . 0.0 109.812 -179.446 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 67.0 p -67.53 -33.8 75.81 Favored 'General case' 0 N--CA 1.491 1.622 0 O-C-N 121.783 -0.573 . . . . 0.0 109.773 -179.262 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 96' ' ' ARG . . . . . . . . . . . . . 61.3 ttm-85 -62.62 -43.47 98.73 Favored 'General case' 0 N--CA 1.492 1.656 0 O-C-N 121.676 -0.64 . . . . 0.0 109.508 -179.563 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 97' ' ' ALA . . . . . . . . . . . . . . . -66.79 -34.32 77.56 Favored 'General case' 0 N--CA 1.492 1.647 0 N-CA-C 109.522 -0.547 . . . . 0.0 109.522 -179.661 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 98' ' ' LEU . . . . . 0.553 HD13 ' O ' ' A' ' 98' ' ' LEU . 0.2 OUTLIER -61.86 -45.07 95.36 Favored 'General case' 0 N--CA 1.486 1.33 0 O-C-N 121.542 -0.724 . . . . 0.0 109.131 -178.955 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 99' ' ' ALA . . . . . . . . . . . . . . . -65.88 -36.2 82.77 Favored 'General case' 0 N--CA 1.492 1.626 0 CA-C-O 121.263 0.554 . . . . 0.0 109.63 -179.35 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 100' ' ' ARG . . . . . . . . . . . . . 78.1 ttt180 -68.36 -16.48 63.95 Favored 'General case' 0 N--CA 1.489 1.494 0 N-CA-C 108.692 -0.855 . . . . 0.0 108.692 -179.783 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 101' ' ' LEU . . . . . . . . . . . . . 79.5 mt 53.31 68.19 0.88 Allowed 'General case' 0 N--CA 1.488 1.431 0 CA-C-O 121.558 0.694 . . . . 0.0 109.788 179.678 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 102' ' ' GLU . . . . . . . . . . . . . 97.6 mt-10 -68.66 146.12 53.29 Favored 'General case' 0 N--CA 1.488 1.446 0 CA-C-O 121.657 0.741 . . . . 0.0 110.206 -179.985 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 103' ' ' HIS . . . . . . . . . . . . . 73.9 m80 -74.31 142.29 45.2 Favored 'General case' 0 N--CA 1.488 1.43 0 CA-C-O 121.534 0.683 . . . . 0.0 110.031 -179.547 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 104' ' ' HIS . . . . . . . . . . . . . 78.5 m80 -118.13 154.55 31.93 Favored 'General case' 0 N--CA 1.495 1.792 0 CA-C-O 121.876 0.846 . . . . 0.0 110.284 -179.751 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 105' ' ' HIS . . . . . . . . . . . . . 60.8 m170 -69.8 139.98 53.27 Favored 'General case' 0 N--CA 1.49 1.559 0 CA-C-O 121.588 0.709 . . . . 0.0 109.932 -179.398 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 106' ' ' HIS . . . . . . . . . . . . . 77.1 m80 -61.74 -41.71 98.01 Favored 'General case' 0 C--N 1.302 -1.469 0 N-CA-C 109.648 -0.501 . . . . 0.0 109.648 -179.372 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 107' ' ' HIS . . . . . . . . . . . . . 98.2 m-70 -77.87 137.83 38.59 Favored 'General case' 0 N--CA 1.492 1.665 0 CA-C-O 121.613 0.721 . . . . 0.0 110.035 -179.8 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 108' ' ' HIS . . . . . . . . . . . . . 85.9 t60 . . . . . 0 N--CA 1.491 1.618 0 CA-C-O 117.842 -1.075 . . . . 0.0 109.715 179.85 . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . 0.579 ' SD ' ' N ' ' A' ' 1' ' ' MET . 0.0 OUTLIER . . . . . 0 N--CA 1.489 1.475 0 CA-C-O 121.567 0.699 . . . . 0.0 110.006 . . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 2.0 m 50.28 27.61 2.76 Favored 'General case' 0 N--CA 1.496 1.872 0 CA-C-O 121.454 0.645 . . . . 0.0 109.915 -179.624 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 3' ' ' ASN . . . . . 0.436 ' O ' ' O ' ' A' ' 4' ' ' GLN . 64.1 t30 61.75 123.95 0.01 OUTLIER 'General case' 0 N--CA 1.493 1.683 0 CA-C-O 121.573 0.701 . . . . 0.0 110.038 179.087 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 4' ' ' GLN . . . . . 0.557 ' O ' ' N ' ' A' ' 6' ' ' CYS . 88.1 mt-30 -50.88 -102.11 0.0 OUTLIER 'General case' 0 N--CA 1.49 1.535 0 CA-C-O 121.378 0.609 . . . . 0.0 109.596 -179.398 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 5' ' ' THR . . . . . 0.418 HG22 ' N ' ' A' ' 6' ' ' CYS . 75.1 m 41.39 -90.17 0.01 OUTLIER 'General case' 0 N--CA 1.487 1.425 0 CA-C-O 121.376 0.608 . . . . 0.0 110.032 -179.482 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 6' ' ' CYS . . . . . 0.557 ' N ' ' O ' ' A' ' 4' ' ' GLN . 1.6 p -88.31 102.24 14.66 Favored 'General case' 0 N--CA 1.492 1.637 0 CA-C-O 121.893 0.854 . . . . 0.0 109.623 -179.69 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 7' ' ' VAL . . . . . . . . . . . . . 15.5 t -97.23 108.93 22.33 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.651 0 CA-C-O 121.766 0.793 . . . . 0.0 109.866 179.892 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 79.8 tt0 39.73 65.51 0.7 Allowed 'General case' 0 N--CA 1.496 1.835 0 CA-C-O 121.774 0.797 . . . . 0.0 109.915 179.568 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 9' ' ' ASN . . . . . 0.409 ' ND2' ' CB ' ' A' ' 6' ' ' CYS . 93.5 m-20 -80.86 -79.08 0.16 Allowed 'General case' 0 N--CA 1.494 1.747 0 O-C-N 121.547 -0.721 . . . . 0.0 109.385 -179.878 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 97.9 mt-10 44.59 -165.95 0.01 OUTLIER 'General case' 0 N--CA 1.492 1.663 0 CA-C-O 121.688 0.756 . . . . 0.0 110.609 -179.836 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 73.7 t -83.5 132.46 31.39 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.568 0 CA-C-O 121.841 0.829 . . . . 0.0 109.918 -179.315 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 2.9 p -75.01 144.96 42.84 Favored 'General case' 0 N--CA 1.489 1.499 0 CA-C-O 121.832 0.825 . . . . 0.0 110.387 -179.524 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 22.4 tp10 66.09 28.5 10.29 Favored 'General case' 0 N--CA 1.489 1.521 0 CA-C-O 121.545 0.688 . . . . 0.0 109.371 179.457 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -88.5 -6.32 57.68 Favored 'General case' 0 N--CA 1.493 1.682 0 O-C-N 121.455 -0.778 . . . . 0.0 109.055 179.749 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 28.2 p -156.95 164.18 38.31 Favored 'General case' 0 N--CA 1.491 1.615 0 CA-C-O 121.858 0.837 . . . . 0.0 110.118 179.779 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . -64.79 160.64 41.24 Favored Glycine 0 N--CA 1.491 2.311 0 N-CA-C 110.688 -0.965 . . . . 0.0 110.688 -179.179 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 93.8 m -86.76 144.19 27.19 Favored 'General case' 0 N--CA 1.493 1.68 0 O-C-N 121.86 -0.788 . . . . 0.0 110.138 -179.623 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -79.88 -7.08 58.52 Favored 'General case' 0 N--CA 1.492 1.647 0 N-CA-C 109.131 -0.692 . . . . 0.0 109.131 -179.575 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -79.0 -3.53 88.23 Favored Glycine 0 N--CA 1.493 2.452 0 N-CA-C 108.992 -1.643 . . . . 0.0 108.992 -179.936 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 79.8 mm-40 -73.86 132.67 42.77 Favored 'General case' 0 N--CA 1.493 1.712 0 O-C-N 121.642 -0.916 . . . . 0.0 110.064 -179.577 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 21' ' ' ILE . . . . . . . . . . . . . 20.0 tt -89.19 131.73 35.76 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.7 0 CA-C-O 121.959 0.885 . . . . 0.0 109.964 -179.788 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . -167.7 -109.11 0.21 Allowed Glycine 0 N--CA 1.487 2.053 0 N-CA-C 109.579 -1.409 . . . . 0.0 109.579 179.942 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 23' ' ' PHE . . . . . 0.428 ' O ' ' O ' ' A' ' 24' ' ' ILE . 76.1 m-85 -109.54 -107.17 0.35 Allowed 'General case' 0 N--CA 1.497 1.924 0 O-C-N 121.63 -0.923 . . . . 0.0 109.509 -179.232 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 24' ' ' ILE . . . . . 0.428 ' O ' ' O ' ' A' ' 23' ' ' PHE . 96.7 mt 49.42 100.43 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.49 1.543 0 CA-C-O 121.637 0.732 . . . . 0.0 109.677 -179.753 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 25' ' ' ILE . . . . . 0.617 HG22 ' H ' ' A' ' 27' ' ' GLU . 92.0 mt -79.29 129.12 38.04 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.733 0 CA-C-O 121.937 0.875 . . . . 0.0 110.237 -179.637 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 80.5 mtp85 -99.42 9.61 42.96 Favored 'General case' 0 N--CA 1.498 1.953 0 CA-C-N 115.908 -0.587 . . . . 0.0 109.69 -179.331 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 27' ' ' GLU . . . . . 0.617 ' H ' HG22 ' A' ' 25' ' ' ILE . 93.5 mt-10 -74.58 51.05 0.45 Allowed 'General case' 0 N--CA 1.492 1.667 0 N-CA-C 108.644 -0.873 . . . . 0.0 108.644 179.565 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 28' ' ' GLY . . . . . 0.474 ' C ' ' H ' ' A' ' 30' ' ' ASP . . . -45.89 156.2 0.48 Allowed Glycine 0 N--CA 1.491 2.322 0 N-CA-C 109.954 -1.258 . . . . 0.0 109.954 -179.878 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 1.3 m-20 70.29 -44.05 0.56 Allowed 'General case' 0 N--CA 1.488 1.449 0 N-CA-C 108.874 -0.787 . . . . 0.0 108.874 -179.744 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 30' ' ' ASP . . . . . 0.474 ' H ' ' C ' ' A' ' 28' ' ' GLY . 96.0 m-20 -96.83 9.7 41.07 Favored 'General case' 0 N--CA 1.494 1.77 0 N-CA-C 109.13 -0.693 . . . . 0.0 109.13 179.974 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 3.8 p -129.22 154.04 39.52 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.861 0 CA-C-O 121.641 0.734 . . . . 0.0 109.799 -179.69 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -122.51 142.02 51.03 Favored 'General case' 0 N--CA 1.496 1.853 0 CA-C-O 121.937 0.875 . . . . 0.0 109.819 -179.896 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 33' ' ' GLU . . . . . 0.4 ' H ' ' HG2' ' A' ' 33' ' ' GLU . 21.9 pt-20 -94.36 138.01 32.83 Favored 'General case' 0 N--CA 1.492 1.669 0 CA-C-O 121.782 0.801 . . . . 0.0 110.444 -179.154 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 34' ' ' VAL . . . . . 0.41 HG13 ' CE2' ' A' ' 51' ' ' TYR . 55.0 t -127.01 130.83 71.32 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.834 0 CA-C-O 121.844 0.83 . . . . 0.0 109.263 179.371 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 51.1 m -133.53 128.73 35.91 Favored 'General case' 0 N--CA 1.495 1.809 0 CA-C-O 121.522 0.677 . . . . 0.0 109.315 179.355 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 74.1 mt -119.43 151.37 38.64 Favored 'General case' 0 N--CA 1.499 1.996 0 CA-C-O 121.863 0.84 . . . . 0.0 110.223 -179.39 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 37' ' ' PHE . . . . . . . . . . . . . 96.1 m-85 -124.56 137.92 54.36 Favored 'General case' 0 N--CA 1.497 1.881 0 CA-C-O 121.866 0.841 . . . . 0.0 109.702 -179.669 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 38' ' ' GLY . . . . . 0.528 ' N ' HD21 ' A' ' 44' ' ' LEU . . . 177.2 179.89 47.73 Favored Glycine 0 N--CA 1.491 2.339 0 N-CA-C 110.296 -1.122 . . . . 0.0 110.296 -179.984 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 36.0 p -88.48 -76.69 0.39 Allowed 'General case' 0 N--CA 1.491 1.605 0 O-C-N 121.718 -0.871 . . . . 0.0 109.877 -179.705 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 40' ' ' ASP . . . . . . . . . . . . . 32.9 t70 -80.36 155.46 27.17 Favored 'General case' 0 N--CA 1.497 1.884 0 O-C-N 121.318 -0.864 . . . . 0.0 110.666 -179.2 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 88.8 tttt -63.37 -39.84 95.63 Favored 'General case' 0 N--CA 1.489 1.48 0 CA-C-O 121.107 0.479 . . . . 0.0 110.117 -179.645 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -54.93 -38.9 68.25 Favored 'General case' 0 N--CA 1.492 1.668 0 O-C-N 121.551 -0.718 . . . . 0.0 109.45 -178.951 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 43' ' ' HIS . . . . . 0.636 ' CE1' ' NZ ' ' A' ' 47' ' ' LYS . 11.5 t-160 -67.54 -42.27 82.97 Favored 'General case' 0 N--CA 1.495 1.778 0 O-C-N 121.751 -0.593 . . . . 0.0 109.409 -179.999 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 44' ' ' LEU . . . . . 0.528 HD21 ' N ' ' A' ' 38' ' ' GLY . 96.0 mt -63.02 -40.54 98.07 Favored 'General case' 0 N--CA 1.487 1.385 0 N-CA-C 106.527 -1.657 . . . . 0.0 106.527 178.72 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 77.0 mm-40 -64.36 -32.04 73.49 Favored 'General case' 0 N--CA 1.487 1.409 0 CA-C-N 115.726 -0.67 . . . . 0.0 109.446 179.241 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . -61.33 -50.0 71.5 Favored Glycine 0 N--CA 1.495 2.589 0 N-CA-C 109.507 -1.437 . . . . 0.0 109.507 -179.756 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 47' ' ' LYS . . . . . 0.636 ' NZ ' ' CE1' ' A' ' 43' ' ' HIS . 62.2 mttp -65.99 -38.62 88.98 Favored 'General case' 0 N--CA 1.49 1.536 0 O-C-N 121.678 -0.895 . . . . 0.0 109.039 179.561 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 61.8 tp -56.07 -34.19 65.73 Favored 'General case' 0 C--N 1.302 -1.471 0 N-CA-C 109.348 -0.612 . . . . 0.0 109.348 -179.167 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 49' ' ' ALA . . . . . . . . . . . . . . . -60.05 -38.07 81.72 Favored 'General case' 0 N--CA 1.492 1.655 0 O-C-N 121.614 -0.679 . . . . 0.0 109.183 -179.601 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 97.0 mt-10 -67.8 -38.51 83.42 Favored 'General case' 0 N--CA 1.491 1.617 0 O-C-N 121.638 -0.664 . . . . 0.0 109.308 179.786 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 51' ' ' TYR . . . . . 0.41 ' CE2' HG13 ' A' ' 34' ' ' VAL . 8.3 m-85 -60.97 -45.5 94.5 Favored 'General case' 0 N--CA 1.493 1.676 0 N-CA-C 108.808 -0.812 . . . . 0.0 108.808 179.889 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 52' ' ' ILE . . . . . . . . . . . . . 92.0 mt -65.11 -44.63 95.55 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.557 0 N-CA-C 109.596 -0.52 . . . . 0.0 109.596 -179.828 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 66.9 m -62.9 -46.58 87.14 Favored 'General case' 0 N--CA 1.494 1.738 0 O-C-N 121.415 -0.803 . . . . 0.0 109.862 -179.459 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 54' ' ' LEU . . . . . . . . . . . . . 93.2 mt -65.94 -42.62 89.78 Favored 'General case' 0 N--CA 1.494 1.737 0 O-C-N 121.648 -0.657 . . . . 0.0 109.858 179.999 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -65.57 -38.82 90.64 Favored 'General case' 0 N--CA 1.491 1.589 0 O-C-N 121.81 -0.556 . . . . 0.0 110.015 -178.913 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 56' ' ' LYS . . . . . . . . . . . . . 66.1 tttm -64.82 -45.47 86.06 Favored 'General case' 0 N--CA 1.487 1.414 0 O-C-N 121.42 -0.8 . . . . 0.0 109.729 -179.426 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 29.0 mt-30 -66.38 -44.23 83.7 Favored 'General case' 0 N--CA 1.493 1.69 0 O-C-N 121.594 -0.692 . . . . 0.0 109.675 -179.606 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 58' ' ' VAL . . . . . . . . . . . . . 74.8 t -65.05 -44.65 95.79 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.536 0 N-CA-C 109.116 -0.698 . . . . 0.0 109.116 -179.637 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 59' ' ' TYR . . . . . . . . . . . . . 9.2 t80 -106.97 -143.5 0.38 Allowed 'General case' 0 N--CA 1.496 1.866 0 CA-C-O 121.498 0.666 . . . . 0.0 109.585 -179.676 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -164.79 125.01 1.96 Allowed 'General case' 0 N--CA 1.491 1.622 0 CA-C-O 121.851 0.834 . . . . 0.0 110.255 179.998 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 61' ' ' ASN . . . . . . . . . . . . . 30.8 t-20 57.92 36.24 26.06 Favored 'General case' 0 N--CA 1.493 1.682 0 CA-C-O 121.816 0.817 . . . . 0.0 109.127 179.738 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 62' ' ' VAL . . . . . . . . . . . . . 5.4 p -67.77 139.28 21.1 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.606 0 CA-C-O 121.776 0.798 . . . . 0.0 110.552 -179.653 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 49.9 tp10 -116.94 147.47 42.22 Favored 'General case' 0 N--CA 1.494 1.736 0 CA-C-O 121.65 0.738 . . . . 0.0 109.241 179.957 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 64' ' ' TYR . . . . . . . . . . . . . 48.3 p90 -149.39 166.18 29.83 Favored 'General case' 0 N--CA 1.49 1.556 0 CA-C-O 122.008 0.909 . . . . 0.0 110.798 -179.323 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 75.5 mm-40 -132.16 147.23 52.41 Favored 'General case' 0 N--CA 1.495 1.791 0 CA-C-O 121.496 0.665 . . . . 0.0 109.475 -179.711 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 66' ' ' VAL . . . . . . . . . . . . . 57.7 t -120.74 130.88 74.1 Favored 'Isoleucine or valine' 0 N--CA 1.5 2.058 0 CA-C-O 121.975 0.893 . . . . 0.0 109.968 -179.571 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -79.22 155.94 76.7 Favored Pre-proline 0 C--N 1.306 -1.299 0 N-CA-C 109.348 -0.612 . . . . 0.0 109.348 -179.484 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 68' ' ' PRO . . . . . . . . . . . . . 89.2 Cg_exo -45.71 127.94 10.39 Favored 'Trans proline' 0 N--CA 1.492 1.409 0 C-N-CA 122.612 2.208 . . . . 0.0 113.075 179.765 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 69' ' ' VAL . . . . . . . . . . . . . 47.9 t -130.89 132.46 63.88 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.898 0 CA-C-O 121.822 0.82 . . . . 0.0 110.057 179.807 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -73.29 151.96 41.14 Favored 'General case' 0 N--CA 1.49 1.527 0 CA-C-O 121.749 0.785 . . . . 0.0 110.146 179.328 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 71' ' ' ASP . . . . . 0.537 ' OD1' ' N ' ' A' ' 72' ' ' ASN . 41.5 p-10 -63.73 -35.11 79.5 Favored 'General case' 0 N--CA 1.489 1.505 0 O-C-N 121.769 -0.582 . . . . 0.0 109.607 -179.825 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 72' ' ' ASN . . . . . 0.537 ' N ' ' OD1' ' A' ' 71' ' ' ASP . 99.2 m-20 -95.59 15.3 20.23 Favored 'General case' 0 N--CA 1.494 1.742 0 N-CA-C 108.972 -0.751 . . . . 0.0 108.972 -179.556 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -61.09 146.93 45.6 Favored 'General case' 0 N--CA 1.498 1.954 0 CA-C-O 121.774 0.797 . . . . 0.0 110.704 -179.645 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 74' ' ' THR . . . . . . . . . . . . . 50.6 p -98.63 -1.68 40.28 Favored 'General case' 0 N--CA 1.498 1.943 0 O-C-N 121.751 -0.593 . . . . 0.0 109.467 -179.758 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 2.9 pp20? -156.13 160.1 39.61 Favored 'General case' 0 N--CA 1.495 1.78 0 O-C-N 121.243 -0.911 . . . . 0.0 110.395 179.695 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 5.4 tt -128.06 135.27 49.61 Favored 'General case' 0 N--CA 1.493 1.707 0 CA-C-O 121.565 0.697 . . . . 0.0 109.876 -179.869 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 77' ' ' HIS . . . . . . . . . . . . . 82.2 t60 -117.22 124.3 48.74 Favored 'General case' 0 N--CA 1.497 1.909 0 CA-C-O 122.143 0.973 . . . . 0.0 109.937 -179.883 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -152.62 159.65 43.22 Favored 'General case' 0 N--CA 1.49 1.565 0 CA-C-O 121.506 0.67 . . . . 0.0 109.591 179.708 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 96.5 mtt-85 -127.07 149.82 49.75 Favored 'General case' 0 N--CA 1.497 1.917 0 CA-C-O 121.553 0.692 . . . . 0.0 109.841 -179.528 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 80' ' ' PHE . . . . . . . . . . . . . 35.8 m-85 -122.9 149.68 43.91 Favored 'General case' 0 N--CA 1.497 1.902 0 CA-C-O 121.736 0.779 . . . . 0.0 109.62 -179.653 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 49.7 mtmt -108.56 115.12 29.51 Favored 'General case' 0 N--CA 1.494 1.749 0 CA-C-O 121.62 0.724 . . . . 0.0 109.437 -179.505 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 82' ' ' PHE . . . . . 0.677 ' C ' ' H ' ' A' ' 84' ' ' VAL . 53.6 m-85 -110.56 -0.7 17.21 Favored 'General case' 0 N--CA 1.497 1.889 0 N-CA-C 108.567 -0.901 . . . . 0.0 108.567 179.643 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 41.7 mm-40 63.62 -20.99 0.06 Allowed 'General case' 0 N--CA 1.492 1.657 0 N-CA-C 109.277 -0.638 . . . . 0.0 109.277 179.936 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 84' ' ' VAL . . . . . 0.677 ' H ' ' C ' ' A' ' 82' ' ' PHE . 3.3 m -133.83 133.58 56.49 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.519 0 CA-C-O 121.822 0.82 . . . . 0.0 109.674 -179.621 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 85' ' ' SER . . . . . 0.52 ' O ' ' N ' ' A' ' 88' ' ' LYS . 14.2 t -64.97 -41.0 95.82 Favored 'General case' 0 C--N 1.3 -1.581 0 CA-C-O 121.214 0.531 . . . . 0.0 110.156 179.919 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 86' ' ' ALA . . . . . 0.423 ' C ' ' O ' ' A' ' 85' ' ' SER . . . -41.15 -38.13 1.02 Allowed 'General case' 0 N--CA 1.496 1.854 0 O-C-N 121.514 -0.742 . . . . 0.0 110.121 -178.802 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -69.95 -32.88 71.36 Favored 'General case' 0 N--CA 1.489 1.5 0 O-C-N 121.481 -0.762 . . . . 0.0 109.517 -179.886 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 88' ' ' LYS . . . . . 0.52 ' N ' ' O ' ' A' ' 85' ' ' SER . 64.3 tttm -61.67 -47.19 86.49 Favored 'General case' 0 C--N 1.3 -1.569 0 O-C-N 121.845 -0.534 . . . . 0.0 109.88 -178.937 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 96.0 mt -64.76 -47.92 76.4 Favored 'General case' 0 N--CA 1.493 1.703 0 O-C-N 121.67 -0.644 . . . . 0.0 110.464 -178.94 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 90' ' ' ILE . . . . . . . . . . . . . 96.3 mt -69.6 -43.97 79.95 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.647 0 O-C-N 121.637 -0.665 . . . . 0.0 109.64 -179.887 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 91' ' ' PHE . . . . . . . . . . . . . 82.6 t80 -62.26 -44.74 95.85 Favored 'General case' 0 N--CA 1.493 1.717 0 O-C-N 121.59 -0.694 . . . . 0.0 109.354 -179.979 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 92' ' ' GLU . . . . . . . . . . . . . 81.4 tt0 -63.55 -43.12 97.99 Favored 'General case' 0 N--CA 1.489 1.507 0 N-CA-C 109.309 -0.626 . . . . 0.0 109.309 -179.576 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 93' ' ' LEU . . . . . 0.612 ' O ' HD23 ' A' ' 93' ' ' LEU . 2.8 tt -63.26 -47.26 83.14 Favored 'General case' 0 N--CA 1.489 1.498 0 CA-C-O 121.667 0.746 . . . . 0.0 109.624 -179.119 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 94' ' ' LYS . . . . . . . . . . . . . 55.2 mtpt -63.9 -44.97 91.4 Favored 'General case' 0 N--CA 1.49 1.559 0 O-C-N 121.492 -0.755 . . . . 0.0 109.792 -179.177 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 14.4 p -66.48 -39.86 89.0 Favored 'General case' 0 N--CA 1.492 1.625 0 O-C-N 121.794 -0.566 . . . . 0.0 110.037 -179.539 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 96' ' ' ARG . . . . . . . . . . . . . 16.1 tpt85 -70.77 -17.99 62.77 Favored 'General case' 0 C--N 1.3 -1.555 0 O-C-N 121.562 -0.711 . . . . 0.0 109.788 -179.484 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 97' ' ' ALA . . . . . . . . . . . . . . . -78.87 -43.69 24.46 Favored 'General case' 0 N--CA 1.491 1.604 0 O-C-N 121.624 -0.673 . . . . 0.0 109.761 -179.25 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 98' ' ' LEU . . . . . . . . . . . . . 2.2 pp -88.81 -18.29 28.0 Favored 'General case' 0 N--CA 1.493 1.689 0 N-CA-C 109.201 -0.666 . . . . 0.0 109.201 -179.302 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 99' ' ' ALA . . . . . . . . . . . . . . . -84.19 -40.66 17.87 Favored 'General case' 0 N--CA 1.492 1.675 0 O-C-N 121.623 -0.673 . . . . 0.0 109.441 -179.062 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 100' ' ' ARG . . . . . . . . . . . . . 9.5 ptm180 -64.34 -31.92 73.31 Favored 'General case' 0 N--CA 1.492 1.647 0 N-CA-C 108.953 -0.758 . . . . 0.0 108.953 -179.9 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 101' ' ' LEU . . . . . . . . . . . . . 96.9 mt -71.73 145.98 48.44 Favored 'General case' 0 N--CA 1.492 1.663 0 CA-C-O 121.651 0.738 . . . . 0.0 110.139 -179.556 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 102' ' ' GLU . . . . . 0.497 ' O ' ' N ' ' A' ' 104' ' ' HIS . 83.4 tt0 -159.45 116.21 2.62 Favored 'General case' 0 N--CA 1.492 1.666 0 CA-C-O 121.753 0.787 . . . . 0.0 109.672 179.809 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 103' ' ' HIS . . . . . . . . . . . . . 92.6 m-70 41.42 -92.59 0.01 OUTLIER 'General case' 0 N--CA 1.494 1.73 0 CA-C-O 121.458 0.647 . . . . 0.0 110.166 179.964 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 104' ' ' HIS . . . . . 0.599 ' ND1' ' N ' ' A' ' 105' ' ' HIS . 0.3 OUTLIER 44.45 -114.69 0.4 Allowed 'General case' 0 N--CA 1.493 1.676 0 CA-C-O 121.262 0.553 . . . . 0.0 110.017 -179.866 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 105' ' ' HIS . . . . . 0.599 ' N ' ' ND1' ' A' ' 104' ' ' HIS . 60.2 t-80 53.72 -80.61 0.01 OUTLIER 'General case' 0 N--CA 1.489 1.521 0 CA-C-O 121.364 0.602 . . . . 0.0 109.985 -179.69 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 106' ' ' HIS . . . . . 0.567 ' N ' ' O ' ' A' ' 104' ' ' HIS . 94.9 m-70 56.42 90.1 0.04 OUTLIER 'General case' 0 C--N 1.302 -1.496 0 CA-C-O 121.721 0.772 . . . . 0.0 109.97 -179.786 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 107' ' ' HIS . . . . . 0.402 ' O ' ' O ' ' A' ' 106' ' ' HIS . 98.7 m-70 46.28 -175.72 0.01 OUTLIER 'General case' 0 N--CA 1.492 1.672 0 CA-C-O 121.766 0.793 . . . . 0.0 110.888 179.608 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 108' ' ' HIS . . . . . . . . . . . . . 41.2 p-80 . . . . . 0 N--CA 1.488 1.437 0 CA-C-O 117.909 -1.044 . . . . 0.0 109.396 -179.732 . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 97.4 mmm . . . . . 0 N--CA 1.49 1.54 0 CA-C-O 121.359 0.599 . . . . 0.0 109.97 . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 51.0 m -61.9 -36.54 81.61 Favored 'General case' 0 N--CA 1.494 1.73 0 CA-C-O 121.232 0.539 . . . . 0.0 109.741 -179.579 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 3' ' ' ASN . . . . . . . . . . . . . 9.4 m120 -62.42 -39.56 93.68 Favored 'General case' 0 N--CA 1.494 1.729 0 N-CA-C 109.105 -0.702 . . . . 0.0 109.105 -179.638 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 77.9 mt-30 57.88 24.28 10.72 Favored 'General case' 0 N--CA 1.493 1.689 0 N-CA-C 109.122 -0.696 . . . . 0.0 109.122 -179.847 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 5' ' ' THR . . . . . 0.407 ' H ' HG22 ' A' ' 5' ' ' THR . 0.0 OUTLIER -56.22 98.83 0.03 OUTLIER 'General case' 0 N--CA 1.491 1.582 0 CA-C-O 121.958 0.885 . . . . 0.0 109.626 -179.673 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 1.7 p -83.6 -70.06 0.59 Allowed 'General case' 0 N--CA 1.49 1.554 0 N-CA-C 109.367 -0.605 . . . . 0.0 109.367 179.964 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 7' ' ' VAL . . . . . . . . . . . . . 88.8 t -105.87 -45.25 8.34 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.84 0 O-C-N 121.729 -0.607 . . . . 0.0 109.504 -179.33 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 44.5 tp10 51.44 93.3 0.02 OUTLIER 'General case' 0 N--CA 1.496 1.84 0 CA-C-O 121.609 0.719 . . . . 0.0 109.613 -179.843 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 52.5 t30 -87.72 111.78 21.69 Favored 'General case' 0 N--CA 1.494 1.752 0 CA-C-O 121.692 0.758 . . . . 0.0 110.137 -179.713 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 96.8 mt-10 -64.43 148.89 49.54 Favored 'General case' 0 N--CA 1.493 1.701 0 CA-C-O 121.756 0.789 . . . . 0.0 110.198 -179.737 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 58.0 t -104.78 127.51 59.19 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.859 0 CA-C-O 121.809 0.814 . . . . 0.0 109.759 -179.31 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 10.7 t -89.69 122.41 32.78 Favored 'General case' 0 N--CA 1.493 1.711 0 CA-C-O 121.665 0.745 . . . . 0.0 110.212 -179.626 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 13' ' ' GLU . . . . . 0.543 ' O ' ' N ' ' A' ' 15' ' ' CYS . 79.8 mm-40 -92.93 -10.17 37.45 Favored 'General case' 0 N--CA 1.493 1.692 0 N-CA-C 108.748 -0.834 . . . . 0.0 108.748 179.228 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . 45.48 13.84 0.01 OUTLIER 'General case' 0 N--CA 1.496 1.858 0 CA-C-O 121.327 0.584 . . . . 0.0 109.848 179.974 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 15' ' ' CYS . . . . . 0.543 ' N ' ' O ' ' A' ' 13' ' ' GLU . 5.4 t -71.83 -31.37 66.47 Favored 'General case' 0 N--CA 1.49 1.558 0 O-C-N 121.822 -0.549 . . . . 0.0 109.524 179.903 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . -81.38 -4.21 90.48 Favored Glycine 0 N--CA 1.492 2.432 0 N-CA-C 109.313 -1.515 . . . . 0.0 109.313 -179.37 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 74.1 m -81.16 57.93 3.34 Favored 'General case' 0 N--CA 1.492 1.66 0 O-C-N 121.707 -0.879 . . . . 0.0 109.497 -179.678 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -170.75 100.46 0.23 Allowed 'General case' 0 N--CA 1.489 1.496 0 CA-C-O 121.764 0.792 . . . . 0.0 109.793 179.24 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 71.0 -175.33 38.89 Favored Glycine 0 N--CA 1.493 2.461 0 N-CA-C 111.05 -0.82 . . . . 0.0 111.05 178.938 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 97.9 mt-10 -70.28 131.18 43.78 Favored 'General case' 0 N--CA 1.491 1.604 0 CA-C-O 121.8 0.809 . . . . 0.0 109.878 -179.754 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 21' ' ' ILE . . . . . 0.509 ' H ' HD13 ' A' ' 21' ' ' ILE . 0.0 OUTLIER -92.15 133.95 31.93 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.715 0 CA-C-O 121.822 0.82 . . . . 0.0 110.273 -179.333 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 80.7 20.44 65.94 Favored Glycine 0 N--CA 1.493 2.454 0 N-CA-C 109.318 -1.513 . . . . 0.0 109.318 179.434 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 23' ' ' PHE . . . . . . . . . . . . . 89.5 t80 -96.11 -10.77 27.49 Favored 'General case' 0 N--CA 1.494 1.763 0 O-C-N 121.683 -0.892 . . . . 0.0 109.541 -179.584 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 16.9 tt -82.99 -16.62 11.35 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.788 0 O-C-N 121.473 -0.767 . . . . 0.0 109.436 179.822 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 25' ' ' ILE . . . . . . . . . . . . . 96.6 mt -64.54 -42.94 96.62 Favored 'Isoleucine or valine' 0 N--CA 1.499 2.004 0 O-C-N 121.419 -0.801 . . . . 0.0 109.229 179.922 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 84.2 mtp180 56.09 174.48 0.03 OUTLIER 'General case' 0 N--CA 1.494 1.744 0 CA-C-O 121.716 0.77 . . . . 0.0 111.059 -179.95 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 82.8 tt0 -69.28 84.04 0.37 Allowed 'General case' 0 N--CA 1.494 1.77 0 CA-C-O 121.71 0.767 . . . . 0.0 110.204 -179.066 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . -84.71 173.58 49.36 Favored Glycine 0 N--CA 1.492 2.372 0 N-CA-C 110.147 -1.181 . . . . 0.0 110.147 179.73 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 99.2 m-20 -69.23 -26.64 64.9 Favored 'General case' 0 N--CA 1.491 1.616 0 O-C-N 121.904 -0.763 . . . . 0.0 109.434 179.975 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 38.3 p30 -97.96 23.91 7.55 Favored 'General case' 0 N--CA 1.495 1.78 0 N-CA-C 108.822 -0.807 . . . . 0.0 108.822 -179.888 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 53.3 t -115.99 133.59 61.97 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.9 0 CA-C-O 121.795 0.807 . . . . 0.0 109.41 179.934 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -97.98 154.18 17.86 Favored 'General case' 0 N--CA 1.494 1.744 0 CA-C-O 121.871 0.843 . . . . 0.0 110.135 -179.47 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 33' ' ' GLU . . . . . 0.508 ' OE2' ' NE2' ' A' ' 77' ' ' HIS . 49.7 tp10 -101.58 124.21 46.87 Favored 'General case' 0 N--CA 1.492 1.645 0 CA-C-O 121.515 0.674 . . . . 0.0 109.528 -179.667 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 34' ' ' VAL . . . . . . . . . . . . . 55.7 t -124.24 131.99 72.02 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.791 0 CA-C-O 121.889 0.852 . . . . 0.0 109.689 179.774 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 38.1 t -136.11 138.78 42.41 Favored 'General case' 0 N--CA 1.492 1.637 0 CA-C-O 121.545 0.688 . . . . 0.0 109.35 179.498 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 47.2 tp -126.89 139.33 53.16 Favored 'General case' 0 N--CA 1.493 1.719 0 CA-C-O 121.795 0.807 . . . . 0.0 110.076 -179.664 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 37' ' ' PHE . . . . . . . . . . . . . 96.9 m-85 -112.36 144.77 41.23 Favored 'General case' 0 N--CA 1.496 1.828 0 CA-C-O 121.797 0.808 . . . . 0.0 109.694 179.917 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . -171.0 176.35 44.41 Favored Glycine 0 N--CA 1.489 2.226 0 N-CA-C 110.23 -1.148 . . . . 0.0 110.23 -179.909 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 1.7 m -83.55 -71.59 0.5 Allowed 'General case' 0 N--CA 1.489 1.482 0 O-C-N 121.854 -0.792 . . . . 0.0 109.751 -179.758 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 40' ' ' ASP . . . . . . . . . . . . . 37.0 t70 -98.78 159.06 15.22 Favored 'General case' 0 N--CA 1.498 1.96 0 CA-C-O 121.952 0.882 . . . . 0.0 110.65 -179.223 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 41' ' ' LYS . . . . . 0.43 ' O ' ' OE1' ' A' ' 45' ' ' GLU . 64.5 tttm -62.79 -42.26 99.63 Favored 'General case' 0 N--CA 1.491 1.587 0 CA-C-N 116.091 -0.504 . . . . 0.0 110.213 -179.971 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -49.88 -43.08 49.15 Favored 'General case' 0 N--CA 1.493 1.71 0 O-C-N 121.591 -0.693 . . . . 0.0 109.747 -178.828 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 43' ' ' HIS . . . . . . . . . . . . . 79.7 m-70 -67.47 -42.42 83.04 Favored 'General case' 0 N--CA 1.49 1.527 0 O-C-N 121.701 -0.624 . . . . 0.0 109.506 -179.933 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 81.8 mt -64.27 -44.0 93.07 Favored 'General case' 0 N--CA 1.494 1.737 0 O-C-N 121.742 -0.599 . . . . 0.0 109.792 -179.633 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 45' ' ' GLU . . . . . 0.503 ' OE1' ' N ' ' A' ' 45' ' ' GLU . 2.7 mp0 -66.7 -40.51 88.51 Favored 'General case' 0 N--CA 1.488 1.474 0 O-C-N 121.69 -0.631 . . . . 0.0 109.352 -179.799 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . -60.72 -44.73 97.59 Favored Glycine 0 N--CA 1.492 2.397 0 N-CA-C 109.699 -1.36 . . . . 0.0 109.699 -179.189 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 54.9 mtpt -71.16 -25.6 62.62 Favored 'General case' 0 N--CA 1.49 1.532 0 O-C-N 121.781 -0.835 . . . . 0.0 109.102 179.843 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 48' ' ' LEU . . . . . 0.59 HD13 ' O ' ' A' ' 48' ' ' LEU . 0.3 OUTLIER -61.52 -44.86 96.29 Favored 'General case' 0 C--N 1.303 -1.434 0 O-C-N 121.572 -0.705 . . . . 0.0 109.353 -179.102 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 49' ' ' ALA . . . . . . . . . . . . . . . -53.83 -35.85 61.9 Favored 'General case' 0 N--CA 1.493 1.721 0 O-C-N 121.442 -0.786 . . . . 0.0 109.488 -179.328 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 72.9 mm-40 -69.16 -37.28 78.13 Favored 'General case' 0 N--CA 1.491 1.597 0 N-CA-C 109.258 -0.645 . . . . 0.0 109.258 -179.983 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 4.4 m-85 -63.46 -39.37 94.28 Favored 'General case' 0 N--CA 1.496 1.859 0 O-C-N 121.669 -0.644 . . . . 0.0 109.496 -179.458 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 52' ' ' ILE . . . . . 0.581 HD12 ' CZ ' ' A' ' 64' ' ' TYR . 31.9 mm -64.07 -44.28 97.68 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.611 0 O-C-N 121.634 -0.666 . . . . 0.0 109.626 -179.424 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 66.9 m -60.55 -41.62 94.91 Favored 'General case' 0 N--CA 1.493 1.7 0 O-C-N 121.815 -0.553 . . . . 0.0 109.574 -179.696 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 54' ' ' LEU . . . . . . . . . . . . . 95.4 mt -64.04 -40.49 96.42 Favored 'General case' 0 N--CA 1.492 1.634 0 O-C-N 121.658 -0.651 . . . . 0.0 109.315 -179.926 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -57.92 -46.47 84.95 Favored 'General case' 0 N--CA 1.491 1.619 0 CA-C-O 121.148 0.499 . . . . 0.0 110.147 -178.984 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 56' ' ' LYS . . . . . 0.447 ' HZ2' HG22 ' A' ' 52' ' ' ILE . 62.7 mttp -64.59 -41.53 96.18 Favored 'General case' 0 N--CA 1.491 1.584 0 O-C-N 121.631 -0.668 . . . . 0.0 109.955 -179.742 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 88.2 mt-30 -64.66 -43.65 92.93 Favored 'General case' 0 N--CA 1.491 1.598 0 O-C-N 121.499 -0.751 . . . . 0.0 109.287 -179.726 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 58' ' ' VAL . . . . . . . . . . . . . 77.9 t -65.92 -44.54 92.47 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.619 0 O-C-N 121.742 -0.599 . . . . 0.0 109.419 -179.881 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 59' ' ' TYR . . . . . 0.404 ' O ' ' O ' ' A' ' 60' ' ' ALA . 75.8 t80 -137.47 151.56 48.6 Favored 'General case' 0 N--CA 1.496 1.861 0 CA-C-O 121.913 0.863 . . . . 0.0 110.318 -179.521 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 60' ' ' ALA . . . . . 0.538 ' O ' ' N ' ' A' ' 62' ' ' VAL . . . -59.85 -143.3 0.0 OUTLIER 'General case' 0 N--CA 1.491 1.587 0 CA-C-O 121.449 0.642 . . . . 0.0 110.693 -179.298 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 61' ' ' ASN . . . . . . . . . . . . . 99.3 m-20 -43.67 91.6 0.0 OUTLIER 'General case' 0 N--CA 1.495 1.802 0 CA-C-O 121.85 0.834 . . . . 0.0 109.879 -178.836 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 62' ' ' VAL . . . . . 0.538 ' N ' ' O ' ' A' ' 60' ' ' ALA . 13.2 p -99.42 132.58 44.58 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.503 0 CA-C-O 121.897 0.856 . . . . 0.0 110.279 -179.438 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 63' ' ' GLU . . . . . 0.533 ' OE1' ' N ' ' A' ' 63' ' ' GLU . 57.1 mp0 -105.42 136.51 44.84 Favored 'General case' 0 N--CA 1.492 1.637 0 CA-C-O 121.726 0.774 . . . . 0.0 109.44 -179.764 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 64' ' ' TYR . . . . . 0.581 ' CZ ' HD12 ' A' ' 52' ' ' ILE . 53.5 p90 -149.6 161.84 41.38 Favored 'General case' 0 N--CA 1.491 1.584 0 CA-C-O 121.778 0.799 . . . . 0.0 110.246 -179.516 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 48.7 tp10 -143.39 144.76 32.18 Favored 'General case' 0 N--CA 1.493 1.703 0 CA-C-O 121.736 0.779 . . . . 0.0 109.266 179.412 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 66' ' ' VAL . . . . . . . . . . . . . 14.7 p -121.27 129.95 75.13 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.713 0 CA-C-O 121.866 0.841 . . . . 0.0 109.893 -179.852 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 67' ' ' ALA . . . . . 0.479 ' HB1' ' HD2' ' A' ' 68' ' ' PRO . . . -77.76 159.85 75.63 Favored Pre-proline 0 N--CA 1.49 1.55 0 N-CA-C 109.398 -0.593 . . . . 0.0 109.398 -179.699 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 68' ' ' PRO . . . . . 0.479 ' HD2' ' HB1' ' A' ' 67' ' ' ALA . 17.9 Cg_endo -59.58 140.28 93.07 Favored 'Trans proline' 0 C--N 1.309 -1.545 0 C-N-CA 122.579 2.186 . . . . 0.0 112.57 179.41 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 69' ' ' VAL . . . . . . . . . . . . . 49.6 t -133.8 136.21 54.3 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.787 0 CA-C-O 121.835 0.826 . . . . 0.0 110.074 -179.723 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -76.69 165.52 24.63 Favored 'General case' 0 N--CA 1.492 1.654 0 CA-C-O 121.875 0.845 . . . . 0.0 110.504 -179.953 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 62.0 t0 -63.14 -44.45 95.51 Favored 'General case' 0 N--CA 1.489 1.487 0 CA-C-O 121.224 0.535 . . . . 0.0 109.926 -179.614 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 72' ' ' ASN . . . . . . . . . . . . . 98.5 m-20 -99.75 24.91 7.75 Favored 'General case' 0 N--CA 1.494 1.768 0 N-CA-C 109.347 -0.612 . . . . 0.0 109.347 -179.146 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 73' ' ' ALA . . . . . 0.55 ' C ' ' H ' ' A' ' 75' ' ' GLU . . . -64.47 -26.11 68.3 Favored 'General case' 0 N--CA 1.492 1.666 0 O-C-N 121.607 -0.683 . . . . 0.0 109.228 179.825 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 74' ' ' THR . . . . . 0.48 ' OG1' ' O ' ' A' ' 73' ' ' ALA . 63.0 p 53.35 4.04 0.04 OUTLIER 'General case' 0 N--CA 1.493 1.683 0 CA-C-O 121.256 0.55 . . . . 0.0 109.625 -179.347 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 75' ' ' GLU . . . . . 0.55 ' H ' ' C ' ' A' ' 73' ' ' ALA . 96.5 mt-10 -144.69 156.83 44.28 Favored 'General case' 0 N--CA 1.491 1.605 0 CA-C-O 121.975 0.893 . . . . 0.0 110.135 179.85 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 4.1 tt -141.24 141.09 34.03 Favored 'General case' 0 C--N 1.304 -1.405 0 CA-C-O 121.622 0.725 . . . . 0.0 109.857 -179.907 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 77' ' ' HIS . . . . . 0.508 ' NE2' ' OE2' ' A' ' 33' ' ' GLU . 63.1 t-80 -120.38 128.48 53.26 Favored 'General case' 0 N--CA 1.494 1.735 0 CA-C-O 121.928 0.87 . . . . 0.0 109.763 -179.978 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -150.16 155.21 39.37 Favored 'General case' 0 N--CA 1.49 1.536 0 CA-C-O 121.688 0.756 . . . . 0.0 109.696 179.937 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 33.2 ptt-85 -135.03 153.16 52.16 Favored 'General case' 0 N--CA 1.495 1.778 0 CA-C-O 121.814 0.816 . . . . 0.0 109.845 -179.778 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 80' ' ' PHE . . . . . . . . . . . . . 45.5 m-85 -133.16 153.38 51.58 Favored 'General case' 0 N--CA 1.495 1.821 0 CA-C-O 121.694 0.759 . . . . 0.0 110.175 -179.265 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 64.2 tttm -107.4 125.66 51.5 Favored 'General case' 0 N--CA 1.496 1.841 0 CA-C-O 121.595 0.712 . . . . 0.0 109.366 179.968 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 82' ' ' PHE . . . . . . . . . . . . . 63.1 m-85 -123.21 146.51 47.76 Favored 'General case' 0 N--CA 1.495 1.821 0 CA-C-O 121.615 0.721 . . . . 0.0 109.936 -179.896 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 81.3 tt0 -69.04 -37.88 78.83 Favored 'General case' 0 N--CA 1.491 1.595 0 N-CA-C 109.222 -0.658 . . . . 0.0 109.222 -179.579 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 84' ' ' VAL . . . . . . . . . . . . . 35.1 m -135.79 159.11 39.72 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.926 0 CA-C-O 121.889 0.852 . . . . 0.0 109.984 -179.933 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 85' ' ' SER . . . . . 0.481 ' O ' ' N ' ' A' ' 88' ' ' LYS . 11.2 t -63.62 -42.61 98.19 Favored 'General case' 0 N--CA 1.49 1.563 0 CA-C-O 121.193 0.521 . . . . 0.0 110.08 -179.775 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 86' ' ' ALA . . . . . . . . . . . . . . . -41.23 -40.95 1.73 Allowed 'General case' 0 N--CA 1.494 1.752 0 CA-C-O 121.278 0.561 . . . . 0.0 110.07 -178.976 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 96.6 mt-10 -67.52 -33.17 74.53 Favored 'General case' 0 N--CA 1.491 1.577 0 O-C-N 121.677 -0.64 . . . . 0.0 109.64 -179.829 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 88' ' ' LYS . . . . . 0.481 ' N ' ' O ' ' A' ' 85' ' ' SER . 64.4 tttm -62.37 -45.61 92.38 Favored 'General case' 0 N--CA 1.493 1.677 0 O-C-N 121.645 -0.659 . . . . 0.0 109.673 -179.627 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 89' ' ' LEU . . . . . 0.494 HD22 ' N ' ' A' ' 89' ' ' LEU . 3.8 mm? -64.3 -42.05 96.56 Favored 'General case' 0 N--CA 1.492 1.633 0 O-C-N 121.519 -0.738 . . . . 0.0 109.796 -179.447 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 90' ' ' ILE . . . . . . . . . . . . . 95.3 mt -65.99 -44.23 92.36 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.669 0 CA-C-O 121.325 0.583 . . . . 0.0 109.934 -179.398 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 91' ' ' PHE . . . . . . . . . . . . . 71.3 t80 -61.97 -45.58 93.01 Favored 'General case' 0 N--CA 1.493 1.707 0 O-C-N 121.689 -0.632 . . . . 0.0 109.993 -179.18 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 92' ' ' GLU . . . . . 0.555 ' N ' ' OE1' ' A' ' 92' ' ' GLU . 1.9 mp0 -64.8 -37.98 89.44 Favored 'General case' 0 N--CA 1.491 1.592 0 O-C-N 121.555 -0.716 . . . . 0.0 110.175 -178.976 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 93' ' ' LEU . . . . . . . . . . . . . 5.1 tt -62.11 -45.17 94.66 Favored 'General case' 0 C--N 1.299 -1.599 0 O-C-N 121.472 -0.767 . . . . 0.0 109.958 -178.845 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 94' ' ' LYS . . . . . . . . . . . . . 98.8 mttt -66.14 -43.13 87.95 Favored 'General case' 0 N--CA 1.493 1.694 0 O-C-N 121.826 -0.546 . . . . 0.0 110.045 -179.508 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 21.2 p -67.94 -38.08 82.41 Favored 'General case' 0 N--CA 1.493 1.708 0 O-C-N 121.557 -0.714 . . . . 0.0 109.629 -179.217 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 96' ' ' ARG . . . . . . . . . . . . . 73.6 mmt-85 -64.47 -40.86 96.49 Favored 'General case' 0 C--N 1.301 -1.502 0 O-C-N 121.592 -0.692 . . . . 0.0 109.639 -179.891 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 97' ' ' ALA . . . . . . . . . . . . . . . -63.47 -47.88 80.0 Favored 'General case' 0 C--N 1.302 -1.472 0 N-CA-C 108.994 -0.743 . . . . 0.0 108.994 -179.93 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 98' ' ' LEU . . . . . . . . . . . . . 88.8 mt -65.25 -42.08 93.67 Favored 'General case' 0 N--CA 1.488 1.466 0 N-CA-C 108.852 -0.796 . . . . 0.0 108.852 179.889 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 99' ' ' ALA . . . . . . . . . . . . . . . -65.01 -38.28 90.4 Favored 'General case' 0 N--CA 1.489 1.475 0 N-CA-C 109.515 -0.55 . . . . 0.0 109.515 -179.7 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 100' ' ' ARG . . . . . 0.435 ' O ' ' O ' ' A' ' 101' ' ' LEU . 84.4 mmt-85 -87.9 -6.24 58.16 Favored 'General case' 0 N--CA 1.493 1.714 0 O-C-N 121.499 -0.751 . . . . 0.0 109.003 179.98 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 101' ' ' LEU . . . . . 0.435 ' O ' ' O ' ' A' ' 100' ' ' ARG . 75.9 mt 58.39 126.09 0.01 OUTLIER 'General case' 0 N--CA 1.491 1.612 0 CA-C-O 121.904 0.859 . . . . 0.0 110.545 179.581 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 102' ' ' GLU . . . . . . . . . . . . . 47.7 tp10 -66.27 135.65 54.74 Favored 'General case' 0 C--N 1.303 -1.436 0 CA-C-O 121.805 0.812 . . . . 0.0 109.902 -179.225 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 103' ' ' HIS . . . . . . . . . . . . . 60.0 t-80 -145.41 133.34 21.3 Favored 'General case' 0 N--CA 1.49 1.57 0 CA-C-O 121.711 0.767 . . . . 0.0 109.921 179.688 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 104' ' ' HIS . . . . . 0.463 ' ND1' ' N ' ' A' ' 104' ' ' HIS . 0.0 OUTLIER -173.4 81.96 0.04 OUTLIER 'General case' 0 N--CA 1.49 1.573 0 CA-C-O 121.488 0.661 . . . . 0.0 109.32 179.443 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 105' ' ' HIS . . . . . 0.402 ' C ' ' O ' ' A' ' 104' ' ' HIS . 98.7 m-70 37.82 90.27 0.01 OUTLIER 'General case' 0 N--CA 1.5 2.027 0 CA-C-O 121.763 0.792 . . . . 0.0 110.661 179.879 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 106' ' ' HIS . . . . . 0.486 ' CG ' ' N ' ' A' ' 107' ' ' HIS . 52.1 p-80 -64.71 -43.47 93.35 Favored 'General case' 0 C--N 1.305 -1.362 0 N-CA-C 109.087 -0.709 . . . . 0.0 109.087 179.856 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 107' ' ' HIS . . . . . 0.486 ' N ' ' CG ' ' A' ' 106' ' ' HIS . 36.5 t-80 -79.22 130.63 35.66 Favored 'General case' 0 N--CA 1.493 1.698 0 CA-C-O 121.939 0.876 . . . . 0.0 110.11 -179.536 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 108' ' ' HIS . . . . . . . . . . . . . 63.2 t-80 . . . . . 0 N--CA 1.489 1.488 0 CA-C-O 117.799 -1.096 . . . . 0.0 109.797 179.779 . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 97.5 mmm . . . . . 0 N--CA 1.489 1.497 0 CA-C-O 121.487 0.661 . . . . 0.0 109.862 . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 25.5 p -155.24 161.95 41.03 Favored 'General case' 0 N--CA 1.495 1.776 0 CA-C-O 121.719 0.771 . . . . 0.0 110.11 179.933 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 3' ' ' ASN . . . . . . . . . . . . . 54.6 p30 -106.56 12.03 29.92 Favored 'General case' 0 N--CA 1.497 1.895 0 N-CA-C 109.065 -0.717 . . . . 0.0 109.065 -179.807 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 26.3 mt-30 -73.12 124.78 26.25 Favored 'General case' 0 N--CA 1.493 1.697 0 CA-C-O 121.658 0.742 . . . . 0.0 109.703 -179.69 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 57.5 p -90.69 134.01 34.72 Favored 'General case' 0 N--CA 1.494 1.729 0 CA-C-O 121.691 0.758 . . . . 0.0 109.925 -179.664 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 1.1 t -64.91 -40.4 95.01 Favored 'General case' 0 N--CA 1.489 1.503 0 CA-C-O 121.288 0.566 . . . . 0.0 109.677 -179.913 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 7' ' ' VAL . . . . . . . . . . . . . 4.4 m -86.67 131.72 34.08 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.605 0 CA-C-O 121.695 0.76 . . . . 0.0 110.09 -179.039 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 8' ' ' GLU . . . . . 0.421 ' HG2' ' H ' ' A' ' 10' ' ' GLU . 82.0 tt0 -161.36 -75.79 0.05 Allowed 'General case' 0 N--CA 1.489 1.478 0 N-CA-C 109.264 -0.643 . . . . 0.0 109.264 179.79 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 9' ' ' ASN . . . . . 0.587 ' ND2' ' SG ' ' A' ' 12' ' ' CYS . 13.9 t-20 58.45 37.32 25.7 Favored 'General case' 0 N--CA 1.492 1.634 0 CA-C-O 121.466 0.65 . . . . 0.0 109.377 -179.773 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 10' ' ' GLU . . . . . 0.421 ' H ' ' HG2' ' A' ' 8' ' ' GLU . 83.8 tt0 -102.17 -22.26 14.23 Favored 'General case' 0 N--CA 1.494 1.771 0 N-CA-C 109.17 -0.678 . . . . 0.0 109.17 179.922 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 33.1 m -89.78 -5.94 10.74 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.674 0 N-CA-C 108.934 -0.765 . . . . 0.0 108.934 -179.892 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 12' ' ' CYS . . . . . 0.587 ' SG ' ' ND2' ' A' ' 9' ' ' ASN . 16.2 p -83.91 134.28 34.68 Favored 'General case' 0 N--CA 1.492 1.633 0 CA-C-O 121.692 0.758 . . . . 0.0 110.126 179.753 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 16.2 pt-20 -159.1 -24.85 0.07 Allowed 'General case' 0 N--CA 1.49 1.547 0 N-CA-C 109.05 -0.722 . . . . 0.0 109.05 179.756 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -84.23 -7.46 59.34 Favored 'General case' 0 N--CA 1.493 1.691 0 N-CA-C 108.792 -0.818 . . . . 0.0 108.792 -179.812 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 61.3 m -125.88 107.52 10.57 Favored 'General case' 0 N--CA 1.499 1.995 0 CA-C-O 121.784 0.802 . . . . 0.0 109.749 179.82 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . -89.19 -83.6 1.3 Allowed Glycine 0 N--CA 1.491 2.355 0 N-CA-C 109.813 -1.315 . . . . 0.0 109.813 -179.992 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 1.2 t -66.2 -38.91 89.13 Favored 'General case' 0 N--CA 1.493 1.719 0 O-C-N 121.819 -0.812 . . . . 0.0 109.757 -179.464 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . 53.68 34.93 19.93 Favored 'General case' 0 N--CA 1.491 1.608 0 CA-C-O 121.414 0.626 . . . . 0.0 109.422 -179.672 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -81.19 -5.05 90.35 Favored Glycine 0 N--CA 1.491 2.326 0 N-CA-C 109.311 -1.516 . . . . 0.0 109.311 179.961 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 84.7 tt0 -73.34 125.36 27.65 Favored 'General case' 0 N--CA 1.494 1.739 0 O-C-N 121.727 -0.866 . . . . 0.0 109.838 -179.645 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 21' ' ' ILE . . . . . . . . . . . . . 38.9 mm -57.52 -81.02 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.49 1.542 0 N-CA-C 109.515 -0.55 . . . . 0.0 109.515 -179.774 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 41.63 86.4 0.01 OUTLIER Glycine 0 N--CA 1.497 2.711 0 N-CA-C 109.946 -1.262 . . . . 0.0 109.946 -179.843 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 23' ' ' PHE . . . . . . . . . . . . . 49.5 t80 -62.36 -47.51 83.89 Favored 'General case' 0 N--CA 1.489 1.492 0 O-C-N 121.849 -0.795 . . . . 0.0 109.999 -179.66 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 24' ' ' ILE . . . . . 0.435 ' O ' ' O ' ' A' ' 25' ' ' ILE . 10.3 tp -171.53 130.38 0.14 Allowed 'Isoleucine or valine' 0 N--CA 1.49 1.544 0 O-C-N 121.671 -0.643 . . . . 0.0 110.396 179.964 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 25' ' ' ILE . . . . . 0.435 ' O ' ' O ' ' A' ' 24' ' ' ILE . 96.5 mt 41.61 95.02 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.494 1.751 0 CA-C-O 121.519 0.676 . . . . 0.0 110.127 179.635 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 9.6 ptm180 -76.77 156.04 32.67 Favored 'General case' 0 N--CA 1.495 1.81 0 CA-C-O 121.782 0.801 . . . . 0.0 110.766 -179.289 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 27' ' ' GLU . . . . . 0.478 ' CD ' ' N ' ' A' ' 28' ' ' GLY . 15.6 tm-20 -48.64 147.02 2.74 Favored 'General case' 0 N--CA 1.492 1.64 0 CA-C-O 121.838 0.827 . . . . 0.0 110.819 -179.268 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 28' ' ' GLY . . . . . 0.478 ' N ' ' CD ' ' A' ' 27' ' ' GLU . . . 88.7 -153.3 23.83 Favored Glycine 0 N--CA 1.49 2.272 0 N-CA-C 110.344 -1.102 . . . . 0.0 110.344 179.404 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 96.9 m-20 58.15 34.25 23.97 Favored 'General case' 0 N--CA 1.492 1.63 0 CA-C-O 121.316 0.579 . . . . 0.0 109.86 -179.714 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 34.8 t0 62.9 59.37 1.38 Allowed 'General case' 0 N--CA 1.491 1.608 0 CA-C-O 121.505 0.669 . . . . 0.0 109.513 179.391 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 53.6 t -117.79 133.93 63.01 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.802 0 CA-C-O 121.854 0.835 . . . . 0.0 109.276 179.989 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 32' ' ' ALA . . . . . 0.703 ' HB1' ' HZ2' ' A' ' 88' ' ' LYS . . . -99.22 151.67 20.76 Favored 'General case' 0 N--CA 1.49 1.528 0 CA-C-O 121.698 0.761 . . . . 0.0 109.838 -179.637 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 33' ' ' GLU . . . . . 0.543 ' N ' ' OE1' ' A' ' 33' ' ' GLU . 57.4 mp0 -110.17 120.04 41.2 Favored 'General case' 0 N--CA 1.492 1.675 0 CA-C-O 121.619 0.723 . . . . 0.0 109.442 -179.853 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 34' ' ' VAL . . . . . . . . . . . . . 55.0 t -125.42 133.8 68.37 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.73 0 CA-C-O 121.88 0.848 . . . . 0.0 109.605 179.996 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 15.6 m -153.87 138.94 17.33 Favored 'General case' 0 N--CA 1.49 1.532 0 CA-C-O 121.768 0.794 . . . . 0.0 109.425 179.412 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 36' ' ' LEU . . . . . 0.452 HD12 ' N ' ' A' ' 36' ' ' LEU . 8.2 mp -107.73 152.95 23.65 Favored 'General case' 0 N--CA 1.495 1.797 0 CA-C-O 121.823 0.821 . . . . 0.0 109.833 -179.628 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 37' ' ' PHE . . . . . . . . . . . . . 91.8 m-85 -127.67 149.14 50.34 Favored 'General case' 0 N--CA 1.491 1.58 0 CA-C-O 121.929 0.871 . . . . 0.0 109.962 -179.518 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 38' ' ' GLY . . . . . 0.426 ' O ' ' O ' ' A' ' 39' ' ' SER . . . 84.63 178.17 51.23 Favored Glycine 0 N--CA 1.487 2.084 0 N-CA-C 110.396 -1.082 . . . . 0.0 110.396 179.442 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 39' ' ' SER . . . . . 0.524 ' HG ' ' CG ' ' A' ' 43' ' ' HIS . 0.3 OUTLIER 55.66 159.78 0.01 OUTLIER 'General case' 0 N--CA 1.488 1.467 0 CA-C-O 121.659 0.743 . . . . 0.0 110.483 179.819 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 40' ' ' ASP . . . . . . . . . . . . . 54.9 p-10 -79.94 174.26 11.77 Favored 'General case' 0 N--CA 1.489 1.492 0 CA-C-O 121.906 0.86 . . . . 0.0 110.785 -179.11 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 41' ' ' LYS . . . . . 0.424 ' O ' ' OE1' ' A' ' 45' ' ' GLU . 21.1 tptm -59.48 -45.54 91.36 Favored 'General case' 0 C--N 1.306 -1.306 0 CA-C-N 116.022 -0.536 . . . . 0.0 110.105 -179.362 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -57.65 -47.32 82.6 Favored 'General case' 0 N--CA 1.492 1.645 0 O-C-N 121.735 -0.603 . . . . 0.0 109.886 -178.828 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 43' ' ' HIS . . . . . 0.524 ' CG ' ' HG ' ' A' ' 39' ' ' SER . 58.7 t-80 -68.33 -35.77 78.26 Favored 'General case' 0 N--CA 1.49 1.572 0 O-C-N 121.628 -0.67 . . . . 0.0 109.683 -179.736 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 13.9 mt -61.94 -42.53 99.21 Favored 'General case' 0 N--CA 1.492 1.67 0 O-C-N 121.625 -0.672 . . . . 0.0 109.386 -179.013 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 45' ' ' GLU . . . . . 0.512 ' OE1' ' N ' ' A' ' 45' ' ' GLU . 1.2 mp0 -63.32 -46.57 86.06 Favored 'General case' 0 N--CA 1.485 1.323 0 O-C-N 121.681 -0.637 . . . . 0.0 109.389 -179.587 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . -61.81 -44.22 98.17 Favored Glycine 0 N--CA 1.49 2.279 0 N-CA-C 109.044 -1.622 . . . . 0.0 109.044 -179.602 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 41.3 tptt -67.22 -35.41 79.54 Favored 'General case' 0 N--CA 1.485 1.315 0 O-C-N 121.834 -0.804 . . . . 0.0 109.039 179.887 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 27.1 tp -58.17 -29.99 66.05 Favored 'General case' 0 N--CA 1.492 1.638 0 N-CA-C 108.805 -0.813 . . . . 0.0 108.805 -179.394 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 49' ' ' ALA . . . . . . . . . . . . . . . -49.62 -27.93 5.18 Favored 'General case' 0 N--CA 1.492 1.651 0 CA-C-O 121.154 0.502 . . . . 0.0 109.988 -179.33 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 50' ' ' GLU . . . . . 0.507 ' CG ' ' N ' ' A' ' 51' ' ' TYR . 16.4 pt-20 -69.41 -42.36 75.15 Favored 'General case' 0 N--CA 1.489 1.514 0 CA-C-O 121.647 0.737 . . . . 0.0 109.281 -179.875 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 51' ' ' TYR . . . . . 0.507 ' N ' ' CG ' ' A' ' 50' ' ' GLU . 22.4 m-85 -60.91 -48.89 79.75 Favored 'General case' 0 N--CA 1.488 1.468 0 O-C-N 121.733 -0.605 . . . . 0.0 109.787 -178.638 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 52' ' ' ILE . . . . . . . . . . . . . 94.6 mt -66.5 -43.39 90.87 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.637 0 CA-C-O 121.201 0.525 . . . . 0.0 109.817 -179.479 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 68.3 m -59.78 -58.18 9.67 Favored 'General case' 0 N--CA 1.493 1.714 0 O-C-N 121.762 -0.587 . . . . 0.0 110.047 -178.567 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 54' ' ' LEU . . . . . 0.427 ' N ' HD22 ' A' ' 54' ' ' LEU . 4.1 mm? -64.03 -40.84 97.21 Favored 'General case' 0 C--N 1.301 -1.512 0 O-C-N 121.717 -0.614 . . . . 0.0 109.943 -179.724 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -60.05 -43.07 95.62 Favored 'General case' 0 N--CA 1.489 1.523 0 N-CA-C 109.508 -0.553 . . . . 0.0 109.508 -179.126 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 56' ' ' LYS . . . . . . . . . . . . . 65.8 tttm -65.36 -43.4 90.93 Favored 'General case' 0 C--N 1.307 -1.276 0 O-C-N 121.713 -0.617 . . . . 0.0 109.534 -179.981 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 87.7 mt-30 -65.21 -44.24 88.99 Favored 'General case' 0 N--CA 1.491 1.62 0 O-C-N 121.841 -0.537 . . . . 0.0 109.693 -179.393 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 58' ' ' VAL . . . . . . . . . . . . . 77.3 t -64.47 -44.8 97.0 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.536 0 N-CA-C 109.143 -0.688 . . . . 0.0 109.143 -179.667 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 59' ' ' TYR . . . . . 0.434 ' CE1' ' O ' ' A' ' 60' ' ' ALA . 54.5 t80 -130.58 120.25 23.74 Favored 'General case' 0 N--CA 1.495 1.806 0 CA-C-O 121.829 0.823 . . . . 0.0 109.727 -179.874 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 60' ' ' ALA . . . . . 0.434 ' O ' ' CE1' ' A' ' 59' ' ' TYR . . . -69.2 145.71 52.98 Favored 'General case' 0 N--CA 1.489 1.487 0 CA-C-O 121.623 0.725 . . . . 0.0 110.55 -179.771 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 61' ' ' ASN . . . . . . . . . . . . . 32.2 t-20 57.82 42.24 23.62 Favored 'General case' 0 N--CA 1.494 1.765 0 CA-C-O 121.325 0.583 . . . . 0.0 109.745 179.643 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 62' ' ' VAL . . . . . . . . . . . . . 12.6 p -68.87 137.85 23.52 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.628 0 CA-C-O 121.551 0.691 . . . . 0.0 110.179 179.959 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 63' ' ' GLU . . . . . 0.541 ' OE1' ' N ' ' A' ' 63' ' ' GLU . 57.1 mp0 -112.06 137.71 49.71 Favored 'General case' 0 N--CA 1.494 1.769 0 CA-C-O 121.81 0.814 . . . . 0.0 109.587 -179.752 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 64' ' ' TYR . . . . . . . . . . . . . 55.5 p90 -155.8 164.84 38.03 Favored 'General case' 0 N--CA 1.487 1.417 0 CA-C-O 121.931 0.872 . . . . 0.0 110.413 -179.693 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 83.0 tt0 -142.5 153.69 43.84 Favored 'General case' 0 N--CA 1.491 1.622 0 CA-C-O 121.56 0.695 . . . . 0.0 109.318 179.832 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 66' ' ' VAL . . . . . . . . . . . . . 2.9 p -123.53 132.32 71.58 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.794 0 CA-C-O 122.085 0.945 . . . . 0.0 109.887 -179.744 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 67' ' ' ALA . . . . . 0.481 ' HB1' ' HD2' ' A' ' 68' ' ' PRO . . . -85.89 160.23 53.05 Favored Pre-proline 0 N--CA 1.491 1.585 0 N-CA-C 109.221 -0.659 . . . . 0.0 109.221 179.945 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 68' ' ' PRO . . . . . 0.481 ' HD2' ' HB1' ' A' ' 67' ' ' ALA . 28.4 Cg_endo -59.83 134.67 58.56 Favored 'Trans proline' 0 C--N 1.307 -1.631 0 C-N-CA 122.728 2.286 . . . . 0.0 112.593 179.666 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 69' ' ' VAL . . . . . . . . . . . . . 99.5 t -138.63 139.15 41.67 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.8 0 CA-C-O 121.766 0.793 . . . . 0.0 110.442 179.82 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -67.08 154.64 40.7 Favored 'General case' 0 N--CA 1.488 1.47 0 CA-C-O 121.794 0.807 . . . . 0.0 110.018 179.787 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 71' ' ' ASP . . . . . 0.545 ' OD1' ' N ' ' A' ' 72' ' ' ASN . 42.3 p-10 -63.92 -34.44 77.96 Favored 'General case' 0 C--N 1.302 -1.465 0 CA-C-O 121.424 0.631 . . . . 0.0 109.45 -179.597 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 72' ' ' ASN . . . . . 0.545 ' N ' ' OD1' ' A' ' 71' ' ' ASP . 8.1 m120 -104.28 28.32 6.97 Favored 'General case' 0 N--CA 1.494 1.773 0 N-CA-C 109.114 -0.699 . . . . 0.0 109.114 -179.474 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 73' ' ' ALA . . . . . 0.445 ' C ' ' H ' ' A' ' 75' ' ' GLU . . . -70.43 -11.54 60.99 Favored 'General case' 0 N--CA 1.493 1.695 0 N-CA-C 109.135 -0.691 . . . . 0.0 109.135 -179.88 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 74' ' ' THR . . . . . . . . . . . . . 47.5 p 52.4 10.31 0.13 Allowed 'General case' 0 N--CA 1.493 1.697 0 CA-C-O 121.27 0.557 . . . . 0.0 109.513 179.854 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 75' ' ' GLU . . . . . 0.445 ' H ' ' C ' ' A' ' 73' ' ' ALA . 15.3 pt-20 -153.01 179.91 8.26 Favored 'General case' 0 N--CA 1.49 1.571 0 CA-C-O 121.806 0.812 . . . . 0.0 110.095 179.834 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 7.3 tp -146.06 133.48 20.75 Favored 'General case' 0 C--N 1.303 -1.422 0 CA-C-O 121.708 0.766 . . . . 0.0 109.988 179.878 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 77' ' ' HIS . . . . . . . . . . . . . 97.8 m-70 -116.53 118.32 32.32 Favored 'General case' 0 N--CA 1.493 1.717 0 CA-C-O 121.854 0.835 . . . . 0.0 109.438 179.533 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -151.25 161.53 42.54 Favored 'General case' 0 N--CA 1.49 1.547 0 CA-C-O 121.657 0.742 . . . . 0.0 109.871 -179.885 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 81.0 mtp85 -130.31 150.61 51.47 Favored 'General case' 0 N--CA 1.495 1.789 0 CA-C-O 121.695 0.759 . . . . 0.0 109.803 -179.631 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 80' ' ' PHE . . . . . . . . . . . . . 28.9 m-85 -126.17 150.77 48.07 Favored 'General case' 0 N--CA 1.496 1.847 0 CA-C-O 121.574 0.702 . . . . 0.0 109.852 -179.711 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 88.4 tttt -113.66 126.8 55.66 Favored 'General case' 0 N--CA 1.494 1.755 0 CA-C-O 121.738 0.78 . . . . 0.0 109.593 -179.835 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 82' ' ' PHE . . . . . 0.524 ' CG ' ' OE2' ' A' ' 87' ' ' GLU . 73.0 m-85 -125.41 148.77 48.67 Favored 'General case' 0 N--CA 1.495 1.813 0 CA-C-O 121.796 0.808 . . . . 0.0 109.996 179.907 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 45.6 tp10 -70.51 -33.75 71.54 Favored 'General case' 0 N--CA 1.488 1.462 0 N-CA-C 109.346 -0.613 . . . . 0.0 109.346 -179.586 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 84' ' ' VAL . . . . . . . . . . . . . 33.1 m -131.68 162.52 39.33 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.936 0 CA-C-O 121.965 0.888 . . . . 0.0 110.411 -179.12 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 69.3 m -88.25 -15.65 35.29 Favored 'General case' 0 N--CA 1.492 1.672 0 N-CA-C 109.578 -0.527 . . . . 0.0 109.578 -179.643 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 86' ' ' ALA . . . . . . . . . . . . . . . -60.11 -46.23 90.3 Favored 'General case' 0 N--CA 1.492 1.642 0 O-C-N 121.444 -0.785 . . . . 0.0 109.475 -179.234 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 87' ' ' GLU . . . . . 0.524 ' OE2' ' CG ' ' A' ' 82' ' ' PHE . 2.9 pp20? -67.33 -30.68 70.58 Favored 'General case' 0 N--CA 1.488 1.45 0 O-C-N 121.738 -0.601 . . . . 0.0 109.411 -179.715 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 88' ' ' LYS . . . . . 0.703 ' HZ2' ' HB1' ' A' ' 32' ' ' ALA . 56.8 tttp -62.79 -45.54 92.17 Favored 'General case' 0 N--CA 1.491 1.582 0 O-C-N 121.73 -0.606 . . . . 0.0 109.379 -179.58 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 96.0 mt -62.89 -50.46 70.79 Favored 'General case' 0 N--CA 1.492 1.641 0 O-C-N 121.852 -0.53 . . . . 0.0 110.025 -179.036 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 90' ' ' ILE . . . . . . . . . . . . . 93.5 mt -69.77 -43.79 79.63 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.591 0 O-C-N 121.731 -0.605 . . . . 0.0 110.013 -179.971 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 91' ' ' PHE . . . . . 0.462 ' O ' HG23 ' A' ' 95' ' ' THR . 74.6 t80 -62.6 -45.81 91.15 Favored 'General case' 0 N--CA 1.491 1.614 0 O-C-N 121.57 -0.707 . . . . 0.0 109.799 -179.052 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 92' ' ' GLU . . . . . 0.54 ' CG ' ' NH1' ' A' ' 96' ' ' ARG . 82.1 tt0 -66.12 -40.65 90.83 Favored 'General case' 0 N--CA 1.491 1.599 0 O-C-N 121.662 -0.649 . . . . 0.0 109.332 -179.64 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 93' ' ' LEU . . . . . . . . . . . . . 4.7 tp -65.45 -43.35 90.63 Favored 'General case' 0 N--CA 1.489 1.495 0 O-C-N 121.584 -0.697 . . . . 0.0 109.749 -179.868 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 94' ' ' LYS . . . . . . . . . . . . . 6.9 ttpm? -68.58 -36.61 78.98 Favored 'General case' 0 N--CA 1.491 1.62 0 CA-C-O 121.24 0.543 . . . . 0.0 110.099 -179.073 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 95' ' ' THR . . . . . 0.462 HG23 ' O ' ' A' ' 91' ' ' PHE . 7.0 p -62.02 -50.5 71.8 Favored 'General case' 0 N--CA 1.491 1.606 0 O-C-N 121.64 -0.663 . . . . 0.0 109.824 -178.802 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 96' ' ' ARG . . . . . 0.54 ' NH1' ' CG ' ' A' ' 92' ' ' GLU . 72.5 mtt85 -64.62 -39.61 94.02 Favored 'General case' 0 N--CA 1.488 1.449 0 N-CA-C 108.864 -0.791 . . . . 0.0 108.864 179.39 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 97' ' ' ALA . . . . . . . . . . . . . . . -61.59 -39.35 90.87 Favored 'General case' 0 N--CA 1.488 1.444 0 N-CA-C 108.995 -0.743 . . . . 0.0 108.995 179.995 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 98' ' ' LEU . . . . . 0.657 ' O ' HD23 ' A' ' 98' ' ' LEU . 3.6 tt -63.66 -44.07 94.86 Favored 'General case' 0 N--CA 1.488 1.442 0 N-CA-C 108.934 -0.765 . . . . 0.0 108.934 -179.823 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 99' ' ' ALA . . . . . . . . . . . . . . . -64.42 -40.15 95.21 Favored 'General case' 0 N--CA 1.491 1.582 0 O-C-N 121.612 -0.68 . . . . 0.0 109.521 -179.393 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 100' ' ' ARG . . . . . . . . . . . . . 79.7 mtp85 -63.99 -41.9 97.37 Favored 'General case' 0 N--CA 1.491 1.6 0 O-C-N 121.769 -0.582 . . . . 0.0 109.453 -179.877 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 101' ' ' LEU . . . . . 0.493 HD12 ' N ' ' A' ' 101' ' ' LEU . 11.1 mp -92.72 120.33 33.0 Favored 'General case' 0 N--CA 1.494 1.753 0 CA-C-O 121.687 0.756 . . . . 0.0 109.23 -179.935 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 102' ' ' GLU . . . . . . . . . . . . . 79.5 mm-40 -141.64 106.02 4.83 Favored 'General case' 0 N--CA 1.495 1.814 0 CA-C-O 121.701 0.762 . . . . 0.0 109.744 -179.956 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 103' ' ' HIS . . . . . . . . . . . . . 98.6 m-70 -111.75 124.49 52.44 Favored 'General case' 0 N--CA 1.499 2.02 0 CA-C-O 121.858 0.837 . . . . 0.0 109.948 179.98 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 104' ' ' HIS . . . . . . . . . . . . . 79.0 m80 -82.32 125.49 31.06 Favored 'General case' 0 N--CA 1.492 1.638 0 CA-C-O 121.713 0.768 . . . . 0.0 109.817 -179.831 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 105' ' ' HIS . . . . . . . . . . . . . 78.3 m80 -67.11 -42.22 84.91 Favored 'General case' 0 N--CA 1.491 1.599 0 N-CA-C 109.477 -0.564 . . . . 0.0 109.477 -179.459 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 106' ' ' HIS . . . . . . . . . . . . . 25.6 p80 -107.44 124.98 50.65 Favored 'General case' 0 N--CA 1.497 1.914 0 CA-C-O 121.741 0.782 . . . . 0.0 110.167 -179.611 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 107' ' ' HIS . . . . . . . . . . . . . 94.7 m-70 -66.74 -40.15 88.23 Favored 'General case' 0 N--CA 1.49 1.549 0 N-CA-C 109.025 -0.731 . . . . 0.0 109.025 179.996 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 108' ' ' HIS . . . . . . . . . . . . . 86.4 t60 . . . . . 0 N--CA 1.491 1.583 0 CA-C-O 118.301 -0.857 . . . . 0.0 109.621 179.839 . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 95.4 mtp . . . . . 0 N--CA 1.489 1.525 0 CA-C-O 121.702 0.763 . . . . 0.0 109.003 . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 11.3 m -70.86 152.36 43.78 Favored 'General case' 0 N--CA 1.489 1.479 0 CA-C-O 121.985 0.898 . . . . 0.0 110.718 -179.57 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 3' ' ' ASN . . . . . . . . . . . . . 99.9 m-20 47.88 -169.74 0.02 OUTLIER 'General case' 0 N--CA 1.489 1.488 0 CA-C-O 121.811 0.815 . . . . 0.0 110.787 179.742 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 78.2 mt-30 -71.84 -166.95 0.24 Allowed 'General case' 0 C--N 1.304 -1.402 0 CA-C-O 121.908 0.861 . . . . 0.0 110.45 -179.415 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 97.3 m 50.1 93.03 0.02 OUTLIER 'General case' 0 N--CA 1.489 1.506 0 CA-C-O 121.858 0.837 . . . . 0.0 110.147 -179.835 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 6' ' ' CYS . . . . . 0.414 ' SG ' ' O ' ' A' ' 6' ' ' CYS . 28.1 p -171.17 67.12 0.04 OUTLIER 'General case' 0 N--CA 1.489 1.511 0 N-CA-C 108.693 -0.854 . . . . 0.0 108.693 179.574 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 7' ' ' VAL . . . . . 0.416 HG22 ' H ' ' A' ' 7' ' ' VAL . 2.6 m -90.92 122.76 42.64 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.692 0 CA-C-O 121.746 0.784 . . . . 0.0 109.98 -179.48 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 15.1 pt-20 -94.92 -7.6 39.54 Favored 'General case' 0 N--CA 1.492 1.632 0 N-CA-C 108.715 -0.846 . . . . 0.0 108.715 179.334 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 9.2 m120 -70.71 148.38 48.06 Favored 'General case' 0 N--CA 1.494 1.769 0 O-C-N 121.462 -0.774 . . . . 0.0 110.67 -178.969 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 51.0 tp10 -156.63 114.44 3.23 Favored 'General case' 0 N--CA 1.492 1.645 0 O-C-N 121.441 -0.787 . . . . 0.0 109.534 179.684 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 14.5 p -72.1 136.22 26.16 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.697 0 CA-C-O 121.603 0.716 . . . . 0.0 110.101 -179.856 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 12' ' ' CYS . . . . . 0.48 ' SG ' ' N ' ' A' ' 13' ' ' GLU . 48.2 t -149.9 166.87 28.27 Favored 'General case' 0 N--CA 1.49 1.529 0 O-C-N 121.371 -0.831 . . . . 0.0 109.421 179.945 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 13' ' ' GLU . . . . . 0.544 ' O ' ' N ' ' A' ' 15' ' ' CYS . 43.7 tp10 -151.04 66.79 0.91 Allowed 'General case' 0 N--CA 1.491 1.608 0 O-C-N 121.474 -0.766 . . . . 0.0 109.227 -179.851 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . 44.1 16.13 0.01 OUTLIER 'General case' 0 N--CA 1.494 1.768 0 CA-C-O 121.653 0.74 . . . . 0.0 110.045 -179.779 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 15' ' ' CYS . . . . . 0.544 ' N ' ' O ' ' A' ' 13' ' ' GLU . 7.7 t -144.92 137.13 25.99 Favored 'General case' 0 N--CA 1.49 1.551 0 O-C-N 121.237 -0.915 . . . . 0.0 110.066 -179.959 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 76.21 21.17 76.3 Favored Glycine 0 N--CA 1.492 2.389 0 N-CA-C 109.542 -1.423 . . . . 0.0 109.542 -179.992 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 97.4 m -64.28 -40.42 95.93 Favored 'General case' 0 N--CA 1.491 1.601 0 O-C-N 121.361 -1.082 . . . . 0.0 109.528 179.897 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -71.31 143.04 50.43 Favored 'General case' 0 N--CA 1.493 1.721 0 O-C-N 121.215 -0.928 . . . . 0.0 110.535 -179.781 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 170.88 42.96 0.03 OUTLIER Glycine 0 N--CA 1.491 2.304 0 N-CA-C 108.822 -1.711 . . . . 0.0 108.822 179.626 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 20' ' ' GLU . . . . . 0.668 ' CD ' ' H ' ' A' ' 20' ' ' GLU . 1.7 pm0 -61.1 147.46 43.81 Favored 'General case' 0 N--CA 1.494 1.765 0 O-C-N 121.439 -1.036 . . . . 0.0 110.009 -179.521 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 21' ' ' ILE . . . . . . . . . . . . . 5.1 mp -97.29 126.18 50.18 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.691 0 O-C-N 121.359 -0.838 . . . . 0.0 110.359 -179.366 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 169.25 -113.86 0.53 Allowed Glycine 0 N--CA 1.487 2.033 0 N-CA-C 109.656 -1.378 . . . . 0.0 109.656 179.918 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 23' ' ' PHE . . . . . . . . . . . . . 94.9 m-85 -101.58 148.86 24.73 Favored 'General case' 0 N--CA 1.498 1.943 0 O-C-N 121.401 -1.058 . . . . 0.0 110.417 -179.525 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 24' ' ' ILE . . . . . 0.519 ' O ' HG23 ' A' ' 24' ' ' ILE . 19.9 tt -162.19 121.22 0.22 Allowed 'Isoleucine or valine' 0 N--CA 1.489 1.493 0 O-C-N 121.44 -0.787 . . . . 0.0 109.678 -179.757 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 25' ' ' ILE . . . . . . . . . . . . . 95.3 mt -83.22 -75.41 0.22 Allowed 'Isoleucine or valine' 0 N--CA 1.491 1.612 0 O-C-N 121.583 -0.698 . . . . 0.0 109.726 -179.88 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 26' ' ' ARG . . . . . 0.434 ' O ' ' O ' ' A' ' 27' ' ' GLU . 78.6 ttt180 -156.02 -17.95 0.1 Allowed 'General case' 0 N--CA 1.491 1.621 0 O-C-N 121.201 -0.937 . . . . 0.0 109.212 -179.609 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 27' ' ' GLU . . . . . 0.434 ' O ' ' O ' ' A' ' 26' ' ' ARG . 97.7 mt-10 56.07 159.46 0.01 OUTLIER 'General case' 0 N--CA 1.496 1.868 0 CA-C-O 121.474 0.654 . . . . 0.0 110.42 179.605 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . 117.26 -169.67 13.22 Favored Glycine 0 N--CA 1.498 2.778 0 N-CA-C 110.826 -0.909 . . . . 0.0 110.826 179.284 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 99.3 m-20 -70.53 -16.91 62.93 Favored 'General case' 0 N--CA 1.493 1.677 0 O-C-N 121.821 -0.811 . . . . 0.0 108.926 179.67 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 90.1 m-20 -82.88 -0.1 46.68 Favored 'General case' 0 N--CA 1.489 1.481 0 N-CA-C 108.414 -0.958 . . . . 0.0 108.414 179.463 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 31' ' ' VAL . . . . . 0.611 HG11 HH21 ' A' ' 79' ' ' ARG . 52.2 t -126.64 135.38 63.9 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.9 0 N-CA-C 109.109 -0.7 . . . . 0.0 109.109 179.827 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -112.25 155.83 23.39 Favored 'General case' 0 N--CA 1.495 1.777 0 CA-C-O 121.629 0.728 . . . . 0.0 109.906 -179.378 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 83.6 tt0 -107.07 123.05 47.66 Favored 'General case' 0 N--CA 1.494 1.757 0 O-C-N 121.647 -0.658 . . . . 0.0 109.614 -179.578 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 34' ' ' VAL . . . . . . . . . . . . . 55.0 t -127.51 132.92 68.81 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.727 0 CA-C-O 121.681 0.753 . . . . 0.0 109.436 179.757 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 37.3 t -148.71 141.0 24.11 Favored 'General case' 0 N--CA 1.49 1.529 0 N-CA-C 109.143 -0.688 . . . . 0.0 109.143 179.61 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 4.9 mp -130.74 151.12 51.52 Favored 'General case' 0 N--CA 1.494 1.766 0 CA-C-O 121.76 0.79 . . . . 0.0 109.928 -179.683 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 37' ' ' PHE . . . . . . . . . . . . . 32.4 p90 -143.69 159.73 41.95 Favored 'General case' 0 C--N 1.301 -1.501 0 CA-C-O 121.551 0.691 . . . . 0.0 109.656 -179.733 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . 114.33 152.96 10.66 Favored Glycine 0 N--CA 1.493 2.475 0 N-CA-C 110.263 -1.135 . . . . 0.0 110.263 179.6 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 39' ' ' SER . . . . . 0.561 ' OG ' ' N ' ' A' ' 40' ' ' ASP . 16.8 t 52.59 -169.24 0.04 OUTLIER 'General case' 0 N--CA 1.491 1.598 0 CA-C-O 122.019 0.914 . . . . 0.0 110.883 179.622 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 40' ' ' ASP . . . . . 0.561 ' N ' ' OG ' ' A' ' 39' ' ' SER . 54.5 p-10 -85.42 178.48 7.43 Favored 'General case' 0 C--N 1.306 -1.318 0 CA-C-O 121.654 0.74 . . . . 0.0 110.178 -179.606 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 88.5 tttt -62.35 -39.0 91.69 Favored 'General case' 0 N--CA 1.49 1.559 0 CA-C-O 121.393 0.616 . . . . 0.0 110.32 -179.577 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -53.31 -41.91 66.13 Favored 'General case' 0 N--CA 1.493 1.714 0 O-C-N 121.286 -0.884 . . . . 0.0 109.825 -179.437 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 43' ' ' HIS . . . . . . . . . . . . . 86.5 t60 -66.76 -41.25 88.05 Favored 'General case' 0 N--CA 1.493 1.712 0 O-C-N 121.242 -0.911 . . . . 0.0 109.488 179.513 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 96.7 mt -63.18 -40.07 96.47 Favored 'General case' 0 N--CA 1.495 1.78 0 O-C-N 121.327 -0.858 . . . . 0.0 109.216 -180.0 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 97.1 mt-10 -61.23 -39.41 90.2 Favored 'General case' 0 N--CA 1.493 1.714 0 O-C-N 121.439 -0.788 . . . . 0.0 109.724 -179.921 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . -60.43 -49.12 82.06 Favored Glycine 0 N--CA 1.492 2.394 0 N-CA-C 109.814 -1.314 . . . . 0.0 109.814 179.96 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 52.1 mtpt -65.9 -37.91 87.35 Favored 'General case' 0 C--N 1.301 -1.526 0 O-C-N 121.429 -1.042 . . . . 0.0 109.565 179.62 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 48' ' ' LEU . . . . . 0.558 HD13 ' O ' ' A' ' 48' ' ' LEU . 0.2 OUTLIER -62.58 -44.39 96.44 Favored 'General case' 0 C--N 1.302 -1.486 0 O-C-N 121.324 -0.86 . . . . 0.0 109.596 -178.805 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 49' ' ' ALA . . . . . . . . . . . . . . . -62.23 -41.76 98.69 Favored 'General case' 0 C--N 1.299 -1.601 0 O-C-N 121.069 -1.019 . . . . 0.0 109.471 -179.617 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 77.1 tt0 -69.47 -36.83 76.93 Favored 'General case' 0 C--N 1.306 -1.316 0 O-C-N 121.419 -0.8 . . . . 0.0 109.199 179.718 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 3.1 m-85 -61.98 -43.49 98.73 Favored 'General case' 0 N--CA 1.496 1.828 0 O-C-N 121.579 -0.701 . . . . 0.0 109.361 -179.996 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 52' ' ' ILE . . . . . 0.407 HD13 ' CZ ' ' A' ' 64' ' ' TYR . 76.7 mt -63.66 -43.19 98.02 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.606 0 O-C-N 121.539 -0.726 . . . . 0.0 109.726 -179.883 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 78.1 p -61.13 -41.71 97.21 Favored 'General case' 0 N--CA 1.493 1.687 0 O-C-N 121.423 -0.798 . . . . 0.0 110.19 -179.253 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 54' ' ' LEU . . . . . . . . . . . . . 93.6 mt -64.98 -42.48 94.51 Favored 'General case' 0 N--CA 1.494 1.737 0 O-C-N 121.264 -0.897 . . . . 0.0 109.4 179.822 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 55' ' ' ALA . . . . . 0.408 ' HB2' ' CE1' ' A' ' 91' ' ' PHE . . . -67.07 -37.06 83.34 Favored 'General case' 0 N--CA 1.491 1.596 0 O-C-N 121.504 -0.748 . . . . 0.0 109.568 179.799 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 56' ' ' LYS . . . . . . . . . . . . . 56.4 tttp -63.27 -43.97 96.43 Favored 'General case' 0 N--CA 1.487 1.377 0 O-C-N 121.491 -0.756 . . . . 0.0 109.568 -179.718 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 77.5 mt-30 -66.13 -44.4 84.35 Favored 'General case' 0 N--CA 1.493 1.687 0 O-C-N 121.324 -0.86 . . . . 0.0 109.433 179.898 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 58' ' ' VAL . . . . . . . . . . . . . 72.3 t -65.18 -45.09 94.98 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.554 0 O-C-N 121.498 -0.751 . . . . 0.0 109.47 179.627 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 59' ' ' TYR . . . . . . . . . . . . . 87.1 t80 -125.05 127.45 46.96 Favored 'General case' 0 N--CA 1.497 1.901 0 CA-C-O 121.748 0.785 . . . . 0.0 109.666 -179.653 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -66.17 148.74 51.38 Favored 'General case' 0 N--CA 1.49 1.554 0 CA-C-O 121.829 0.824 . . . . 0.0 110.848 -179.182 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 61' ' ' ASN . . . . . . . . . . . . . 6.3 p-10 42.93 66.72 0.73 Allowed 'General case' 0 N--CA 1.493 1.71 0 CA-C-O 121.844 0.83 . . . . 0.0 109.966 179.904 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 62' ' ' VAL . . . . . . . . . . . . . 11.7 p -85.55 136.29 23.14 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.616 0 O-C-N 121.549 -0.719 . . . . 0.0 109.794 179.824 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 96.1 mt-10 -111.97 145.24 39.95 Favored 'General case' 0 N--CA 1.496 1.872 0 CA-C-O 121.734 0.778 . . . . 0.0 109.971 -179.517 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 64' ' ' TYR . . . . . 0.407 ' CZ ' HD13 ' A' ' 52' ' ' ILE . 46.9 p90 -149.52 161.54 41.93 Favored 'General case' 0 N--CA 1.49 1.552 0 CA-C-O 121.798 0.809 . . . . 0.0 110.212 -179.424 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 78.4 mm-40 -141.19 146.18 36.6 Favored 'General case' 0 N--CA 1.494 1.734 0 N-CA-C 109.034 -0.728 . . . . 0.0 109.034 179.851 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 66' ' ' VAL . . . . . . . . . . . . . 8.8 p -127.2 131.45 70.64 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.967 0 CA-C-O 121.608 0.718 . . . . 0.0 110.184 -179.744 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 67' ' ' ALA . . . . . 0.462 ' HB1' ' HD2' ' A' ' 68' ' ' PRO . . . -78.95 167.18 36.95 Favored Pre-proline 0 C--N 1.305 -1.356 0 N-CA-C 109.155 -0.683 . . . . 0.0 109.155 -179.95 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 68' ' ' PRO . . . . . 0.462 ' HD2' ' HB1' ' A' ' 67' ' ' ALA . 53.0 Cg_exo -52.27 127.49 23.96 Favored 'Trans proline' 0 N--CA 1.495 1.57 0 C-N-CA 122.383 2.055 . . . . 0.0 112.905 179.573 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 69' ' ' VAL . . . . . . . . . . . . . 70.9 t -132.5 133.27 59.9 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.845 0 O-C-N 121.541 -0.724 . . . . 0.0 109.621 179.482 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -82.04 157.86 24.0 Favored 'General case' 0 C--N 1.302 -1.495 0 O-C-N 121.607 -0.683 . . . . 0.0 109.951 179.637 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 43.4 t0 -64.01 -37.98 89.42 Favored 'General case' 0 N--CA 1.493 1.696 0 CA-C-O 121.606 0.717 . . . . 0.0 109.697 179.552 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 72' ' ' ASN . . . . . . . . . . . . . 11.4 m120 -92.45 12.9 21.24 Favored 'General case' 0 N--CA 1.494 1.743 0 O-C-N 121.422 -0.799 . . . . 0.0 109.467 -179.567 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -64.25 146.51 54.22 Favored 'General case' 0 N--CA 1.496 1.83 0 O-C-N 121.19 -0.944 . . . . 0.0 110.406 -179.551 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 74' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -101.08 -4.35 27.53 Favored 'General case' 0 N--CA 1.494 1.748 0 O-C-N 121.515 -0.741 . . . . 0.0 109.69 179.819 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 82.9 tt0 -144.13 148.02 34.5 Favored 'General case' 0 N--CA 1.497 1.91 0 O-C-N 120.901 -1.125 . . . . 0.0 109.748 179.898 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 3.5 tt -126.17 135.31 51.49 Favored 'General case' 0 N--CA 1.49 1.573 0 CA-C-O 121.502 0.668 . . . . 0.0 109.549 -179.925 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 77' ' ' HIS . . . . . . . . . . . . . 99.1 m-70 -107.78 129.63 55.04 Favored 'General case' 0 N--CA 1.494 1.727 0 CA-C-O 121.578 0.704 . . . . 0.0 109.705 -179.519 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -148.03 153.99 39.67 Favored 'General case' 0 N--CA 1.49 1.529 0 O-C-N 121.587 -0.696 . . . . 0.0 109.438 -179.866 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 79' ' ' ARG . . . . . 0.611 HH21 HG11 ' A' ' 31' ' ' VAL . 79.7 mtp85 -132.74 149.36 52.29 Favored 'General case' 0 N--CA 1.494 1.726 0 CA-C-O 121.393 0.616 . . . . 0.0 109.387 -179.817 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 80' ' ' PHE . . . . . . . . . . . . . 61.8 m-85 -127.53 150.63 49.6 Favored 'General case' 0 N--CA 1.495 1.802 0 CA-C-O 121.536 0.684 . . . . 0.0 109.455 -179.872 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 53.7 tttp -110.5 112.85 25.05 Favored 'General case' 0 N--CA 1.493 1.678 0 CA-C-O 121.569 0.7 . . . . 0.0 109.35 179.874 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 82' ' ' PHE . . . . . . . . . . . . . 59.1 m-85 -111.24 145.22 39.12 Favored 'General case' 0 N--CA 1.495 1.788 0 CA-C-O 121.598 0.713 . . . . 0.0 109.71 179.915 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 46.2 tp10 -66.46 -38.65 87.81 Favored 'General case' 0 C--N 1.301 -1.505 0 O-C-N 121.692 -0.63 . . . . 0.0 109.904 -179.818 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 84' ' ' VAL . . . . . 0.431 ' CG2' ' OE2' ' A' ' 87' ' ' GLU . 16.6 m -136.17 161.24 37.88 Favored 'Isoleucine or valine' 0 N--CA 1.499 1.994 0 O-C-N 121.322 -0.861 . . . . 0.0 110.52 -179.421 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 33.9 m -70.57 -16.54 62.87 Favored 'General case' 0 N--CA 1.49 1.556 0 CA-C-O 121.367 0.604 . . . . 0.0 109.883 -179.902 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 86' ' ' ALA . . . . . . . . . . . . . . . -60.78 -42.37 97.38 Favored 'General case' 0 N--CA 1.493 1.724 0 O-C-N 121.188 -0.945 . . . . 0.0 109.567 -179.876 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 87' ' ' GLU . . . . . 0.551 ' OE1' ' N ' ' A' ' 87' ' ' GLU . 0.4 OUTLIER -70.36 -34.06 72.16 Favored 'General case' 0 N--CA 1.491 1.605 0 O-C-N 121.33 -0.856 . . . . 0.0 109.224 179.858 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 88' ' ' LYS . . . . . . . . . . . . . 88.5 tttt -61.79 -47.07 86.79 Favored 'General case' 0 N--CA 1.49 1.53 0 O-C-N 121.293 -0.88 . . . . 0.0 109.77 -179.921 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 56.6 tp -63.38 -45.77 89.57 Favored 'General case' 0 N--CA 1.489 1.515 0 O-C-N 121.288 -0.883 . . . . 0.0 109.715 -179.489 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 90' ' ' ILE . . . . . . . . . . . . . 96.5 mt -66.04 -44.54 92.03 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.611 0 O-C-N 121.508 -0.745 . . . . 0.0 109.839 -179.832 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 91' ' ' PHE . . . . . 0.408 ' CE1' ' HB2' ' A' ' 55' ' ' ALA . 54.1 t80 -62.98 -43.95 97.38 Favored 'General case' 0 N--CA 1.492 1.629 0 CA-C-O 121.64 0.733 . . . . 0.0 109.799 -179.636 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 92' ' ' GLU . . . . . . . . . . . . . 40.6 tp10 -56.28 -58.98 5.66 Favored 'General case' 0 N--CA 1.493 1.682 0 O-C-N 121.461 -0.775 . . . . 0.0 110.444 -178.897 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 93' ' ' LEU . . . . . 0.476 HD12 ' N ' ' A' ' 93' ' ' LEU . 10.8 mp -64.53 -39.27 93.46 Favored 'General case' 0 N--CA 1.495 1.778 0 O-C-N 121.266 -0.896 . . . . 0.0 110.553 -179.444 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 94' ' ' LYS . . . . . . . . . . . . . 38.6 ttmt -61.73 -46.96 87.41 Favored 'General case' 0 N--CA 1.493 1.719 0 O-C-N 120.997 -1.064 . . . . 0.0 110.639 -178.764 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 21.0 p -69.0 -40.6 78.61 Favored 'General case' 0 N--CA 1.493 1.719 0 O-C-N 120.887 -1.133 . . . . 0.0 109.686 -179.667 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 96' ' ' ARG . . . . . . . . . . . . . 82.6 mtp180 -64.89 -40.61 95.37 Favored 'General case' 0 N--CA 1.491 1.603 0 O-C-N 121.395 -0.816 . . . . 0.0 109.337 179.52 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 97' ' ' ALA . . . . . . . . . . . . . . . -61.65 -36.83 81.94 Favored 'General case' 0 N--CA 1.49 1.559 0 O-C-N 121.448 -0.783 . . . . 0.0 109.518 179.907 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 98' ' ' LEU . . . . . 0.651 ' O ' HD23 ' A' ' 98' ' ' LEU . 5.3 tt -62.62 -45.06 94.61 Favored 'General case' 0 N--CA 1.491 1.587 0 CA-C-O 121.698 0.761 . . . . 0.0 109.442 -179.932 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 99' ' ' ALA . . . . . . . . . . . . . . . -67.13 -20.85 65.83 Favored 'General case' 0 N--CA 1.491 1.613 0 O-C-N 121.468 -0.77 . . . . 0.0 109.59 -179.895 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 100' ' ' ARG . . . . . . . . . . . . . 99.2 mtt180 -82.26 3.71 26.45 Favored 'General case' 0 N--CA 1.49 1.539 0 O-C-N 121.409 -0.807 . . . . 0.0 109.38 179.653 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 101' ' ' LEU . . . . . . . . . . . . . 91.6 mt -85.67 -4.52 59.19 Favored 'General case' 0 N--CA 1.493 1.685 0 O-C-N 121.339 -0.851 . . . . 0.0 108.865 179.583 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 102' ' ' GLU . . . . . . . . . . . . . 71.3 mm-40 -59.57 133.7 56.34 Favored 'General case' 0 N--CA 1.491 1.593 0 CA-C-O 121.818 0.818 . . . . 0.0 110.229 -179.628 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 103' ' ' HIS . . . . . . . . . . . . . 57.8 t-80 -101.97 60.26 0.86 Allowed 'General case' 0 N--CA 1.492 1.628 0 O-C-N 121.641 -0.662 . . . . 0.0 109.404 179.938 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 104' ' ' HIS . . . . . 0.464 ' C ' ' H ' ' A' ' 106' ' ' HIS . 74.6 m80 -125.91 6.48 7.32 Favored 'General case' 0 N--CA 1.498 1.953 0 N-CA-C 108.686 -0.857 . . . . 0.0 108.686 179.611 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 105' ' ' HIS . . . . . . . . . . . . . 78.8 m80 52.15 9.63 0.1 Allowed 'General case' 0 N--CA 1.496 1.831 0 O-C-N 121.499 -0.75 . . . . 0.0 109.64 -179.945 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 106' ' ' HIS . . . . . 0.464 ' H ' ' C ' ' A' ' 104' ' ' HIS . 95.6 m-70 -133.61 145.42 50.0 Favored 'General case' 0 N--CA 1.496 1.842 0 O-C-N 121.392 -0.818 . . . . 0.0 109.963 179.862 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 107' ' ' HIS . . . . . . . . . . . . . 94.1 m-70 -66.77 -38.84 87.37 Favored 'General case' 0 N--CA 1.49 1.564 0 CA-C-O 121.52 0.676 . . . . 0.0 109.675 179.718 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 108' ' ' HIS . . . . . . . . . . . . . 85.4 t60 . . . . . 0 N--CA 1.492 1.64 0 CA-C-O 118.019 -0.991 . . . . 0.0 109.691 -179.948 . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 38.2 ttm . . . . . 0 N--CA 1.489 1.493 0 N-CA-C 108.984 -0.747 . . . . 0.0 108.984 . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 12.4 p 52.49 51.02 16.98 Favored 'General case' 0 N--CA 1.493 1.686 0 CA-C-O 121.66 0.743 . . . . 0.0 109.774 179.913 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 3' ' ' ASN . . . . . . . . . . . . . 54.3 t-20 -64.02 -40.46 96.39 Favored 'General case' 0 N--CA 1.493 1.694 0 CA-C-O 121.575 0.702 . . . . 0.0 109.879 179.552 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 14.4 mm100 -70.41 127.79 33.94 Favored 'General case' 0 N--CA 1.494 1.732 0 O-C-N 121.469 -0.769 . . . . 0.0 109.872 -179.278 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 81.5 p -78.06 165.51 23.93 Favored 'General case' 0 N--CA 1.492 1.652 0 CA-C-O 121.566 0.698 . . . . 0.0 110.364 -179.529 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 28.0 p -129.72 128.03 41.66 Favored 'General case' 0 N--CA 1.498 1.933 0 CA-C-O 121.72 0.771 . . . . 0.0 109.799 -179.571 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 7' ' ' VAL . . . . . . . . . . . . . 71.6 t -92.22 131.08 40.28 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.684 0 CA-C-O 122.016 0.912 . . . . 0.0 110.443 -179.408 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 8' ' ' GLU . . . . . 0.423 ' O ' HG12 ' A' ' 11' ' ' VAL . 98.0 mt-10 46.53 85.31 0.02 OUTLIER 'General case' 0 N--CA 1.489 1.509 0 CA-C-O 121.734 0.778 . . . . 0.0 110.179 179.804 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 9' ' ' ASN . . . . . 0.505 ' N ' ' OE2' ' A' ' 10' ' ' GLU . 54.4 p30 -89.79 -6.44 55.95 Favored 'General case' 0 N--CA 1.493 1.686 0 CA-C-O 121.321 0.582 . . . . 0.0 109.478 179.744 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 10' ' ' GLU . . . . . 0.58 ' CD ' ' H ' ' A' ' 10' ' ' GLU . 2.3 pm0 -94.08 -5.6 47.0 Favored 'General case' 0 N--CA 1.497 1.88 0 O-C-N 121.397 -0.815 . . . . 0.0 109.362 -179.998 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 11' ' ' VAL . . . . . 0.436 ' O ' HG13 ' A' ' 11' ' ' VAL . 7.0 p -73.83 128.35 36.2 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.711 0 O-C-N 121.405 -0.809 . . . . 0.0 109.971 -179.497 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 38.1 m -98.14 81.6 2.83 Favored 'General case' 0 N--CA 1.495 1.785 0 CA-C-O 121.589 0.709 . . . . 0.0 109.7 -179.579 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 48.3 tp10 -82.44 135.99 35.02 Favored 'General case' 0 N--CA 1.494 1.729 0 CA-C-O 121.733 0.778 . . . . 0.0 110.081 -179.727 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -82.3 112.81 19.62 Favored 'General case' 0 N--CA 1.494 1.747 0 CA-C-O 121.669 0.747 . . . . 0.0 110.396 -179.565 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 66.5 m -142.09 155.57 45.37 Favored 'General case' 0 N--CA 1.496 1.855 0 CA-C-O 121.645 0.735 . . . . 0.0 109.902 -179.948 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 16' ' ' GLY . . . . . 0.453 ' O ' ' O ' ' A' ' 17' ' ' CYS . . . 89.36 -6.74 83.13 Favored Glycine 0 N--CA 1.493 2.455 0 N-CA-C 109.901 -1.279 . . . . 0.0 109.901 179.903 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 17' ' ' CYS . . . . . 0.453 ' O ' ' O ' ' A' ' 16' ' ' GLY . 62.1 m 37.51 97.0 0.0 OUTLIER 'General case' 0 N--CA 1.5 2.058 0 CA-C-O 121.731 0.776 . . . . 0.0 110.724 179.892 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -56.23 139.77 46.78 Favored 'General case' 0 N--CA 1.492 1.654 0 CA-C-O 121.708 0.766 . . . . 0.0 110.462 -179.481 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -166.35 69.93 0.18 Allowed Glycine 0 N--CA 1.491 2.306 0 N-CA-C 109.31 -1.516 . . . . 0.0 109.31 179.959 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 74.7 mm-40 55.43 35.66 25.51 Favored 'General case' 0 N--CA 1.494 1.735 0 O-C-N 121.716 -0.873 . . . . 0.0 109.462 179.812 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 21' ' ' ILE . . . . . 0.543 HG22 ' O ' ' A' ' 21' ' ' ILE . 95.9 mt -67.82 0.05 1.02 Allowed 'Isoleucine or valine' 0 N--CA 1.49 1.531 0 CA-C-O 121.756 0.789 . . . . 0.0 109.333 179.522 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 89.57 70.67 1.24 Allowed Glycine 0 N--CA 1.493 2.437 0 N-CA-C 109.888 -1.285 . . . . 0.0 109.888 179.765 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 23' ' ' PHE . . . . . . . . . . . . . 55.6 p90 -82.45 15.84 2.34 Favored 'General case' 0 N--CA 1.492 1.645 0 O-C-N 121.673 -0.898 . . . . 0.0 109.243 179.681 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 16.3 pt -76.9 139.66 18.42 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.775 0 CA-C-O 121.65 0.738 . . . . 0.0 110.472 -179.717 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 25' ' ' ILE . . . . . . . . . . . . . 92.0 mt -99.0 131.74 45.67 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.623 0 CA-C-O 121.73 0.776 . . . . 0.0 110.443 -179.622 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 25.6 mmt85 -63.35 142.42 58.4 Favored 'General case' 0 C--N 1.302 -1.458 0 CA-C-O 122.11 0.957 . . . . 0.0 110.362 -179.514 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 27' ' ' GLU . . . . . 0.653 ' CD ' ' H ' ' A' ' 27' ' ' GLU . 2.1 pm0 -73.73 164.84 26.12 Favored 'General case' 0 C--N 1.3 -1.585 0 CA-C-O 121.835 0.826 . . . . 0.0 110.664 -179.253 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 28' ' ' GLY . . . . . 0.446 ' O ' ' OD1' ' A' ' 29' ' ' ASP . . . 91.53 -157.87 24.94 Favored Glycine 0 N--CA 1.49 2.29 0 N-CA-C 110.486 -1.046 . . . . 0.0 110.486 179.528 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 29' ' ' ASP . . . . . 0.446 ' OD1' ' O ' ' A' ' 28' ' ' GLY . 7.1 p-10 40.32 -145.98 0.03 OUTLIER 'General case' 0 N--CA 1.49 1.55 0 CA-C-O 121.86 0.838 . . . . 0.0 111.126 179.969 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 30' ' ' ASP . . . . . 0.402 ' OD2' ' O ' ' A' ' 82' ' ' PHE . 9.0 p-10 -82.74 72.74 9.81 Favored 'General case' 0 C--N 1.303 -1.451 0 O-C-N 121.596 -0.69 . . . . 0.0 109.777 -179.302 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 31' ' ' VAL . . . . . 0.596 ' CG1' HH11 ' A' ' 79' ' ' ARG . 53.5 t -124.96 135.33 64.42 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.881 0 CA-C-O 121.426 0.632 . . . . 0.0 109.433 179.858 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -130.56 140.98 50.46 Favored 'General case' 0 N--CA 1.494 1.759 0 CA-C-O 121.585 0.707 . . . . 0.0 109.471 -179.915 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 22.2 pt-20 -96.01 140.36 30.86 Favored 'General case' 0 N--CA 1.493 1.686 0 CA-C-O 121.501 0.667 . . . . 0.0 110.055 -179.495 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 34' ' ' VAL . . . . . 0.4 HG21 ' CD1' ' A' ' 80' ' ' PHE . 55.4 t -127.0 132.8 69.58 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.763 0 CA-C-O 121.513 0.673 . . . . 0.0 109.304 179.885 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 35' ' ' SER . . . . . 0.506 ' C ' HD12 ' A' ' 36' ' ' LEU . 39.4 t -140.35 128.27 21.99 Favored 'General case' 0 N--CA 1.493 1.701 0 CA-C-O 121.506 0.669 . . . . 0.0 109.724 -179.968 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 36' ' ' LEU . . . . . 0.506 HD12 ' C ' ' A' ' 35' ' ' SER . 11.0 mp -111.25 154.06 24.99 Favored 'General case' 0 N--CA 1.499 2.0 0 CA-C-O 121.509 0.671 . . . . 0.0 109.434 179.977 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 37' ' ' PHE . . . . . . . . . . . . . 92.3 t80 -124.58 130.24 52.07 Favored 'General case' 0 N--CA 1.493 1.679 0 CA-C-O 121.644 0.735 . . . . 0.0 109.508 -179.794 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . -164.95 -171.34 31.07 Favored Glycine 0 N--CA 1.491 2.314 0 N-CA-C 110.182 -1.167 . . . . 0.0 110.182 -179.697 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 14.0 p -85.99 -90.06 0.11 Allowed 'General case' 0 N--CA 1.497 1.903 0 O-C-N 121.909 -0.759 . . . . 0.0 110.738 -179.312 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 40' ' ' ASP . . . . . . . . . . . . . 52.6 p-10 -84.67 168.65 15.08 Favored 'General case' 0 N--CA 1.494 1.742 0 CA-C-O 121.777 0.799 . . . . 0.0 110.525 -178.944 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 88.9 tttt -65.2 -38.08 89.33 Favored 'General case' 0 N--CA 1.496 1.874 0 CA-C-O 121.311 0.577 . . . . 0.0 110.584 -179.506 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -55.1 -41.7 71.97 Favored 'General case' 0 N--CA 1.498 1.933 0 O-C-N 121.358 -0.839 . . . . 0.0 110.413 -178.974 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 43' ' ' HIS . . . . . . . . . . . . . 54.8 t-80 -66.63 -42.09 87.31 Favored 'General case' 0 N--CA 1.496 1.854 0 O-C-N 121.473 -0.767 . . . . 0.0 110.258 -179.555 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 74.1 mt -63.94 -40.34 96.24 Favored 'General case' 0 N--CA 1.497 1.897 0 O-C-N 121.469 -0.769 . . . . 0.0 109.767 -179.412 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 71.7 mm-40 -61.44 -43.46 98.83 Favored 'General case' 0 N--CA 1.492 1.655 0 CA-C-O 121.54 0.686 . . . . 0.0 109.794 -179.451 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . -62.2 -48.33 83.59 Favored Glycine 0 N--CA 1.494 2.534 0 N-CA-C 110.226 -1.15 . . . . 0.0 110.226 -179.648 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 61.5 tttp -66.82 -30.2 70.33 Favored 'General case' 0 N--CA 1.495 1.786 0 O-C-N 121.527 -0.984 . . . . 0.0 109.536 179.936 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 45.3 tp -62.23 -38.24 88.45 Favored 'General case' 0 N--CA 1.491 1.624 0 CA-C-O 121.492 0.663 . . . . 0.0 109.574 -179.509 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 49' ' ' ALA . . . . . . . . . . . . . . . -51.53 -33.47 32.16 Favored 'General case' 0 N--CA 1.493 1.687 0 O-C-N 121.565 -0.71 . . . . 0.0 109.559 -179.588 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 97.8 mt-10 -63.65 -43.2 97.44 Favored 'General case' 0 N--CA 1.493 1.695 0 O-C-N 121.585 -0.697 . . . . 0.0 109.622 -179.906 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 51' ' ' TYR . . . . . 0.468 ' CE1' HD21 ' A' ' 36' ' ' LEU . 32.8 m-85 -62.13 -46.39 89.23 Favored 'General case' 0 N--CA 1.494 1.764 0 O-C-N 121.466 -0.771 . . . . 0.0 109.706 -179.975 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 52' ' ' ILE . . . . . . . . . . . . . 96.5 mt -65.08 -43.99 95.79 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.652 0 O-C-N 121.649 -0.657 . . . . 0.0 109.871 -179.444 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 9.7 t -63.01 -46.63 86.72 Favored 'General case' 0 N--CA 1.495 1.807 0 O-C-N 121.48 -0.762 . . . . 0.0 109.656 -179.701 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 54' ' ' LEU . . . . . . . . . . . . . 91.0 mt -67.32 -40.0 85.92 Favored 'General case' 0 N--CA 1.494 1.732 0 CA-C-O 121.743 0.782 . . . . 0.0 109.181 179.54 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -58.83 -46.33 87.91 Favored 'General case' 0 N--CA 1.494 1.735 0 CA-C-O 121.46 0.648 . . . . 0.0 109.858 -179.447 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 56' ' ' LYS . . . . . . . . . . . . . 68.0 mttm -64.2 -41.21 97.16 Favored 'General case' 0 N--CA 1.492 1.668 0 O-C-N 121.537 -0.727 . . . . 0.0 109.647 179.834 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 67.2 tp60 -65.41 -46.1 81.32 Favored 'General case' 0 N--CA 1.491 1.608 0 O-C-N 121.591 -0.693 . . . . 0.0 109.506 -179.739 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 58' ' ' VAL . . . . . . . . . . . . . 71.5 t -65.89 -44.08 92.78 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.568 0 O-C-N 121.622 -0.673 . . . . 0.0 109.441 -179.98 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 59' ' ' TYR . . . . . 0.412 ' O ' ' O ' ' A' ' 60' ' ' ALA . 52.8 t80 -125.37 133.1 52.66 Favored 'General case' 0 N--CA 1.498 1.964 0 CA-C-O 121.799 0.809 . . . . 0.0 109.758 -179.874 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 60' ' ' ALA . . . . . 0.412 ' O ' ' O ' ' A' ' 59' ' ' TYR . . . -46.45 -100.04 0.0 OUTLIER 'General case' 0 N--CA 1.494 1.733 0 CA-C-O 121.562 0.696 . . . . 0.0 111.042 -179.471 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 61' ' ' ASN . . . . . . . . . . . . . 10.7 m120 -86.01 90.09 8.0 Favored 'General case' 0 N--CA 1.491 1.612 0 CA-C-O 121.805 0.812 . . . . 0.0 109.79 -178.676 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 62' ' ' VAL . . . . . . . . . . . . . 9.6 p -90.89 140.45 15.96 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.587 0 CA-C-O 121.488 0.661 . . . . 0.0 109.952 179.947 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 76.1 mm-40 -112.67 134.44 54.19 Favored 'General case' 0 N--CA 1.494 1.741 0 CA-C-O 121.589 0.709 . . . . 0.0 109.445 -179.809 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 64' ' ' TYR . . . . . . . . . . . . . 47.0 p90 -148.9 162.5 39.73 Favored 'General case' 0 N--CA 1.492 1.661 0 CA-C-O 121.718 0.771 . . . . 0.0 110.078 -179.333 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 15.7 pt-20 -143.18 154.37 43.8 Favored 'General case' 0 N--CA 1.494 1.732 0 N-CA-C 109.2 -0.667 . . . . 0.0 109.2 179.905 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 66' ' ' VAL . . . . . . . . . . . . . 77.3 t -119.83 130.42 74.2 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.878 0 CA-C-O 121.686 0.755 . . . . 0.0 109.856 -179.569 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 67' ' ' ALA . . . . . 0.601 ' HB1' ' HD2' ' A' ' 68' ' ' PRO . . . -84.36 170.99 12.12 Favored Pre-proline 0 N--CA 1.49 1.559 0 N-CA-C 109.423 -0.584 . . . . 0.0 109.423 -179.932 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 68' ' ' PRO . . . . . 0.601 ' HD2' ' HB1' ' A' ' 67' ' ' ALA . 62.9 Cg_exo -52.01 131.47 38.97 Favored 'Trans proline' 0 N--CA 1.496 1.659 0 C-N-CA 122.699 2.266 . . . . 0.0 112.971 -179.806 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 69' ' ' VAL . . . . . . . . . . . . . 53.3 t -132.33 131.99 60.6 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.897 0 CA-C-O 121.651 0.738 . . . . 0.0 109.896 179.838 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -74.9 152.72 38.84 Favored 'General case' 0 N--CA 1.491 1.59 0 CA-C-O 121.731 0.776 . . . . 0.0 110.021 179.625 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 53.3 m-20 -64.11 -36.0 82.6 Favored 'General case' 0 N--CA 1.493 1.677 0 CA-C-O 121.541 0.686 . . . . 0.0 109.267 179.969 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 72' ' ' ASN . . . . . . . . . . . . . 63.2 t30 -94.58 13.37 24.35 Favored 'General case' 0 N--CA 1.494 1.745 0 O-C-N 121.279 -0.888 . . . . 0.0 109.279 179.977 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -58.05 145.38 36.58 Favored 'General case' 0 N--CA 1.497 1.889 0 CA-C-O 121.74 0.781 . . . . 0.0 110.806 -179.273 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 74' ' ' THR . . . . . . . . . . . . . 41.0 p -98.45 -1.03 42.34 Favored 'General case' 0 N--CA 1.493 1.717 0 N-CA-C 109.309 -0.626 . . . . 0.0 109.309 179.6 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 18.9 pt-20 -154.3 163.04 40.76 Favored 'General case' 0 N--CA 1.494 1.747 0 O-C-N 121.259 -0.9 . . . . 0.0 109.912 179.887 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 5.3 tt -126.41 127.81 46.02 Favored 'General case' 0 N--CA 1.494 1.738 0 CA-C-O 121.574 0.702 . . . . 0.0 109.728 -179.855 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 77' ' ' HIS . . . . . . . . . . . . . 60.6 t-80 -97.83 124.01 42.04 Favored 'General case' 0 N--CA 1.491 1.606 0 CA-C-O 121.775 0.798 . . . . 0.0 109.88 -179.765 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -142.75 158.03 44.05 Favored 'General case' 0 N--CA 1.491 1.618 0 N-CA-C 108.881 -0.785 . . . . 0.0 108.881 179.693 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 79' ' ' ARG . . . . . 0.596 HH11 ' CG1' ' A' ' 31' ' ' VAL . 63.2 ttm-85 -128.83 137.67 51.62 Favored 'General case' 0 N--CA 1.493 1.693 0 CA-C-O 121.536 0.684 . . . . 0.0 109.551 -179.685 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 80' ' ' PHE . . . . . 0.4 ' CD1' HG21 ' A' ' 34' ' ' VAL . 59.3 m-85 -123.78 146.67 48.16 Favored 'General case' 0 N--CA 1.496 1.844 0 CA-C-O 121.521 0.677 . . . . 0.0 109.524 -179.803 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 63.6 tttp -115.76 128.91 56.21 Favored 'General case' 0 N--CA 1.496 1.845 0 N-CA-C 109.115 -0.698 . . . . 0.0 109.115 -179.859 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 82' ' ' PHE . . . . . 0.402 ' O ' ' OD2' ' A' ' 30' ' ' ASP . 94.4 m-85 -122.55 -122.01 0.28 Allowed 'General case' 0 N--CA 1.499 1.979 0 CA-C-O 121.346 0.593 . . . . 0.0 109.902 -179.413 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 52.8 tp10 -150.71 -39.84 0.13 Allowed 'General case' 0 N--CA 1.489 1.521 0 N-CA-C 108.747 -0.834 . . . . 0.0 108.747 -179.544 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 84' ' ' VAL . . . . . . . . . . . . . 25.6 m -137.12 157.7 35.48 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.888 0 O-C-N 121.469 -0.77 . . . . 0.0 109.686 179.928 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 85' ' ' SER . . . . . 0.482 ' O ' ' N ' ' A' ' 88' ' ' LYS . 11.3 t -64.08 -42.03 97.11 Favored 'General case' 0 N--CA 1.494 1.726 0 CA-C-O 121.33 0.586 . . . . 0.0 110.329 -179.979 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 86' ' ' ALA . . . . . 0.42 ' C ' ' O ' ' A' ' 85' ' ' SER . . . -39.22 -46.06 1.45 Allowed 'General case' 0 N--CA 1.5 2.026 0 CA-C-O 121.45 0.643 . . . . 0.0 110.587 -179.01 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 96.1 mt-10 -62.73 -33.94 76.16 Favored 'General case' 0 N--CA 1.494 1.73 0 O-C-N 121.469 -0.769 . . . . 0.0 110.008 -179.779 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 88' ' ' LYS . . . . . 0.482 ' N ' ' O ' ' A' ' 85' ' ' SER . 88.2 tttt -63.02 -43.11 99.62 Favored 'General case' 0 N--CA 1.492 1.664 0 O-C-N 121.414 -0.804 . . . . 0.0 109.648 -179.802 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 89' ' ' LEU . . . . . 0.55 HD12 ' N ' ' A' ' 89' ' ' LEU . 10.6 mp -63.47 -48.47 77.53 Favored 'General case' 0 N--CA 1.495 1.788 0 O-C-N 121.604 -0.685 . . . . 0.0 110.371 -179.093 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 90' ' ' ILE . . . . . 0.52 ' N ' HD12 ' A' ' 90' ' ' ILE . 1.4 mp -69.67 -43.65 80.03 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.756 0 O-C-N 121.355 -0.84 . . . . 0.0 108.972 179.962 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 91' ' ' PHE . . . . . . . . . . . . . 88.3 t80 -59.2 -47.6 84.74 Favored 'General case' 0 C--N 1.302 -1.478 0 CA-C-O 121.725 0.774 . . . . 0.0 109.184 -179.585 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 92' ' ' GLU . . . . . . . . . . . . . 84.2 tt0 -69.97 -31.83 69.74 Favored 'General case' 0 N--CA 1.49 1.56 0 CA-C-O 121.533 0.682 . . . . 0.0 109.431 179.681 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 93' ' ' LEU . . . . . . . . . . . . . 61.6 tp -62.99 -45.46 92.3 Favored 'General case' 0 N--CA 1.492 1.651 0 O-C-N 121.328 -0.857 . . . . 0.0 109.754 -179.455 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 94' ' ' LYS . . . . . . . . . . . . . 52.4 mtmt -65.24 -42.38 93.43 Favored 'General case' 0 N--CA 1.491 1.6 0 CA-C-O 121.467 0.651 . . . . 0.0 110.088 -179.386 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 34.2 p -67.02 -38.35 85.79 Favored 'General case' 0 N--CA 1.492 1.669 0 O-C-N 121.514 -0.741 . . . . 0.0 110.193 -179.325 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 96' ' ' ARG . . . . . . . . . . . . . 77.8 mmt-85 -66.19 -39.02 89.38 Favored 'General case' 0 N--CA 1.493 1.686 0 O-C-N 121.302 -0.874 . . . . 0.0 109.563 -179.954 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 97' ' ' ALA . . . . . . . . . . . . . . . -64.83 -41.67 95.55 Favored 'General case' 0 C--N 1.301 -1.535 0 CA-C-O 121.635 0.731 . . . . 0.0 109.187 179.997 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 98' ' ' LEU . . . . . . . . . . . . . 81.6 mt -64.64 -42.79 95.21 Favored 'General case' 0 N--CA 1.492 1.661 0 CA-C-O 121.548 0.689 . . . . 0.0 109.665 179.865 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 99' ' ' ALA . . . . . . . . . . . . . . . -71.82 -47.41 53.42 Favored 'General case' 0 N--CA 1.493 1.689 0 CA-C-O 121.602 0.715 . . . . 0.0 109.909 -179.792 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 100' ' ' ARG . . . . . . . . . . . . . 94.9 mtt-85 -66.17 -43.09 87.88 Favored 'General case' 0 N--CA 1.492 1.671 0 O-C-N 121.561 -0.712 . . . . 0.0 110.018 -179.637 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 101' ' ' LEU . . . . . . . . . . . . . 69.2 mt -100.61 130.46 46.67 Favored 'General case' 0 N--CA 1.495 1.799 0 O-C-N 121.409 -0.807 . . . . 0.0 109.901 -179.448 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 102' ' ' GLU . . . . . . . . . . . . . 81.5 tt0 -90.01 -12.17 39.41 Favored 'General case' 0 N--CA 1.488 1.464 0 N-CA-C 109.153 -0.684 . . . . 0.0 109.153 179.814 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 103' ' ' HIS . . . . . . . . . . . . . 41.9 p-80 -150.9 162.46 40.75 Favored 'General case' 0 N--CA 1.498 1.932 0 O-C-N 121.212 -0.93 . . . . 0.0 110.191 179.949 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 104' ' ' HIS . . . . . . . . . . . . . 97.5 m-70 -88.85 118.63 28.69 Favored 'General case' 0 N--CA 1.493 1.724 0 CA-C-O 121.758 0.79 . . . . 0.0 110.011 -179.801 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 105' ' ' HIS . . . . . 0.419 ' ND1' ' C ' ' A' ' 105' ' ' HIS . 0.0 OUTLIER -97.31 10.09 40.51 Favored 'General case' 0 N--CA 1.493 1.7 0 CA-C-O 121.605 0.717 . . . . 0.0 109.103 179.707 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 106' ' ' HIS . . . . . . . . . . . . . 70.8 m80 -61.77 -39.08 90.39 Favored 'General case' 0 N--CA 1.492 1.663 0 CA-C-O 121.563 0.697 . . . . 0.0 109.26 179.435 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 107' ' ' HIS . . . . . . . . . . . . . 78.8 m80 -71.9 134.3 45.95 Favored 'General case' 0 N--CA 1.49 1.55 0 CA-C-O 121.74 0.781 . . . . 0.0 109.924 -179.442 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 108' ' ' HIS . . . . . . . . . . . . . 51.1 p-80 . . . . . 0 N--CA 1.494 1.752 0 CA-C-O 118.04 -0.981 . . . . 0.0 109.644 -179.815 . . . . . . . . 0 0 . 1 . 011 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 65.3 ttp . . . . . 0 N--CA 1.49 1.57 0 CA-C-O 121.493 0.663 . . . . 0.0 109.455 . . . . . . . . . 0 0 . 1 . 011 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 97.3 p -157.98 163.51 37.72 Favored 'General case' 0 N--CA 1.494 1.744 0 CA-C-O 121.703 0.763 . . . . 0.0 110.233 -179.954 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 3' ' ' ASN . . . . . . . . . . . . . 11.1 p30 -87.32 117.15 25.89 Favored 'General case' 0 N--CA 1.495 1.775 0 CA-C-O 121.51 0.672 . . . . 0.0 109.604 -179.815 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 7.2 pt20 -87.02 -2.25 58.49 Favored 'General case' 0 N--CA 1.495 1.788 0 N-CA-C 108.996 -0.742 . . . . 0.0 108.996 -179.68 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 70.7 p 46.53 -141.99 0.38 Allowed 'General case' 0 N--CA 1.494 1.744 0 CA-C-O 121.537 0.684 . . . . 0.0 110.582 179.656 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 21.1 p -158.67 177.35 11.29 Favored 'General case' 0 C--N 1.303 -1.434 0 CA-C-O 121.558 0.694 . . . . 0.0 110.03 -179.482 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 7' ' ' VAL . . . . . . . . . . . . . 78.0 t -71.22 -21.96 22.21 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.593 0 N-CA-C 109.29 -0.633 . . . . 0.0 109.29 -179.278 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 97.9 mt-10 -83.97 120.24 25.87 Favored 'General case' 0 N--CA 1.492 1.665 0 CA-C-O 121.585 0.707 . . . . 0.0 109.753 -179.929 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 66.1 t30 -151.91 -49.18 0.11 Allowed 'General case' 0 N--CA 1.492 1.639 0 O-C-N 121.556 -0.715 . . . . 0.0 109.074 179.522 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 98.1 mt-10 -72.87 150.17 42.87 Favored 'General case' 0 N--CA 1.496 1.868 0 CA-C-O 121.68 0.753 . . . . 0.0 110.812 -179.219 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 78.1 t -73.41 132.92 32.69 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.71 0 CA-C-O 121.728 0.775 . . . . 0.0 110.416 -179.308 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 47.6 m -94.63 143.02 26.78 Favored 'General case' 0 N--CA 1.493 1.685 0 CA-C-O 121.805 0.812 . . . . 0.0 110.428 -179.349 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 83.2 tt0 -161.61 83.79 0.61 Allowed 'General case' 0 N--CA 1.49 1.549 0 CA-C-O 121.513 0.673 . . . . 0.0 109.478 179.682 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -83.89 106.47 15.59 Favored 'General case' 0 N--CA 1.494 1.73 0 CA-C-O 121.629 0.728 . . . . 0.0 109.811 179.68 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 58.5 m 41.11 57.0 2.93 Favored 'General case' 0 N--CA 1.492 1.673 0 CA-C-O 121.496 0.665 . . . . 0.0 109.795 179.928 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . -66.98 141.22 39.37 Favored Glycine 0 N--CA 1.492 2.419 0 N-CA-C 110.577 -1.009 . . . . 0.0 110.577 -179.449 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 14.9 p -90.15 142.12 28.03 Favored 'General case' 0 N--CA 1.489 1.515 0 CA-C-O 121.615 0.721 . . . . 0.0 109.881 179.892 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -77.84 -78.11 0.14 Allowed 'General case' 0 C--N 1.3 -1.567 0 N-CA-C 109.4 -0.593 . . . . 0.0 109.4 179.859 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -84.84 135.23 13.33 Favored Glycine 0 N--CA 1.494 2.562 0 N-CA-C 111.146 -0.782 . . . . 0.0 111.146 -178.924 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 20' ' ' GLU . . . . . 0.485 ' HG3' ' H ' ' A' ' 22' ' ' GLY . 27.9 tp10 -71.51 153.03 42.5 Favored 'General case' 0 N--CA 1.488 1.437 0 CA-C-O 121.669 0.747 . . . . 0.0 109.998 179.835 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 21' ' ' ILE . . . . . . . . . . . . . 37.1 pt -91.36 -4.25 10.72 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.747 0 N-CA-C 109.087 -0.708 . . . . 0.0 109.087 -179.791 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 22' ' ' GLY . . . . . 0.485 ' H ' ' HG3' ' A' ' 20' ' ' GLU . . . 63.71 107.26 0.01 OUTLIER Glycine 0 N--CA 1.494 2.516 0 N-CA-C 110.846 -0.901 . . . . 0.0 110.846 179.113 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 23' ' ' PHE . . . . . . . . . . . . . 86.0 m-85 -76.95 -178.18 4.8 Favored 'General case' 0 N--CA 1.493 1.696 0 CA-C-O 121.611 0.719 . . . . 0.0 110.366 179.732 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 38.3 mm -65.12 -43.68 95.7 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.61 0 O-C-N 121.72 -0.613 . . . . 0.0 109.655 -179.233 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 25' ' ' ILE . . . . . . . . . . . . . 96.6 mt -79.91 125.38 38.86 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.688 0 CA-C-O 121.928 0.87 . . . . 0.0 109.687 -179.573 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 73.9 ttp85 -77.53 132.72 38.5 Favored 'General case' 0 N--CA 1.493 1.694 0 CA-C-O 121.809 0.814 . . . . 0.0 110.68 -178.81 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 15.1 pt-20 -77.87 147.21 35.22 Favored 'General case' 0 N--CA 1.49 1.537 0 CA-C-O 121.813 0.816 . . . . 0.0 110.496 179.987 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . -175.91 -172.58 40.83 Favored Glycine 0 N--CA 1.487 2.1 0 N-CA-C 110.25 -1.14 . . . . 0.0 110.25 179.702 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 98.8 m-20 -68.15 -16.05 63.84 Favored 'General case' 0 N--CA 1.489 1.504 0 O-C-N 121.95 -0.735 . . . . 0.0 109.114 -179.575 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 39.1 p-10 -88.5 2.16 53.42 Favored 'General case' 0 N--CA 1.494 1.743 0 O-C-N 121.729 -0.607 . . . . 0.0 109.366 -179.776 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 50.3 t -123.64 133.6 68.76 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.955 0 CA-C-O 121.602 0.715 . . . . 0.0 109.985 179.519 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 32' ' ' ALA . . . . . 0.626 ' HB1' ' NZ ' ' A' ' 88' ' ' LYS . . . -116.96 150.6 38.28 Favored 'General case' 0 N--CA 1.497 1.919 0 CA-C-O 121.977 0.894 . . . . 0.0 110.113 179.825 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 16.4 pt-20 -98.34 142.23 30.24 Favored 'General case' 0 N--CA 1.494 1.727 0 CA-C-O 121.615 0.722 . . . . 0.0 110.118 -179.821 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 34' ' ' VAL . . . . . . . . . . . . . 53.0 t -125.96 134.5 66.4 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.833 0 CA-C-O 121.789 0.804 . . . . 0.0 109.459 179.881 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 34.7 p -137.87 129.51 28.22 Favored 'General case' 0 N--CA 1.494 1.742 0 CA-C-O 121.726 0.774 . . . . 0.0 110.15 179.825 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 25.6 tp -127.99 139.83 52.34 Favored 'General case' 0 N--CA 1.492 1.64 0 CA-C-O 121.725 0.774 . . . . 0.0 109.574 179.656 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 37' ' ' PHE . . . . . . . . . . . . . 46.8 p90 -139.7 148.23 42.05 Favored 'General case' 0 N--CA 1.492 1.663 0 CA-C-O 121.902 0.858 . . . . 0.0 110.109 179.934 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . 155.31 128.52 1.15 Allowed Glycine 0 N--CA 1.49 2.234 0 N-CA-C 109.831 -1.308 . . . . 0.0 109.831 179.796 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 14.7 m 47.84 -146.6 0.25 Allowed 'General case' 0 N--CA 1.488 1.45 0 O-C-N 121.75 -0.853 . . . . 0.0 110.205 179.625 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 40' ' ' ASP . . . . . . . . . . . . . 56.1 p30 -86.94 -177.74 6.13 Favored 'General case' 0 N--CA 1.492 1.666 0 CA-C-O 121.606 0.717 . . . . 0.0 110.451 -178.903 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 88.8 tttt -62.66 -42.03 99.39 Favored 'General case' 0 N--CA 1.494 1.733 0 O-C-N 121.93 -0.481 . . . . 0.0 110.085 -179.091 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -49.86 -41.76 46.07 Favored 'General case' 0 N--CA 1.495 1.825 0 O-C-N 121.662 -0.648 . . . . 0.0 109.738 -178.645 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 43' ' ' HIS . . . . . . . . . . . . . 50.4 t-80 -64.01 -41.55 97.42 Favored 'General case' 0 N--CA 1.491 1.614 0 CA-C-O 121.353 0.597 . . . . 0.0 109.619 -179.809 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 49.8 mt -64.11 -40.11 95.5 Favored 'General case' 0 N--CA 1.492 1.64 0 O-C-N 121.628 -0.67 . . . . 0.0 109.627 -179.467 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 79.6 mm-40 -62.93 -39.59 95.05 Favored 'General case' 0 N--CA 1.493 1.68 0 O-C-N 121.769 -0.582 . . . . 0.0 109.474 -179.263 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . -62.34 -42.4 99.71 Favored Glycine 0 N--CA 1.492 2.383 0 N-CA-C 109.604 -1.398 . . . . 0.0 109.604 -179.646 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 55.1 mtpt -83.19 -18.24 39.99 Favored 'General case' 0 N--CA 1.491 1.594 0 O-C-N 121.661 -0.905 . . . . 0.0 109.255 -179.634 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 58.2 tp -64.13 -39.83 94.88 Favored 'General case' 0 N--CA 1.488 1.45 0 N-CA-C 108.901 -0.777 . . . . 0.0 108.901 179.719 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 49' ' ' ALA . . . . . . . . . . . . . . . -58.02 -41.2 82.65 Favored 'General case' 0 N--CA 1.494 1.758 0 N-CA-C 109.588 -0.523 . . . . 0.0 109.588 -179.018 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 79.5 mm-40 -68.92 -37.16 78.76 Favored 'General case' 0 N--CA 1.494 1.753 0 O-C-N 121.648 -0.657 . . . . 0.0 109.244 179.966 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 3.6 m-85 -61.54 -43.88 98.06 Favored 'General case' 0 N--CA 1.496 1.836 0 O-C-N 121.615 -0.678 . . . . 0.0 109.505 -179.326 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 52' ' ' ILE . . . . . . . . . . . . . 90.8 mt -64.22 -42.38 95.3 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.653 0 N-CA-C 109.0 -0.741 . . . . 0.0 109.0 -179.973 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 11.5 t -59.01 -42.69 90.73 Favored 'General case' 0 N--CA 1.489 1.523 0 N-CA-C 109.092 -0.707 . . . . 0.0 109.092 -179.017 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 54' ' ' LEU . . . . . . . . . . . . . 88.8 mt -63.15 -40.95 99.05 Favored 'General case' 0 C--N 1.301 -1.541 0 N-CA-C 109.231 -0.655 . . . . 0.0 109.231 -179.962 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -65.93 -38.86 89.75 Favored 'General case' 0 N--CA 1.494 1.758 0 O-C-N 121.939 -0.476 . . . . 0.0 110.002 -179.253 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 56' ' ' LYS . . . . . . . . . . . . . 64.7 mttm -64.81 -41.46 95.76 Favored 'General case' 0 N--CA 1.493 1.717 0 O-C-N 121.528 -0.732 . . . . 0.0 109.79 -179.821 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 87.8 mt-30 -61.66 -46.23 90.64 Favored 'General case' 0 N--CA 1.488 1.474 0 N-CA-C 109.074 -0.713 . . . . 0.0 109.074 -179.502 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 58' ' ' VAL . . . . . . . . . . . . . 76.0 t -66.41 -44.27 90.75 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.591 0 N-CA-C 109.235 -0.654 . . . . 0.0 109.235 179.794 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 59' ' ' TYR . . . . . . . . . . . . . 87.7 t80 -140.42 118.53 11.95 Favored 'General case' 0 N--CA 1.498 1.929 0 CA-C-O 121.813 0.816 . . . . 0.0 110.046 -179.844 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -70.79 149.15 47.15 Favored 'General case' 0 N--CA 1.495 1.797 0 CA-C-O 121.572 0.701 . . . . 0.0 110.895 -179.854 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 61' ' ' ASN . . . . . . . . . . . . . 50.2 t-20 61.42 42.47 11.54 Favored 'General case' 0 N--CA 1.493 1.687 0 CA-C-O 121.602 0.715 . . . . 0.0 109.089 179.671 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 62' ' ' VAL . . . . . . . . . . . . . 9.4 p -80.37 137.27 21.78 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.531 0 CA-C-O 121.636 0.731 . . . . 0.0 110.383 -179.811 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 96.6 mt-10 -111.39 146.17 37.62 Favored 'General case' 0 N--CA 1.495 1.793 0 CA-C-O 121.967 0.889 . . . . 0.0 109.932 -179.844 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 64' ' ' TYR . . . . . . . . . . . . . 55.1 p90 -151.47 161.03 43.4 Favored 'General case' 0 N--CA 1.489 1.516 0 CA-C-O 121.503 0.668 . . . . 0.0 110.023 -179.667 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 74.6 mm-40 -138.13 151.02 47.37 Favored 'General case' 0 N--CA 1.5 2.049 0 CA-C-O 121.707 0.765 . . . . 0.0 110.406 -179.481 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 66' ' ' VAL . . . . . . . . . . . . . 53.4 t -122.62 130.84 74.21 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.969 0 CA-C-O 121.923 0.868 . . . . 0.0 110.163 -179.549 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 67' ' ' ALA . . . . . 0.591 ' HB1' ' HD2' ' A' ' 68' ' ' PRO . . . -81.41 170.28 15.88 Favored Pre-proline 0 N--CA 1.487 1.38 0 CA-C-O 121.167 0.508 . . . . 0.0 109.739 179.812 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 68' ' ' PRO . . . . . 0.591 ' HD2' ' HB1' ' A' ' 67' ' ' ALA . 31.5 Cg_exo -56.55 122.86 12.54 Favored 'Trans proline' 0 N--CA 1.494 1.557 0 C-N-CA 122.537 2.158 . . . . 0.0 112.601 179.922 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 69' ' ' VAL . . . . . . . . . . . . . 67.8 t -135.45 134.1 52.16 Favored 'Isoleucine or valine' 0 N--CA 1.499 1.975 0 CA-C-O 121.789 0.804 . . . . 0.0 110.379 179.903 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -71.55 151.64 43.67 Favored 'General case' 0 N--CA 1.497 1.877 0 CA-C-O 121.578 0.704 . . . . 0.0 110.583 179.934 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 98.4 m-20 -62.43 -35.93 80.81 Favored 'General case' 0 N--CA 1.493 1.722 0 N-CA-C 109.531 -0.544 . . . . 0.0 109.531 -179.537 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 72' ' ' ASN . . . . . . . . . . . . . 56.6 p30 -92.04 11.54 24.92 Favored 'General case' 0 N--CA 1.495 1.775 0 O-C-N 121.555 -0.716 . . . . 0.0 109.363 -179.288 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -66.14 144.03 56.92 Favored 'General case' 0 N--CA 1.493 1.723 0 O-C-N 121.496 -0.752 . . . . 0.0 109.736 179.833 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 74' ' ' THR . . . . . . . . . . . . . 3.8 m -99.18 -3.54 34.17 Favored 'General case' 0 N--CA 1.493 1.681 0 N-CA-C 108.697 -0.853 . . . . 0.0 108.697 -179.873 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 84.0 tt0 -135.88 150.49 49.38 Favored 'General case' 0 N--CA 1.492 1.656 0 CA-C-O 121.792 0.806 . . . . 0.0 109.522 179.977 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 4.7 tt -131.21 128.29 39.66 Favored 'General case' 0 N--CA 1.489 1.52 0 CA-C-O 121.806 0.812 . . . . 0.0 109.841 -179.725 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 77' ' ' HIS . . . . . . . . . . . . . 80.5 m80 -96.92 131.41 43.72 Favored 'General case' 0 N--CA 1.493 1.686 0 CA-C-O 121.857 0.836 . . . . 0.0 109.435 -179.805 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -147.64 155.78 42.12 Favored 'General case' 0 N--CA 1.49 1.551 0 CA-C-O 121.716 0.77 . . . . 0.0 109.995 -179.85 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 95.2 mtt180 -128.54 137.66 51.86 Favored 'General case' 0 N--CA 1.496 1.849 0 CA-C-O 121.794 0.807 . . . . 0.0 109.728 -179.881 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 80' ' ' PHE . . . . . . . . . . . . . 30.0 m-85 -129.44 147.78 51.29 Favored 'General case' 0 N--CA 1.495 1.809 0 CA-C-O 121.723 0.773 . . . . 0.0 109.629 179.885 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -124.96 146.24 49.48 Favored 'General case' 0 N--CA 1.495 1.813 0 CA-C-O 121.622 0.725 . . . . 0.0 109.774 179.902 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 82' ' ' PHE . . . . . . . . . . . . . 97.7 m-85 -132.67 -97.6 0.3 Allowed 'General case' 0 N--CA 1.496 1.873 0 CA-C-O 121.351 0.596 . . . . 0.0 109.701 -179.869 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 6.1 pt-20 -177.32 -28.87 0.01 OUTLIER 'General case' 0 N--CA 1.494 1.757 0 O-C-N 121.341 -0.85 . . . . 0.0 108.812 -179.82 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 84' ' ' VAL . . . . . . . . . . . . . 33.7 m -134.27 160.11 41.79 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.903 0 CA-C-O 121.814 0.816 . . . . 0.0 110.208 -179.918 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 35.6 m -79.61 -18.06 52.43 Favored 'General case' 0 N--CA 1.493 1.706 0 CA-C-O 121.348 0.595 . . . . 0.0 109.679 -179.711 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 86' ' ' ALA . . . . . . . . . . . . . . . -63.27 -42.93 99.19 Favored 'General case' 0 N--CA 1.493 1.712 0 O-C-N 121.519 -0.738 . . . . 0.0 109.515 -179.337 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 92.5 mt-10 -67.31 -29.64 69.27 Favored 'General case' 0 N--CA 1.493 1.708 0 O-C-N 121.523 -0.736 . . . . 0.0 109.471 -179.701 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 88' ' ' LYS . . . . . 0.626 ' NZ ' ' HB1' ' A' ' 32' ' ' ALA . 64.6 tttp -63.22 -46.06 88.74 Favored 'General case' 0 N--CA 1.489 1.498 0 O-C-N 121.681 -0.637 . . . . 0.0 109.531 -179.413 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 96.6 mt -64.14 -48.87 74.36 Favored 'General case' 0 N--CA 1.491 1.606 0 O-C-N 121.685 -0.634 . . . . 0.0 110.095 -178.965 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 90' ' ' ILE . . . . . 0.521 ' N ' HD12 ' A' ' 90' ' ' ILE . 1.3 mp -68.68 -44.21 82.6 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.612 0 O-C-N 121.766 -0.584 . . . . 0.0 109.735 179.904 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 91' ' ' PHE . . . . . . . . . . . . . 85.7 t80 -61.81 -44.73 96.28 Favored 'General case' 0 C--N 1.301 -1.542 0 N-CA-C 108.723 -0.843 . . . . 0.0 108.723 -178.972 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 92' ' ' GLU . . . . . . . . . . . . . 50.8 tp10 -63.16 -37.52 87.54 Favored 'General case' 0 C--N 1.302 -1.463 0 N-CA-C 109.28 -0.637 . . . . 0.0 109.28 -179.628 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 93' ' ' LEU . . . . . . . . . . . . . 6.3 tt -63.27 -46.6 86.06 Favored 'General case' 0 N--CA 1.489 1.511 0 CA-C-O 121.426 0.631 . . . . 0.0 109.677 -179.43 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 94' ' ' LYS . . . . . . . . . . . . . 67.8 mttm -66.5 -44.84 81.46 Favored 'General case' 0 N--CA 1.491 1.589 0 O-C-N 121.792 -0.568 . . . . 0.0 110.262 -179.408 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 22.3 p -69.13 -41.77 76.91 Favored 'General case' 0 N--CA 1.494 1.765 0 O-C-N 121.518 -0.738 . . . . 0.0 109.847 -179.188 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 96' ' ' ARG . . . . . . . . . . . . . 64.0 ttm-85 -68.23 -42.3 79.97 Favored 'General case' 0 N--CA 1.491 1.623 0 O-C-N 121.536 -0.727 . . . . 0.0 109.042 -179.818 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 97' ' ' ALA . . . . . . . . . . . . . . . -63.7 -41.42 98.13 Favored 'General case' 0 N--CA 1.49 1.526 0 N-CA-C 109.217 -0.661 . . . . 0.0 109.217 -179.499 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 98' ' ' LEU . . . . . 0.686 ' O ' HD23 ' A' ' 98' ' ' LEU . 3.1 tt -63.66 -40.66 97.39 Favored 'General case' 0 C--N 1.303 -1.452 0 CA-C-O 121.672 0.748 . . . . 0.0 109.026 -179.568 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 99' ' ' ALA . . . . . . . . . . . . . . . -61.44 -35.72 78.37 Favored 'General case' 0 C--N 1.301 -1.533 0 O-C-N 121.501 -0.749 . . . . 0.0 109.348 -179.1 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 100' ' ' ARG . . . . . . . . . . . . . 27.1 mmt180 -61.42 -44.94 96.26 Favored 'General case' 0 N--CA 1.492 1.675 0 O-C-N 121.748 -0.595 . . . . 0.0 110.416 -179.164 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 101' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -102.36 123.93 47.03 Favored 'General case' 0 N--CA 1.497 1.916 0 CA-C-O 121.729 0.776 . . . . 0.0 109.633 -179.728 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 102' ' ' GLU . . . . . 0.606 ' CD ' ' H ' ' A' ' 102' ' ' GLU . 0.8 OUTLIER -93.99 118.9 32.15 Favored 'General case' 0 N--CA 1.495 1.793 0 CA-C-O 121.952 0.882 . . . . 0.0 110.189 -179.986 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 103' ' ' HIS . . . . . . . . . . . . . 52.1 m170 -67.41 -39.45 85.52 Favored 'General case' 0 N--CA 1.488 1.466 0 N-CA-C 109.002 -0.74 . . . . 0.0 109.002 179.446 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 104' ' ' HIS . . . . . . . . . . . . . 77.6 m80 -78.3 154.0 31.28 Favored 'General case' 0 N--CA 1.492 1.649 0 CA-C-O 121.753 0.787 . . . . 0.0 110.346 -179.501 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 105' ' ' HIS . . . . . . . . . . . . . 78.4 m80 45.59 48.69 11.19 Favored 'General case' 0 N--CA 1.49 1.564 0 CA-C-O 121.626 0.727 . . . . 0.0 109.388 -179.747 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 106' ' ' HIS . . . . . . . . . . . . . 84.6 t60 -63.9 -41.68 97.63 Favored 'General case' 0 N--CA 1.489 1.479 0 N-CA-C 109.3 -0.63 . . . . 0.0 109.3 179.703 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 107' ' ' HIS . . . . . . . . . . . . . 84.2 t60 -64.34 -44.79 90.38 Favored 'General case' 0 N--CA 1.492 1.625 0 O-C-N 121.634 -0.666 . . . . 0.0 109.843 -179.44 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 108' ' ' HIS . . . . . . . . . . . . . 85.3 t60 . . . . . 0 N--CA 1.494 1.744 0 CA-C-O 117.7 -1.143 . . . . 0.0 109.8 -179.487 . . . . . . . . 0 0 . 1 . 012 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . 0.411 ' SD ' ' N ' ' A' ' 1' ' ' MET . 4.3 mpp? . . . . . 0 N--CA 1.492 1.626 0 CA-C-O 121.792 0.806 . . . . 0.0 109.196 . . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 42.8 t -68.16 145.17 54.6 Favored 'General case' 0 N--CA 1.491 1.592 0 CA-C-O 121.682 0.754 . . . . 0.0 110.466 -179.251 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 3' ' ' ASN . . . . . . . . . . . . . 51.8 p30 -92.83 169.08 10.74 Favored 'General case' 0 N--CA 1.49 1.543 0 CA-C-O 121.8 0.809 . . . . 0.0 110.401 -179.767 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 99.4 mt-30 45.57 -168.36 0.01 OUTLIER 'General case' 0 N--CA 1.49 1.548 0 CA-C-O 121.904 0.859 . . . . 0.0 110.749 179.93 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 5' ' ' THR . . . . . 0.469 HG22 ' H ' ' A' ' 6' ' ' CYS . 3.5 m 62.35 -129.91 0.61 Allowed 'General case' 0 N--CA 1.489 1.507 0 CA-C-O 121.631 0.729 . . . . 0.0 110.965 179.802 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 6' ' ' CYS . . . . . 0.469 ' H ' HG22 ' A' ' 5' ' ' THR . 1.0 OUTLIER -60.42 -28.08 67.98 Favored 'General case' 0 N--CA 1.485 1.283 0 O-C-N 121.631 -0.668 . . . . 0.0 109.444 -179.501 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 7' ' ' VAL . . . . . . . . . . . . . 57.3 t -99.88 130.71 48.58 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.733 0 O-C-N 121.442 -0.787 . . . . 0.0 110.012 -179.354 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 84.1 tt0 -173.33 -44.66 0.01 OUTLIER 'General case' 0 N--CA 1.49 1.561 0 N-CA-C 109.151 -0.685 . . . . 0.0 109.151 179.427 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 63.8 t30 -79.91 -9.98 59.73 Favored 'General case' 0 N--CA 1.497 1.878 0 O-C-N 121.173 -0.954 . . . . 0.0 109.447 179.743 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 10' ' ' GLU . . . . . 0.539 ' OE1' ' N ' ' A' ' 10' ' ' GLU . 57.5 mp0 -87.2 151.23 23.35 Favored 'General case' 0 N--CA 1.494 1.738 0 O-C-N 121.329 -0.857 . . . . 0.0 110.079 -179.448 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 46.1 t -110.98 130.64 64.04 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.748 0 CA-C-O 121.97 0.89 . . . . 0.0 110.143 -179.105 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 12' ' ' CYS . . . . . 0.418 ' O ' ' C ' ' A' ' 13' ' ' GLU . 7.4 t -73.54 -74.75 0.17 Allowed 'General case' 0 N--CA 1.49 1.531 0 CA-C-N 115.954 -0.566 . . . . 0.0 110.319 -179.669 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 13' ' ' GLU . . . . . 0.418 ' C ' ' O ' ' A' ' 12' ' ' CYS . 95.7 mt-10 38.64 70.78 0.19 Allowed 'General case' 0 N--CA 1.496 1.874 0 CA-C-O 121.602 0.715 . . . . 0.0 109.899 -179.373 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -63.03 140.55 58.88 Favored 'General case' 0 N--CA 1.488 1.474 0 CA-C-O 121.716 0.769 . . . . 0.0 110.024 -179.264 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 96.9 m -100.0 147.19 25.86 Favored 'General case' 0 N--CA 1.491 1.612 0 CA-C-O 121.8 0.81 . . . . 0.0 110.085 -179.567 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . -89.09 -72.89 1.28 Allowed Glycine 0 N--CA 1.489 2.232 0 N-CA-C 110.09 -1.204 . . . . 0.0 110.09 -179.84 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 17' ' ' CYS . . . . . 0.522 ' O ' ' N ' ' A' ' 19' ' ' GLY . 96.7 m -64.63 -35.9 82.52 Favored 'General case' 0 N--CA 1.493 1.717 0 O-C-N 121.495 -1.003 . . . . 0.0 109.452 -179.837 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . 47.95 12.16 0.03 OUTLIER 'General case' 0 N--CA 1.492 1.673 0 O-C-N 121.588 -0.695 . . . . 0.0 109.738 -179.846 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 19' ' ' GLY . . . . . 0.522 ' N ' ' O ' ' A' ' 17' ' ' CYS . . . -85.28 2.53 88.1 Favored Glycine 0 N--CA 1.493 2.435 0 N-CA-C 109.2 -1.56 . . . . 0.0 109.2 179.535 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 7.1 pt-20 -43.62 95.05 0.01 OUTLIER 'General case' 0 N--CA 1.494 1.762 0 O-C-N 121.676 -0.896 . . . . 0.0 110.017 -179.702 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 21' ' ' ILE . . . . . 0.474 ' N ' ' O ' ' A' ' 19' ' ' GLY . 19.5 tt -89.8 129.72 40.26 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.583 0 CA-C-O 121.704 0.764 . . . . 0.0 110.142 -179.619 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 172.4 107.4 0.2 Allowed Glycine 0 N--CA 1.49 2.252 0 N-CA-C 109.448 -1.461 . . . . 0.0 109.448 179.664 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 23' ' ' PHE . . . . . . . . . . . . . 68.2 t80 -101.52 122.1 43.19 Favored 'General case' 0 N--CA 1.495 1.804 0 O-C-N 121.562 -0.963 . . . . 0.0 109.16 -179.913 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 3.5 pt -83.82 147.79 5.49 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.559 0 CA-C-O 121.948 0.88 . . . . 0.0 110.729 -179.311 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 25' ' ' ILE . . . . . 0.416 ' O ' ' O ' ' A' ' 26' ' ' ARG . 96.3 mt 53.39 101.67 0.02 OUTLIER 'Isoleucine or valine' 0 N--CA 1.486 1.358 0 CA-C-O 121.815 0.817 . . . . 0.0 109.785 179.864 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 26' ' ' ARG . . . . . 0.449 ' CG ' ' H ' ' A' ' 27' ' ' GLU . 11.3 tpt180 -60.21 -137.06 0.0 OUTLIER 'General case' 0 N--CA 1.491 1.6 0 CA-C-O 121.689 0.757 . . . . 0.0 110.83 -179.2 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 27' ' ' GLU . . . . . 0.449 ' H ' ' CG ' ' A' ' 26' ' ' ARG . 37.9 tp10 -132.92 58.73 1.76 Allowed 'General case' 0 N--CA 1.493 1.692 0 CA-C-O 121.649 0.738 . . . . 0.0 109.345 -179.819 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 28' ' ' GLY . . . . . 0.508 ' O ' HG12 ' A' ' 31' ' ' VAL . . . -66.43 169.29 33.25 Favored Glycine 0 N--CA 1.492 2.376 0 N-CA-C 110.585 -1.006 . . . . 0.0 110.585 -179.857 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 29' ' ' ASP . . . . . 0.407 ' N ' ' OD1' ' A' ' 29' ' ' ASP . 37.4 p-10 -79.54 -2.63 43.19 Favored 'General case' 0 N--CA 1.489 1.515 0 O-C-N 121.72 -0.87 . . . . 0.0 109.496 179.868 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 62.3 t0 -94.36 25.96 3.61 Favored 'General case' 0 N--CA 1.492 1.662 0 N-CA-C 108.674 -0.861 . . . . 0.0 108.674 -179.95 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 31' ' ' VAL . . . . . 0.508 HG12 ' O ' ' A' ' 28' ' ' GLY . 4.2 p -129.25 153.98 39.45 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.804 0 CA-C-O 121.349 0.595 . . . . 0.0 109.851 -179.58 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -133.18 148.12 52.06 Favored 'General case' 0 N--CA 1.493 1.71 0 CA-C-O 121.661 0.744 . . . . 0.0 109.575 -179.953 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 98.2 mt-10 -92.17 148.06 22.45 Favored 'General case' 0 N--CA 1.49 1.557 0 CA-C-O 121.559 0.695 . . . . 0.0 110.084 -179.877 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 34' ' ' VAL . . . . . . . . . . . . . 51.6 t -127.01 132.64 69.73 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.671 0 CA-C-O 121.556 0.693 . . . . 0.0 109.385 -179.962 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 70.7 m -125.48 122.75 37.53 Favored 'General case' 0 N--CA 1.492 1.65 0 N-CA-C 109.342 -0.614 . . . . 0.0 109.342 179.918 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 39.8 tp -120.85 133.07 55.31 Favored 'General case' 0 N--CA 1.496 1.841 0 CA-C-O 121.602 0.715 . . . . 0.0 109.336 179.741 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 37' ' ' PHE . . . . . . . . . . . . . 83.4 m-85 -93.94 147.79 22.77 Favored 'General case' 0 N--CA 1.49 1.557 0 CA-C-O 121.646 0.736 . . . . 0.0 110.083 -179.526 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . 179.96 -179.29 48.81 Favored Glycine 0 N--CA 1.487 2.045 0 N-CA-C 110.05 -1.22 . . . . 0.0 110.05 179.877 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 39' ' ' SER . . . . . 0.43 ' O ' ' O ' ' A' ' 73' ' ' ALA . 13.3 p -82.7 -102.85 0.04 OUTLIER 'General case' 0 N--CA 1.49 1.54 0 O-C-N 121.692 -0.887 . . . . 0.0 110.325 -179.715 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 40' ' ' ASP . . . . . . . . . . . . . 52.4 p-10 -83.8 174.97 9.98 Favored 'General case' 0 N--CA 1.492 1.629 0 O-C-N 121.371 -0.83 . . . . 0.0 110.777 -179.037 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 37.5 ttmt -62.95 -39.91 96.06 Favored 'General case' 0 N--CA 1.49 1.54 0 O-C-N 121.712 -0.617 . . . . 0.0 110.63 -179.353 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -56.17 -43.32 78.26 Favored 'General case' 0 N--CA 1.495 1.815 0 O-C-N 121.223 -0.923 . . . . 0.0 109.893 -179.166 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 43' ' ' HIS . . . . . . . . . . . . . 83.2 t60 -66.9 -43.11 84.27 Favored 'General case' 0 N--CA 1.494 1.773 0 O-C-N 121.408 -0.808 . . . . 0.0 109.878 -179.853 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 47.5 mt -63.86 -40.58 96.9 Favored 'General case' 0 N--CA 1.494 1.774 0 O-C-N 121.302 -0.874 . . . . 0.0 109.939 -179.642 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 97.1 mt-10 -65.09 -36.12 83.29 Favored 'General case' 0 N--CA 1.494 1.765 0 O-C-N 121.315 -0.865 . . . . 0.0 109.662 -179.708 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . -61.02 -42.47 99.81 Favored Glycine 0 N--CA 1.492 2.395 0 N-CA-C 109.407 -1.477 . . . . 0.0 109.407 179.993 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 97.4 mttt -83.19 -17.11 44.0 Favored 'General case' 0 N--CA 1.492 1.633 0 O-C-N 121.533 -0.98 . . . . 0.0 109.308 179.548 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 48' ' ' LEU . . . . . 0.564 HD13 ' CD2' ' A' ' 76' ' ' LEU . 51.5 tp -65.18 -39.44 92.91 Favored 'General case' 0 N--CA 1.491 1.611 0 O-C-N 121.536 -0.728 . . . . 0.0 109.697 179.954 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 49' ' ' ALA . . . . . . . . . . . . . . . -54.25 -28.59 42.52 Favored 'General case' 0 N--CA 1.491 1.618 0 O-C-N 121.591 -0.693 . . . . 0.0 109.571 -179.131 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 80.5 mm-40 -66.72 -42.75 85.83 Favored 'General case' 0 N--CA 1.492 1.638 0 O-C-N 121.384 -0.822 . . . . 0.0 109.335 179.78 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 32.0 m-85 -61.2 -44.62 96.99 Favored 'General case' 0 N--CA 1.495 1.811 0 O-C-N 121.551 -0.718 . . . . 0.0 109.891 -179.969 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 52' ' ' ILE . . . . . . . . . . . . . 96.6 mt -65.28 -43.75 95.09 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.59 0 O-C-N 121.676 -0.64 . . . . 0.0 110.58 -179.208 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 5.2 t -61.06 -51.62 68.39 Favored 'General case' 0 N--CA 1.494 1.741 0 O-C-N 121.271 -0.893 . . . . 0.0 110.316 -179.037 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 54' ' ' LEU . . . . . . . . . . . . . 4.0 mm? -66.0 -38.07 87.53 Favored 'General case' 0 N--CA 1.492 1.657 0 O-C-N 121.525 -0.734 . . . . 0.0 109.886 179.716 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -55.39 -48.12 74.82 Favored 'General case' 0 N--CA 1.49 1.572 0 O-C-N 121.513 -0.742 . . . . 0.0 110.332 -179.029 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 56' ' ' LYS . . . . . . . . . . . . . 61.4 mttp -65.65 -42.68 91.12 Favored 'General case' 0 N--CA 1.493 1.683 0 O-C-N 121.299 -0.876 . . . . 0.0 110.121 -179.921 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 27.4 mt-30 -65.62 -45.69 82.14 Favored 'General case' 0 N--CA 1.493 1.7 0 O-C-N 121.402 -0.811 . . . . 0.0 109.488 -179.656 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 58' ' ' VAL . . . . . . . . . . . . . 71.7 t -65.15 -45.86 92.76 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.478 0 O-C-N 121.589 -0.695 . . . . 0.0 109.343 179.783 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 59' ' ' TYR . . . . . . . . . . . . . 52.4 t80 -132.33 119.52 20.85 Favored 'General case' 0 N--CA 1.496 1.853 0 CA-C-O 121.616 0.722 . . . . 0.0 109.108 -179.979 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -70.51 144.39 51.36 Favored 'General case' 0 N--CA 1.491 1.592 0 CA-C-O 121.813 0.816 . . . . 0.0 110.913 -179.236 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 61' ' ' ASN . . . . . . . . . . . . . 40.3 t-20 57.79 41.81 24.4 Favored 'General case' 0 N--CA 1.492 1.63 0 CA-C-O 121.851 0.834 . . . . 0.0 109.349 179.926 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 62' ' ' VAL . . . . . . . . . . . . . 8.2 p -74.09 138.84 20.35 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.48 0 CA-C-O 121.631 0.729 . . . . 0.0 110.452 -179.776 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 71.7 mm-40 -112.64 137.59 50.68 Favored 'General case' 0 N--CA 1.494 1.751 0 CA-C-O 121.609 0.719 . . . . 0.0 109.402 179.968 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 64' ' ' TYR . . . . . . . . . . . . . 50.9 p90 -149.64 161.08 42.88 Favored 'General case' 0 N--CA 1.489 1.493 0 CA-C-O 121.721 0.772 . . . . 0.0 110.337 -179.585 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 50.8 tp10 -142.4 148.72 38.29 Favored 'General case' 0 N--CA 1.49 1.573 0 N-CA-C 108.997 -0.742 . . . . 0.0 108.997 179.782 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 66' ' ' VAL . . . . . . . . . . . . . 54.9 t -111.62 130.87 64.41 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.791 0 CA-C-O 121.79 0.805 . . . . 0.0 109.839 -179.59 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -82.18 158.91 66.22 Favored Pre-proline 0 N--CA 1.488 1.425 0 N-CA-C 109.605 -0.517 . . . . 0.0 109.605 -179.759 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 68' ' ' PRO . . . . . . . . . . . . . 48.6 Cg_exo -51.26 128.8 26.58 Favored 'Trans proline' 0 N--CA 1.493 1.45 0 C-N-CA 122.233 1.955 . . . . 0.0 112.178 179.039 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 69' ' ' VAL . . . . . . . . . . . . . 54.0 t -131.27 135.31 59.83 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.754 0 CA-C-O 121.649 0.738 . . . . 0.0 110.02 -179.827 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -69.71 152.47 44.62 Favored 'General case' 0 C--N 1.303 -1.451 0 CA-C-O 121.75 0.786 . . . . 0.0 110.006 179.554 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 12.9 m-20 -64.27 -34.49 78.24 Favored 'General case' 0 N--CA 1.491 1.586 0 O-C-N 121.629 -0.67 . . . . 0.0 109.424 179.886 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 72' ' ' ASN . . . . . . . . . . . . . 57.1 p30 -94.8 16.32 16.18 Favored 'General case' 0 N--CA 1.493 1.704 0 O-C-N 121.348 -0.845 . . . . 0.0 109.435 -179.445 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 73' ' ' ALA . . . . . 0.43 ' O ' ' O ' ' A' ' 39' ' ' SER . . . -66.6 144.95 56.11 Favored 'General case' 0 N--CA 1.491 1.594 0 O-C-N 121.525 -0.734 . . . . 0.0 110.059 179.964 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 74' ' ' THR . . . . . . . . . . . . . 61.4 p -101.13 -0.96 35.2 Favored 'General case' 0 N--CA 1.493 1.688 0 O-C-N 121.551 -0.718 . . . . 0.0 109.299 179.857 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 95.3 mt-10 -139.58 160.05 40.76 Favored 'General case' 0 N--CA 1.496 1.856 0 O-C-N 121.256 -0.903 . . . . 0.0 109.835 -179.856 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 76' ' ' LEU . . . . . 0.564 ' CD2' HD13 ' A' ' 48' ' ' LEU . 6.5 tp -123.8 131.15 53.53 Favored 'General case' 0 N--CA 1.491 1.617 0 CA-C-O 121.524 0.678 . . . . 0.0 109.37 -179.95 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 77' ' ' HIS . . . . . . . . . . . . . 97.2 m-70 -106.35 126.77 52.65 Favored 'General case' 0 N--CA 1.493 1.681 0 CA-C-O 121.541 0.686 . . . . 0.0 109.689 -179.767 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -149.4 159.75 44.03 Favored 'General case' 0 N--CA 1.49 1.529 0 CA-C-O 121.507 0.67 . . . . 0.0 109.848 -179.763 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 86.4 mtm-85 -127.47 142.37 51.42 Favored 'General case' 0 N--CA 1.495 1.8 0 CA-C-O 121.508 0.671 . . . . 0.0 109.433 -179.847 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 80' ' ' PHE . . . . . . . . . . . . . 44.1 m-85 -127.87 149.47 50.28 Favored 'General case' 0 N--CA 1.498 1.931 0 CA-C-O 121.401 0.619 . . . . 0.0 109.741 -179.482 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 82.8 tttt -111.73 133.36 54.01 Favored 'General case' 0 N--CA 1.493 1.698 0 CA-C-O 121.554 0.692 . . . . 0.0 109.685 -179.861 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 82' ' ' PHE . . . . . . . . . . . . . 71.8 m-85 -137.54 -128.53 0.13 Allowed 'General case' 0 N--CA 1.494 1.73 0 CA-C-O 121.442 0.639 . . . . 0.0 109.711 -179.665 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 81.3 tt0 -149.8 -34.14 0.18 Allowed 'General case' 0 N--CA 1.489 1.489 0 O-C-N 121.519 -0.738 . . . . 0.0 109.132 -179.765 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 84' ' ' VAL . . . . . . . . . . . . . 34.8 m -135.08 158.28 41.05 Favored 'Isoleucine or valine' 0 N--CA 1.499 1.98 0 O-C-N 121.31 -0.869 . . . . 0.0 110.348 -179.971 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 82.8 p -74.07 -16.77 61.02 Favored 'General case' 0 N--CA 1.491 1.582 0 CA-C-O 121.327 0.584 . . . . 0.0 109.823 -179.952 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 86' ' ' ALA . . . . . . . . . . . . . . . -63.89 -38.2 90.22 Favored 'General case' 0 N--CA 1.492 1.667 0 O-C-N 121.367 -0.833 . . . . 0.0 109.457 -179.761 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 94.4 mt-10 -68.08 -35.05 77.56 Favored 'General case' 0 N--CA 1.491 1.624 0 O-C-N 121.499 -0.75 . . . . 0.0 109.302 179.683 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 88' ' ' LYS . . . . . . . . . . . . . 49.1 tptt -61.95 -44.48 96.67 Favored 'General case' 0 C--N 1.302 -1.491 0 O-C-N 121.436 -0.79 . . . . 0.0 109.211 179.82 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 42.5 tp -62.07 -50.16 73.08 Favored 'General case' 0 C--N 1.303 -1.431 0 O-C-N 121.651 -0.655 . . . . 0.0 109.817 -179.029 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 90' ' ' ILE . . . . . . . . . . . . . 96.6 mt -66.66 -43.03 90.5 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.773 0 O-C-N 121.529 -0.732 . . . . 0.0 109.878 179.929 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 91' ' ' PHE . . . . . 0.422 ' O ' HG23 ' A' ' 95' ' ' THR . 71.1 t80 -59.35 -46.09 89.59 Favored 'General case' 0 N--CA 1.493 1.679 0 O-C-N 121.468 -0.77 . . . . 0.0 109.649 -179.186 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 92' ' ' GLU . . . . . . . . . . . . . 9.5 tm-20 -66.98 -41.18 87.22 Favored 'General case' 0 N--CA 1.49 1.536 0 CA-C-O 121.691 0.758 . . . . 0.0 109.191 179.881 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 93' ' ' LEU . . . . . 0.544 HD13 ' O ' ' A' ' 93' ' ' LEU . 0.3 OUTLIER -63.87 -47.71 79.61 Favored 'General case' 0 C--N 1.303 -1.437 0 CA-C-O 121.932 0.873 . . . . 0.0 109.651 -179.226 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 94' ' ' LYS . . . . . . . . . . . . . 54.9 mtpt -65.04 -43.52 92.05 Favored 'General case' 0 C--N 1.3 -1.567 0 O-C-N 121.411 -0.806 . . . . 0.0 109.786 -179.252 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 95' ' ' THR . . . . . 0.422 HG23 ' O ' ' A' ' 91' ' ' PHE . 40.9 p -69.06 -35.56 76.69 Favored 'General case' 0 N--CA 1.491 1.6 0 O-C-N 121.608 -0.683 . . . . 0.0 109.847 -179.867 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 96' ' ' ARG . . . . . 0.492 ' NE ' HH21 ' A' ' 100' ' ' ARG . 74.1 ttt180 -64.63 -42.9 95.16 Favored 'General case' 0 N--CA 1.491 1.587 0 O-C-N 121.487 -0.758 . . . . 0.0 109.267 179.798 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 97' ' ' ALA . . . . . . . . . . . . . . . -62.24 -40.54 96.5 Favored 'General case' 0 N--CA 1.493 1.704 0 CA-C-O 121.477 0.656 . . . . 0.0 109.482 -179.946 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 98' ' ' LEU . . . . . . . . . . . . . 93.6 mt -64.26 -40.7 96.51 Favored 'General case' 0 N--CA 1.492 1.636 0 O-C-N 121.583 -0.698 . . . . 0.0 109.449 179.745 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 99' ' ' ALA . . . . . . . . . . . . . . . -83.03 -6.4 59.48 Favored 'General case' 0 N--CA 1.49 1.528 0 N-CA-C 109.19 -0.67 . . . . 0.0 109.19 179.901 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 100' ' ' ARG . . . . . 0.492 HH21 ' NE ' ' A' ' 96' ' ' ARG . 44.5 ttm180 -85.71 -15.91 40.7 Favored 'General case' 0 N--CA 1.493 1.721 0 O-C-N 121.521 -0.737 . . . . 0.0 109.022 179.71 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 101' ' ' LEU . . . . . 0.575 HD22 ' N ' ' A' ' 101' ' ' LEU . 3.7 mm? 59.52 121.41 0.01 OUTLIER 'General case' 0 N--CA 1.493 1.705 0 CA-C-O 121.948 0.88 . . . . 0.0 110.163 -179.701 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 102' ' ' GLU . . . . . . . . . . . . . 12.2 pt-20 -60.18 133.07 55.75 Favored 'General case' 0 N--CA 1.488 1.427 0 CA-C-O 121.546 0.689 . . . . 0.0 109.979 -179.602 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 103' ' ' HIS . . . . . . . . . . . . . 52.5 t-80 -95.3 -75.44 0.52 Allowed 'General case' 0 N--CA 1.494 1.774 0 CA-C-O 121.7 0.762 . . . . 0.0 109.437 -179.97 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 104' ' ' HIS . . . . . 0.687 ' CG ' ' H ' ' A' ' 105' ' ' HIS . 43.7 t60 42.04 -152.82 0.02 OUTLIER 'General case' 0 N--CA 1.494 1.731 0 CA-C-O 121.573 0.702 . . . . 0.0 110.404 179.994 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 105' ' ' HIS . . . . . 0.687 ' H ' ' CG ' ' A' ' 104' ' ' HIS . 1.3 p80 -150.32 165.15 33.91 Favored 'General case' 0 N--CA 1.487 1.4 0 O-C-N 121.471 -0.768 . . . . 0.0 109.579 -179.583 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 106' ' ' HIS . . . . . . . . . . . . . 80.3 t60 -75.86 131.35 39.64 Favored 'General case' 0 N--CA 1.489 1.495 0 CA-C-O 121.711 0.767 . . . . 0.0 110.484 -179.252 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 107' ' ' HIS . . . . . . . . . . . . . 45.9 p-80 -150.63 162.35 40.83 Favored 'General case' 0 N--CA 1.489 1.524 0 CA-C-O 121.536 0.684 . . . . 0.0 109.874 179.652 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 108' ' ' HIS . . . . . . . . . . . . . 42.7 p-80 . . . . . 0 N--CA 1.491 1.613 0 CA-C-O 118.004 -0.998 . . . . 0.0 109.156 179.883 . . . . . . . . 0 0 . 1 . 013 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 63.8 ttp . . . . . 0 N--CA 1.493 1.698 0 CA-C-O 121.428 0.632 . . . . 0.0 109.538 . . . . . . . . . 0 0 . 1 . 013 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 79.4 p -63.79 -33.19 75.12 Favored 'General case' 0 N--CA 1.494 1.728 0 O-C-N 121.556 -0.715 . . . . 0.0 109.67 -179.907 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 3' ' ' ASN . . . . . . . . . . . . . 98.9 m-20 -64.34 -39.76 94.55 Favored 'General case' 0 N--CA 1.493 1.705 0 O-C-N 121.455 -0.778 . . . . 0.0 109.47 179.895 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 85.9 mt-30 -81.48 119.74 24.12 Favored 'General case' 0 N--CA 1.489 1.52 0 O-C-N 121.358 -0.839 . . . . 0.0 109.736 -179.74 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 71.9 p -101.8 -10.58 19.78 Favored 'General case' 0 N--CA 1.493 1.677 0 N-CA-C 108.867 -0.79 . . . . 0.0 108.867 179.624 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 1.9 t -90.98 5.71 47.68 Favored 'General case' 0 N--CA 1.498 1.945 0 O-C-N 121.451 -0.781 . . . . 0.0 109.495 179.7 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 7' ' ' VAL . . . . . . . . . . . . . 12.9 p -67.46 136.52 26.47 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.735 0 O-C-N 121.305 -0.872 . . . . 0.0 110.489 -179.222 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 19.5 pt-20 -150.86 -159.21 1.0 Allowed 'General case' 0 N--CA 1.489 1.478 0 CA-C-O 121.443 0.64 . . . . 0.0 109.421 179.683 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 97.7 m-20 -73.1 -119.64 0.0 OUTLIER 'General case' 0 N--CA 1.491 1.614 0 CA-C-O 121.889 0.852 . . . . 0.0 110.246 -179.47 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 81.5 tt0 45.71 82.42 0.03 OUTLIER 'General case' 0 N--CA 1.489 1.493 0 O-C-N 121.537 -0.727 . . . . 0.0 109.651 -179.516 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 54.9 t -118.63 132.25 69.04 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.959 0 CA-C-O 121.777 0.798 . . . . 0.0 109.987 -179.514 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 12' ' ' CYS . . . . . 0.429 ' O ' ' N ' ' A' ' 14' ' ' ALA . 69.2 m 47.84 22.47 0.36 Allowed 'General case' 0 N--CA 1.492 1.655 0 CA-C-O 121.646 0.736 . . . . 0.0 109.786 179.974 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 79.6 mm-40 53.88 -90.42 0.02 OUTLIER 'General case' 0 N--CA 1.493 1.688 0 CA-C-O 121.591 0.71 . . . . 0.0 110.17 179.498 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 14' ' ' ALA . . . . . 0.429 ' N ' ' O ' ' A' ' 12' ' ' CYS . . . 49.85 82.39 0.05 Allowed 'General case' 0 N--CA 1.494 1.751 0 CA-C-O 121.867 0.841 . . . . 0.0 109.685 -179.508 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 54.2 m -93.46 141.99 27.84 Favored 'General case' 0 N--CA 1.494 1.734 0 CA-C-O 121.789 0.804 . . . . 0.0 110.253 -179.599 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . -83.28 37.63 2.74 Favored Glycine 0 N--CA 1.492 2.379 0 N-CA-C 109.62 -1.392 . . . . 0.0 109.62 179.656 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -61.74 -37.43 84.23 Favored 'General case' 0 N--CA 1.491 1.596 0 O-C-N 121.321 -1.105 . . . . 0.0 109.194 179.761 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -63.9 140.81 58.91 Favored 'General case' 0 N--CA 1.491 1.595 0 CA-C-O 121.88 0.848 . . . . 0.0 110.291 -178.977 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 19' ' ' GLY . . . . . 0.427 ' C ' ' N ' ' A' ' 21' ' ' ILE . . . -91.24 -6.01 66.96 Favored Glycine 0 N--CA 1.493 2.442 0 N-CA-C 109.464 -1.454 . . . . 0.0 109.464 179.754 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 20' ' ' GLU . . . . . 0.452 ' O ' ' O ' ' A' ' 21' ' ' ILE . 22.0 tp10 47.66 20.65 0.21 Allowed 'General case' 0 N--CA 1.493 1.699 0 O-C-N 121.483 -1.01 . . . . 0.0 109.238 -179.785 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 21' ' ' ILE . . . . . 0.452 ' O ' ' O ' ' A' ' 20' ' ' GLU . 93.7 mt 58.31 139.8 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.492 1.669 0 CA-C-O 122.023 0.916 . . . . 0.0 110.263 179.388 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . -72.78 -174.04 25.03 Favored Glycine 0 N--CA 1.487 2.055 0 N-CA-C 110.826 -0.91 . . . . 0.0 110.826 -179.354 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 23' ' ' PHE . . . . . . . . . . . . . 91.7 m-85 -86.32 131.21 34.27 Favored 'General case' 0 N--CA 1.491 1.58 0 O-C-N 121.689 -0.889 . . . . 0.0 110.276 -179.651 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 35.8 mm -69.38 -41.71 80.92 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.695 0 CA-C-O 121.673 0.749 . . . . 0.0 109.765 179.642 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 25' ' ' ILE . . . . . 0.404 ' O ' ' O ' ' A' ' 26' ' ' ARG . 34.1 mm -61.75 -42.29 93.84 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.68 0 O-C-N 121.274 -0.891 . . . . 0.0 109.511 -179.386 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 26' ' ' ARG . . . . . 0.404 ' O ' ' O ' ' A' ' 25' ' ' ILE . 95.9 mtt-85 59.78 121.18 0.01 OUTLIER 'General case' 0 N--CA 1.494 1.742 0 CA-C-O 121.847 0.832 . . . . 0.0 109.991 -179.971 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 97.9 mt-10 -64.21 137.56 58.0 Favored 'General case' 0 N--CA 1.491 1.623 0 CA-C-O 121.685 0.755 . . . . 0.0 110.421 -179.37 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . 156.56 -62.39 0.33 Allowed Glycine 0 N--CA 1.49 2.247 0 N-CA-C 109.544 -1.422 . . . . 0.0 109.544 179.834 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 99.3 m-20 -70.62 -168.7 0.27 Allowed 'General case' 0 N--CA 1.495 1.786 0 O-C-N 121.444 -1.033 . . . . 0.0 111.284 -179.406 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 97.3 m-20 -75.74 94.31 3.25 Favored 'General case' 0 N--CA 1.488 1.472 0 CA-C-O 121.515 0.674 . . . . 0.0 109.846 -179.415 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 8.6 p -123.13 144.62 32.06 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.708 0 CA-C-O 121.354 0.597 . . . . 0.0 109.487 179.955 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -116.71 155.46 28.82 Favored 'General case' 0 N--CA 1.495 1.781 0 CA-C-O 121.473 0.654 . . . . 0.0 109.383 -179.404 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 77.7 mm-40 -108.26 136.06 48.55 Favored 'General case' 0 N--CA 1.494 1.729 0 CA-C-O 121.598 0.713 . . . . 0.0 109.61 179.858 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 34' ' ' VAL . . . . . . . . . . . . . 56.0 t -127.26 134.38 66.02 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.874 0 CA-C-O 121.592 0.711 . . . . 0.0 109.937 -179.579 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 45.8 p -136.68 122.42 19.86 Favored 'General case' 0 N--CA 1.493 1.704 0 N-CA-C 108.73 -0.841 . . . . 0.0 108.73 179.299 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 51.0 tp -117.7 143.59 46.05 Favored 'General case' 0 N--CA 1.497 1.882 0 CA-C-O 121.645 0.736 . . . . 0.0 110.109 -179.443 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 37' ' ' PHE . . . . . . . . . . . . . 82.9 m-85 -105.84 145.62 30.98 Favored 'General case' 0 N--CA 1.494 1.752 0 CA-C-O 121.657 0.741 . . . . 0.0 109.998 -179.858 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 38' ' ' GLY . . . . . 0.426 ' N ' HD21 ' A' ' 44' ' ' LEU . . . -173.55 175.28 46.27 Favored Glycine 0 N--CA 1.487 2.081 0 N-CA-C 109.77 -1.332 . . . . 0.0 109.77 -179.972 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 52.5 p -81.85 -92.28 0.06 Allowed 'General case' 0 N--CA 1.492 1.633 0 O-C-N 121.582 -0.952 . . . . 0.0 109.989 -179.819 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 40' ' ' ASP . . . . . . . . . . . . . 99.8 m-20 -82.24 168.82 17.25 Favored 'General case' 0 N--CA 1.495 1.779 0 O-C-N 121.225 -0.922 . . . . 0.0 110.631 -179.387 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 65.8 tttm -64.04 -38.82 92.46 Favored 'General case' 0 N--CA 1.497 1.908 0 O-C-N 121.652 -0.655 . . . . 0.0 110.514 -179.933 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -56.01 -39.21 71.55 Favored 'General case' 0 N--CA 1.494 1.766 0 O-C-N 121.314 -0.866 . . . . 0.0 109.935 -179.246 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 43' ' ' HIS . . . . . 0.68 ' CE1' ' HZ3' ' A' ' 47' ' ' LYS . 78.1 t60 -66.79 -45.2 79.16 Favored 'General case' 0 N--CA 1.494 1.743 0 O-C-N 121.315 -0.866 . . . . 0.0 109.861 -179.928 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 44' ' ' LEU . . . . . 0.426 HD21 ' N ' ' A' ' 38' ' ' GLY . 81.8 mt -64.69 -41.67 95.87 Favored 'General case' 0 N--CA 1.497 1.91 0 O-C-N 121.382 -0.823 . . . . 0.0 109.955 -179.69 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 71.1 mm-40 -63.91 -38.4 90.93 Favored 'General case' 0 N--CA 1.491 1.593 0 CA-C-O 121.66 0.743 . . . . 0.0 109.573 -179.81 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . -57.86 -54.81 34.45 Favored Glycine 0 N--CA 1.492 2.394 0 N-CA-C 109.823 -1.311 . . . . 0.0 109.823 -179.589 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 47' ' ' LYS . . . . . 0.68 ' HZ3' ' CE1' ' A' ' 43' ' ' HIS . 50.5 mttp -66.29 -37.8 86.27 Favored 'General case' 0 N--CA 1.494 1.755 0 O-C-N 121.497 -1.002 . . . . 0.0 109.761 179.45 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 50.5 tp -49.45 -36.17 21.71 Favored 'General case' 0 N--CA 1.492 1.632 0 O-C-N 121.497 -0.752 . . . . 0.0 109.394 -179.525 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 49' ' ' ALA . . . . . . . . . . . . . . . -55.03 -40.1 69.87 Favored 'General case' 0 N--CA 1.493 1.718 0 O-C-N 121.407 -0.808 . . . . 0.0 109.715 -179.918 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 96.8 mt-10 -67.21 -39.43 86.28 Favored 'General case' 0 N--CA 1.497 1.887 0 O-C-N 121.355 -0.84 . . . . 0.0 109.939 -179.888 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 12.4 m-85 -61.6 -47.41 85.61 Favored 'General case' 0 N--CA 1.496 1.856 0 O-C-N 121.36 -0.837 . . . . 0.0 109.918 -179.556 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 52' ' ' ILE . . . . . . . . . . . . . 96.8 mt -66.17 -43.13 92.15 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.629 0 O-C-N 121.524 -0.735 . . . . 0.0 109.884 -179.619 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 80.5 p -58.93 -43.21 91.14 Favored 'General case' 0 N--CA 1.494 1.769 0 O-C-N 121.371 -0.831 . . . . 0.0 109.498 -179.328 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 54' ' ' LEU . . . . . . . . . . . . . 79.7 mt -64.95 -39.88 94.17 Favored 'General case' 0 N--CA 1.494 1.734 0 O-C-N 121.461 -0.774 . . . . 0.0 109.366 179.358 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -58.56 -42.68 88.48 Favored 'General case' 0 N--CA 1.49 1.546 0 CA-C-O 121.535 0.683 . . . . 0.0 109.595 -179.774 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 56' ' ' LYS . . . . . . . . . . . . . 54.0 mtmt -64.9 -45.31 86.44 Favored 'General case' 0 N--CA 1.492 1.672 0 O-C-N 121.326 -0.859 . . . . 0.0 109.554 179.658 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 99.3 mm-40 -63.47 -44.13 95.33 Favored 'General case' 0 N--CA 1.494 1.736 0 O-C-N 121.589 -0.694 . . . . 0.0 109.64 -179.866 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 58' ' ' VAL . . . . . . . . . . . . . 79.4 t -65.17 -45.43 93.98 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.691 0 O-C-N 121.283 -0.885 . . . . 0.0 109.443 179.823 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 59' ' ' TYR . . . . . . . . . . . . . 82.8 t80 -140.25 120.06 13.45 Favored 'General case' 0 N--CA 1.497 1.881 0 O-C-N 121.272 -0.893 . . . . 0.0 109.589 -179.975 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -68.09 148.1 51.42 Favored 'General case' 0 N--CA 1.491 1.586 0 CA-C-O 121.819 0.818 . . . . 0.0 110.631 -179.717 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 61' ' ' ASN . . . . . . . . . . . . . 8.5 t-20 59.44 40.73 20.42 Favored 'General case' 0 N--CA 1.493 1.68 0 CA-C-O 121.689 0.757 . . . . 0.0 109.693 -179.879 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 62' ' ' VAL . . . . . . . . . . . . . 14.9 p -74.84 139.62 18.85 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.618 0 O-C-N 121.52 -0.737 . . . . 0.0 110.056 179.782 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 63' ' ' GLU . . . . . 0.548 ' OE1' ' N ' ' A' ' 63' ' ' GLU . 56.6 mp0 -109.84 137.15 48.04 Favored 'General case' 0 N--CA 1.495 1.785 0 CA-C-O 121.583 0.706 . . . . 0.0 109.474 -179.656 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 64' ' ' TYR . . . . . . . . . . . . . 53.4 p90 -148.68 163.37 37.51 Favored 'General case' 0 N--CA 1.492 1.643 0 CA-C-O 121.718 0.771 . . . . 0.0 110.252 -179.22 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 44.9 tt0 -141.96 147.81 37.59 Favored 'General case' 0 N--CA 1.494 1.762 0 N-CA-C 108.979 -0.749 . . . . 0.0 108.979 179.711 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 66' ' ' VAL . . . . . . . . . . . . . 92.1 t -120.13 130.19 74.6 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.965 0 CA-C-O 121.654 0.74 . . . . 0.0 110.204 -179.825 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 67' ' ' ALA . . . . . 0.413 ' O ' HG23 ' A' ' 69' ' ' VAL . . . -75.72 152.35 85.01 Favored Pre-proline 0 N--CA 1.485 1.319 0 N-CA-C 109.349 -0.611 . . . . 0.0 109.349 -179.888 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 68' ' ' PRO . . . . . . . . . . . . . 80.4 Cg_exo -42.44 131.39 5.09 Favored 'Trans proline' 0 C--N 1.31 -1.449 0 C-N-CA 122.637 2.224 . . . . 0.0 112.89 179.672 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 69' ' ' VAL . . . . . 0.413 HG23 ' O ' ' A' ' 67' ' ' ALA . 88.3 t -125.32 131.21 72.58 Favored 'Isoleucine or valine' 0 N--CA 1.499 1.985 0 CA-C-O 121.722 0.772 . . . . 0.0 109.978 -179.955 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -76.98 156.33 31.98 Favored 'General case' 0 C--N 1.302 -1.495 0 CA-C-O 121.619 0.723 . . . . 0.0 110.016 179.863 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 71' ' ' ASP . . . . . 0.404 ' O ' ' OD1' ' A' ' 71' ' ' ASP . 62.9 t0 -63.13 -37.77 88.55 Favored 'General case' 0 N--CA 1.493 1.692 0 O-C-N 121.542 -0.724 . . . . 0.0 109.694 179.727 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 72' ' ' ASN . . . . . . . . . . . . . 8.5 m120 -94.23 13.05 24.62 Favored 'General case' 0 N--CA 1.496 1.846 0 O-C-N 121.226 -0.922 . . . . 0.0 109.171 -179.948 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -60.03 141.82 55.04 Favored 'General case' 0 N--CA 1.493 1.723 0 O-C-N 121.34 -0.85 . . . . 0.0 109.972 -179.696 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 74' ' ' THR . . . . . . . . . . . . . 16.4 p -104.83 0.23 27.86 Favored 'General case' 0 N--CA 1.494 1.73 0 N-CA-C 109.013 -0.736 . . . . 0.0 109.013 179.585 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 84.3 tt0 -144.46 149.84 36.65 Favored 'General case' 0 N--CA 1.494 1.772 0 O-C-N 121.143 -0.973 . . . . 0.0 109.614 179.766 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 6.3 tt -124.47 130.35 52.31 Favored 'General case' 0 N--CA 1.494 1.726 0 CA-C-O 121.325 0.583 . . . . 0.0 109.512 179.885 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 77' ' ' HIS . . . . . . . . . . . . . 96.4 m-70 -107.59 130.76 54.86 Favored 'General case' 0 N--CA 1.495 1.808 0 CA-C-O 121.655 0.74 . . . . 0.0 109.679 -179.711 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -146.15 156.82 43.69 Favored 'General case' 0 N--CA 1.49 1.561 0 O-C-N 121.6 -0.687 . . . . 0.0 109.318 -179.697 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 84.6 mtt85 -129.67 145.91 51.49 Favored 'General case' 0 N--CA 1.495 1.82 0 O-C-N 121.646 -0.659 . . . . 0.0 109.629 -179.62 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 80' ' ' PHE . . . . . . . . . . . . . 92.8 m-85 -129.64 145.92 51.47 Favored 'General case' 0 N--CA 1.495 1.816 0 O-C-N 121.637 -0.664 . . . . 0.0 109.353 -179.862 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 27.6 ttpt -117.04 121.53 41.6 Favored 'General case' 0 N--CA 1.494 1.752 0 CA-C-O 121.507 0.67 . . . . 0.0 109.721 -179.785 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 82' ' ' PHE . . . . . . . . . . . . . 68.8 m-85 -111.42 148.81 32.29 Favored 'General case' 0 N--CA 1.495 1.816 0 CA-C-O 121.637 0.732 . . . . 0.0 109.756 179.784 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 80.6 tt0 -64.16 -31.79 73.12 Favored 'General case' 0 N--CA 1.49 1.555 0 O-C-N 121.733 -0.604 . . . . 0.0 109.521 179.957 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 84' ' ' VAL . . . . . 0.425 HG23 ' H ' ' A' ' 87' ' ' GLU . 27.6 m -134.11 156.48 40.88 Favored 'Isoleucine or valine' 0 N--CA 1.5 2.044 0 O-C-N 121.359 -0.838 . . . . 0.0 110.139 -179.853 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 78.3 p -70.26 -24.02 62.99 Favored 'General case' 0 N--CA 1.492 1.64 0 CA-C-O 121.51 0.672 . . . . 0.0 109.962 179.802 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 86' ' ' ALA . . . . . . . . . . . . . . . -59.21 -46.08 89.4 Favored 'General case' 0 N--CA 1.494 1.736 0 O-C-N 121.316 -0.865 . . . . 0.0 109.663 -179.712 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 87' ' ' GLU . . . . . 0.425 ' H ' HG23 ' A' ' 84' ' ' VAL . 98.4 mt-10 -70.52 -32.43 69.9 Favored 'General case' 0 N--CA 1.495 1.799 0 CA-C-O 121.742 0.782 . . . . 0.0 109.36 179.593 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 88' ' ' LYS . . . . . . . . . . . . . 14.1 tmtt? -61.98 -47.22 85.81 Favored 'General case' 0 C--N 1.301 -1.539 0 O-C-N 121.52 -0.737 . . . . 0.0 110.081 -179.713 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 95.8 mt -64.34 -43.26 95.15 Favored 'General case' 0 N--CA 1.494 1.766 0 O-C-N 121.419 -0.801 . . . . 0.0 109.639 -179.988 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 90' ' ' ILE . . . . . . . . . . . . . 96.9 mt -65.64 -43.54 93.86 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.667 0 CA-C-O 121.569 0.7 . . . . 0.0 109.793 -179.631 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 91' ' ' PHE . . . . . . . . . . . . . 76.5 t80 -61.4 -45.48 94.14 Favored 'General case' 0 N--CA 1.493 1.717 0 O-C-N 121.573 -0.704 . . . . 0.0 110.05 -179.465 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 92' ' ' GLU . . . . . . . . . . . . . 48.2 tp10 -66.01 -45.79 80.25 Favored 'General case' 0 N--CA 1.492 1.659 0 O-C-N 121.334 -0.854 . . . . 0.0 109.595 -179.691 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 93' ' ' LEU . . . . . . . . . . . . . 82.8 mt -64.44 -43.22 94.99 Favored 'General case' 0 N--CA 1.497 1.881 0 O-C-N 121.327 -0.858 . . . . 0.0 109.934 -179.917 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 94' ' ' LYS . . . . . . . . . . . . . 38.0 ttmt -66.57 -44.41 82.32 Favored 'General case' 0 N--CA 1.494 1.75 0 O-C-N 121.356 -0.84 . . . . 0.0 109.956 -179.824 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 20.9 p -66.35 -43.74 85.22 Favored 'General case' 0 N--CA 1.494 1.747 0 O-C-N 121.407 -0.808 . . . . 0.0 109.632 -179.716 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 96' ' ' ARG . . . . . . . . . . . . . 41.6 mmm-85 -65.94 -38.92 89.9 Favored 'General case' 0 N--CA 1.493 1.693 0 O-C-N 121.485 -0.759 . . . . 0.0 109.547 179.97 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 97' ' ' ALA . . . . . . . . . . . . . . . -64.35 -37.78 88.72 Favored 'General case' 0 N--CA 1.493 1.712 0 O-C-N 121.525 -0.734 . . . . 0.0 109.581 -179.957 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 98' ' ' LEU . . . . . . . . . . . . . 6.4 tt -63.55 -42.85 98.36 Favored 'General case' 0 C--N 1.299 -1.602 0 O-C-N 121.436 -0.79 . . . . 0.0 109.612 -179.939 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 99' ' ' ALA . . . . . . . . . . . . . . . -75.03 -42.33 57.46 Favored 'General case' 0 N--CA 1.493 1.714 0 O-C-N 121.541 -0.724 . . . . 0.0 110.079 -179.81 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 100' ' ' ARG . . . . . . . . . . . . . 41.0 ttm180 -66.17 -40.91 90.86 Favored 'General case' 0 N--CA 1.497 1.9 0 O-C-N 121.456 -0.778 . . . . 0.0 110.234 -179.575 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 101' ' ' LEU . . . . . 0.458 HD12 ' NE2' ' A' ' 104' ' ' HIS . 74.8 mt 57.67 -170.21 0.11 Allowed 'General case' 0 N--CA 1.497 1.878 0 CA-C-O 121.648 0.737 . . . . 0.0 110.62 179.911 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 102' ' ' GLU . . . . . 0.42 ' O ' ' O ' ' A' ' 103' ' ' HIS . 34.4 tp10 -105.59 53.4 0.71 Allowed 'General case' 0 N--CA 1.495 1.811 0 CA-C-O 121.529 0.68 . . . . 0.0 109.269 -179.541 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 103' ' ' HIS . . . . . 0.42 ' O ' ' O ' ' A' ' 102' ' ' GLU . 99.8 m-70 57.52 118.18 0.01 OUTLIER 'General case' 0 N--CA 1.494 1.731 0 CA-C-O 121.977 0.894 . . . . 0.0 110.681 179.642 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 104' ' ' HIS . . . . . 0.458 ' NE2' HD12 ' A' ' 101' ' ' LEU . 60.7 m170 -62.31 -47.62 83.46 Favored 'General case' 0 N--CA 1.49 1.556 0 O-C-N 121.61 -0.681 . . . . 0.0 109.59 179.779 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 105' ' ' HIS . . . . . 0.424 ' C ' ' O ' ' A' ' 104' ' ' HIS . 85.5 t60 38.62 84.38 0.02 OUTLIER 'General case' 0 N--CA 1.497 1.889 0 CA-C-O 121.703 0.764 . . . . 0.0 110.207 -179.908 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 106' ' ' HIS . . . . . . . . . . . . . 62.7 t-80 -152.13 135.48 15.95 Favored 'General case' 0 N--CA 1.491 1.593 0 O-C-N 121.346 -0.846 . . . . 0.0 109.786 -179.855 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 107' ' ' HIS . . . . . . . . . . . . . 56.8 p-80 -154.69 -7.98 0.14 Allowed 'General case' 0 N--CA 1.49 1.566 0 N-CA-C 109.015 -0.735 . . . . 0.0 109.015 179.698 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 108' ' ' HIS . . . . . . . . . . . . . 86.3 t60 . . . . . 0 N--CA 1.497 1.917 0 CA-C-O 117.942 -1.028 . . . . 0.0 109.538 179.805 . . . . . . . . 0 0 . 1 . 014 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 97.2 mmm . . . . . 0 N--CA 1.491 1.607 0 N-CA-C 109.011 -0.737 . . . . 0.0 109.011 . . . . . . . . . 0 0 . 1 . 014 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . 0.41 ' O ' ' CG ' ' A' ' 3' ' ' ASN . 23.2 t -156.24 39.1 0.35 Allowed 'General case' 0 N--CA 1.49 1.56 0 O-C-N 121.367 -0.833 . . . . 0.0 108.817 179.815 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 3' ' ' ASN . . . . . 0.41 ' CG ' ' O ' ' A' ' 2' ' ' SER . 16.3 p30 42.07 42.48 2.41 Favored 'General case' 0 N--CA 1.497 1.902 0 CA-C-O 121.436 0.636 . . . . 0.0 109.798 -179.695 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 4' ' ' GLN . . . . . 0.415 ' O ' ' O ' ' A' ' 5' ' ' THR . 78.2 mt-30 -60.11 -117.1 0.0 OUTLIER 'General case' 0 N--CA 1.495 1.785 0 O-C-N 121.44 -0.787 . . . . 0.0 110.034 -179.783 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 5' ' ' THR . . . . . 0.415 ' O ' ' O ' ' A' ' 4' ' ' GLN . 64.6 p 40.53 -163.58 0.0 OUTLIER 'General case' 0 N--CA 1.498 1.927 0 CA-C-O 121.589 0.709 . . . . 0.0 110.975 -179.946 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 48.4 t -79.27 136.56 37.08 Favored 'General case' 0 N--CA 1.492 1.667 0 CA-C-O 121.443 0.639 . . . . 0.0 109.861 -179.39 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 7' ' ' VAL . . . . . . . . . . . . . 26.9 m -79.32 133.33 30.12 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.697 0 O-C-N 121.218 -0.926 . . . . 0.0 109.689 -179.916 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 80.8 tt0 -66.78 128.65 37.11 Favored 'General case' 0 N--CA 1.492 1.633 0 O-C-N 121.238 -0.914 . . . . 0.0 109.529 -179.822 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 38.0 p-10 -93.03 119.55 32.4 Favored 'General case' 0 N--CA 1.494 1.767 0 O-C-N 121.225 -0.922 . . . . 0.0 109.965 -179.892 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 83.8 tt0 -98.2 -21.49 16.68 Favored 'General case' 0 N--CA 1.496 1.849 0 O-C-N 121.294 -0.879 . . . . 0.0 108.975 179.426 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 23.5 m -112.19 129.46 67.65 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.97 0 O-C-N 121.657 -0.652 . . . . 0.0 109.441 -179.963 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 39.4 m -145.07 104.45 3.97 Favored 'General case' 0 N--CA 1.494 1.762 0 O-C-N 121.29 -0.881 . . . . 0.0 109.126 179.978 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 97.5 mt-10 -82.7 -2.55 54.47 Favored 'General case' 0 N--CA 1.49 1.555 0 O-C-N 121.282 -0.886 . . . . 0.0 109.016 179.94 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . 56.31 38.62 29.92 Favored 'General case' 0 N--CA 1.49 1.567 0 O-C-N 121.578 -0.701 . . . . 0.0 109.223 -179.948 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 7.2 t -84.78 132.09 34.47 Favored 'General case' 0 N--CA 1.493 1.719 0 O-C-N 121.474 -0.766 . . . . 0.0 109.72 -179.828 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . -178.53 -105.6 0.19 Allowed Glycine 0 N--CA 1.495 2.62 0 N-CA-C 109.234 -1.546 . . . . 0.0 109.234 179.646 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 7.6 t 51.05 -176.24 0.02 OUTLIER 'General case' 0 N--CA 1.498 1.93 0 O-C-N 121.319 -1.106 . . . . 0.0 110.872 179.215 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . 44.2 59.79 3.07 Favored 'General case' 0 N--CA 1.495 1.786 0 O-C-N 121.562 -0.711 . . . . 0.0 109.315 -179.689 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -66.41 147.33 49.79 Favored Glycine 0 N--CA 1.493 2.449 0 N-CA-C 109.713 -1.355 . . . . 0.0 109.713 -179.644 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 49.8 tp10 -67.02 141.57 57.52 Favored 'General case' 0 N--CA 1.494 1.729 0 O-C-N 121.395 -1.062 . . . . 0.0 110.027 -179.657 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 21' ' ' ILE . . . . . . . . . . . . . 96.8 mt -64.12 -43.94 97.53 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.611 0 O-C-N 121.489 -0.757 . . . . 0.0 109.668 179.487 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . -88.17 99.28 2.5 Favored Glycine 0 N--CA 1.495 2.624 0 N-CA-C 110.178 -1.169 . . . . 0.0 110.178 -179.322 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 23' ' ' PHE . . . . . . . . . . . . . 91.2 t80 -173.56 -38.3 0.01 OUTLIER 'General case' 0 N--CA 1.492 1.659 0 O-C-N 121.324 -1.103 . . . . 0.0 108.838 179.246 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 24' ' ' ILE . . . . . 0.513 ' O ' ' N ' ' A' ' 26' ' ' ARG . 20.5 tt -69.37 -37.93 76.37 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.494 0 O-C-N 121.566 -0.709 . . . . 0.0 109.478 179.574 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 25' ' ' ILE . . . . . 0.641 HG22 ' O ' ' A' ' 25' ' ' ILE . 93.5 mt 49.09 11.0 0.04 OUTLIER 'Isoleucine or valine' 0 N--CA 1.495 1.794 0 O-C-N 121.286 -0.884 . . . . 0.0 109.153 -179.331 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 26' ' ' ARG . . . . . 0.513 ' N ' ' O ' ' A' ' 24' ' ' ILE . 99.7 mtt180 50.87 23.72 1.53 Allowed 'General case' 0 N--CA 1.492 1.664 0 O-C-N 121.216 -0.927 . . . . 0.0 109.872 179.455 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 96.8 mt-10 53.71 73.36 0.38 Allowed 'General case' 0 N--CA 1.496 1.834 0 O-C-N 121.466 -0.771 . . . . 0.0 109.776 179.586 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . -55.26 178.43 0.37 Allowed Glycine 0 N--CA 1.494 2.561 0 N-CA-C 110.46 -1.056 . . . . 0.0 110.46 -179.724 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 29' ' ' ASP . . . . . 0.443 ' O ' ' O ' ' A' ' 30' ' ' ASP . 93.5 m-20 -66.48 118.51 10.21 Favored 'General case' 0 N--CA 1.494 1.745 0 O-C-N 121.509 -0.994 . . . . 0.0 110.518 -179.337 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 30' ' ' ASP . . . . . 0.443 ' O ' ' O ' ' A' ' 29' ' ' ASP . 98.1 m-20 51.17 104.29 0.01 OUTLIER 'General case' 0 N--CA 1.493 1.683 0 CA-C-O 121.56 0.695 . . . . 0.0 110.262 179.468 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 31' ' ' VAL . . . . . 0.412 HG11 HH21 ' A' ' 79' ' ' ARG . 9.8 p -128.23 139.24 52.43 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.904 0 N-CA-C 108.717 -0.846 . . . . 0.0 108.717 179.544 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -114.93 153.6 30.26 Favored 'General case' 0 N--CA 1.498 1.958 0 O-C-N 121.633 -0.667 . . . . 0.0 109.353 -179.515 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 33' ' ' GLU . . . . . 0.547 ' N ' ' OE1' ' A' ' 33' ' ' GLU . 55.7 mp0 -103.13 145.56 29.73 Favored 'General case' 0 N--CA 1.495 1.777 0 O-C-N 121.619 -0.676 . . . . 0.0 109.381 -179.438 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 34' ' ' VAL . . . . . . . . . . . . . 46.3 t -126.14 133.75 68.11 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.936 0 N-CA-C 108.85 -0.796 . . . . 0.0 108.85 179.879 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 40.8 t -129.88 131.56 46.1 Favored 'General case' 0 N--CA 1.495 1.806 0 N-CA-C 108.86 -0.793 . . . . 0.0 108.86 179.756 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 44.5 tp -126.01 131.38 52.22 Favored 'General case' 0 N--CA 1.499 2.014 0 O-C-N 121.418 -0.801 . . . . 0.0 108.967 179.717 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 37' ' ' PHE . . . . . . . . . . . . . 93.7 m-85 -115.74 144.99 43.19 Favored 'General case' 0 N--CA 1.497 1.911 0 N-CA-C 109.294 -0.632 . . . . 0.0 109.294 -179.614 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . -174.07 176.94 46.49 Favored Glycine 0 N--CA 1.491 2.301 0 N-CA-C 109.585 -1.406 . . . . 0.0 109.585 179.907 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 34.6 p -61.36 -98.98 0.0 OUTLIER 'General case' 0 C--N 1.301 -1.528 0 O-C-N 121.267 -1.137 . . . . 0.0 110.776 -179.268 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 40' ' ' ASP . . . . . 0.418 ' OD1' ' N ' ' A' ' 41' ' ' LYS . 51.4 t0 -76.84 153.43 34.83 Favored 'General case' 0 N--CA 1.494 1.727 0 CA-C-O 121.71 0.766 . . . . 0.0 110.938 -178.67 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 41' ' ' LYS . . . . . 0.418 ' N ' ' OD1' ' A' ' 40' ' ' ASP . 65.5 tttm -64.97 -35.64 81.84 Favored 'General case' 0 N--CA 1.491 1.597 0 O-C-N 121.614 -0.679 . . . . 0.0 109.978 -179.974 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -55.94 -39.53 71.83 Favored 'General case' 0 N--CA 1.492 1.659 0 O-C-N 121.276 -0.89 . . . . 0.0 109.496 -179.382 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 43' ' ' HIS . . . . . . . . . . . . . 11.7 t-160 -62.97 -38.56 91.6 Favored 'General case' 0 N--CA 1.489 1.494 0 O-C-N 121.307 -0.871 . . . . 0.0 109.127 179.865 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 46.2 mt -61.3 -40.71 95.18 Favored 'General case' 0 N--CA 1.489 1.497 0 O-C-N 121.23 -0.919 . . . . 0.0 109.299 -179.724 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 97.7 mt-10 -62.76 -36.35 82.78 Favored 'General case' 0 N--CA 1.491 1.579 0 O-C-N 121.344 -0.848 . . . . 0.0 109.306 -179.939 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . -60.86 -41.62 99.29 Favored Glycine 0 N--CA 1.492 2.402 0 N-CA-C 109.501 -1.44 . . . . 0.0 109.501 -179.902 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 97.5 mttt -77.37 -25.13 50.65 Favored 'General case' 0 N--CA 1.493 1.702 0 O-C-N 121.118 -1.225 . . . . 0.0 109.687 179.776 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 57.8 tp -61.66 -39.2 90.54 Favored 'General case' 0 N--CA 1.49 1.554 0 O-C-N 121.432 -0.793 . . . . 0.0 109.44 179.975 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 49' ' ' ALA . . . . . . . . . . . . . . . -53.66 -42.2 67.61 Favored 'General case' 0 N--CA 1.491 1.621 0 O-C-N 121.3 -0.875 . . . . 0.0 109.948 -179.315 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 50' ' ' GLU . . . . . 0.476 ' OE1' ' N ' ' A' ' 50' ' ' GLU . 58.2 mp0 -69.96 -42.35 73.31 Favored 'General case' 0 N--CA 1.494 1.742 0 O-C-N 121.236 -0.915 . . . . 0.0 109.84 -179.679 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 51' ' ' TYR . . . . . 0.461 ' CZ ' ' CG2' ' A' ' 95' ' ' THR . 4.3 m-85 -50.85 -49.11 59.63 Favored 'General case' 0 N--CA 1.489 1.516 0 O-C-N 121.138 -0.976 . . . . 0.0 108.779 -179.193 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 52' ' ' ILE . . . . . 0.47 HD13 ' OH ' ' A' ' 64' ' ' TYR . 93.6 mt -65.52 -43.57 94.26 Favored 'Isoleucine or valine' 0 C--N 1.297 -1.675 0 O-C-N 121.57 -0.706 . . . . 0.0 110.066 179.878 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 48.0 t -58.2 -49.51 76.78 Favored 'General case' 0 N--CA 1.493 1.696 0 O-C-N 121.132 -0.98 . . . . 0.0 110.503 -178.583 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 54' ' ' LEU . . . . . 0.654 HD12 ' NZ ' ' A' ' 94' ' ' LYS . 4.3 mm? -64.35 -41.25 96.84 Favored 'General case' 0 N--CA 1.491 1.622 0 O-C-N 121.099 -1.001 . . . . 0.0 109.105 179.554 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -62.78 -36.35 82.82 Favored 'General case' 0 N--CA 1.49 1.527 0 O-C-N 121.382 -0.823 . . . . 0.0 109.531 -179.831 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 56' ' ' LYS . . . . . . . . . . . . . 30.3 mmtm -62.27 -45.56 92.74 Favored 'General case' 0 N--CA 1.492 1.649 0 O-C-N 121.385 -0.822 . . . . 0.0 109.934 -179.963 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 58.5 tt0 -68.87 -41.78 77.92 Favored 'General case' 0 N--CA 1.49 1.554 0 O-C-N 121.242 -0.911 . . . . 0.0 109.625 -179.86 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 58' ' ' VAL . . . . . 0.478 ' CG1' ' OE1' ' A' ' 87' ' ' GLU . 66.8 t -64.09 -45.71 95.77 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.455 0 O-C-N 121.308 -0.87 . . . . 0.0 109.607 179.883 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 59' ' ' TYR . . . . . 0.44 ' O ' ' O ' ' A' ' 60' ' ' ALA . 62.9 t80 -126.89 136.22 52.02 Favored 'General case' 0 N--CA 1.5 2.032 0 O-C-N 121.494 -0.754 . . . . 0.0 109.586 -179.46 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 60' ' ' ALA . . . . . 0.44 ' O ' ' O ' ' A' ' 59' ' ' TYR . . . -48.25 -102.99 0.0 OUTLIER 'General case' 0 N--CA 1.494 1.741 0 O-C-N 121.693 -0.63 . . . . 0.0 110.867 -179.286 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 61' ' ' ASN . . . . . . . . . . . . . 83.2 m-20 -85.51 86.9 7.34 Favored 'General case' 0 N--CA 1.492 1.637 0 O-C-N 121.266 -0.896 . . . . 0.0 109.439 -179.119 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 62' ' ' VAL . . . . . . . . . . . . . 14.7 p -81.72 136.74 22.44 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.585 0 O-C-N 121.333 -0.855 . . . . 0.0 109.687 -179.927 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 96.8 mt-10 -108.45 137.09 46.99 Favored 'General case' 0 N--CA 1.5 2.05 0 O-C-N 121.407 -0.808 . . . . 0.0 108.95 179.842 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 64' ' ' TYR . . . . . 0.47 ' OH ' HD13 ' A' ' 52' ' ' ILE . 48.6 p90 -152.56 164.11 38.27 Favored 'General case' 0 N--CA 1.49 1.565 0 O-C-N 121.226 -0.921 . . . . 0.0 109.511 -179.615 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 79.7 mm-40 -138.81 154.34 48.46 Favored 'General case' 0 N--CA 1.497 1.895 0 N-CA-C 108.756 -0.831 . . . . 0.0 108.756 179.793 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 66' ' ' VAL . . . . . . . . . . . . . 2.7 p -125.75 129.07 72.61 Favored 'Isoleucine or valine' 0 N--CA 1.499 1.989 0 N-CA-C 109.088 -0.708 . . . . 0.0 109.088 -179.735 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -88.03 119.32 70.38 Favored Pre-proline 0 N--CA 1.494 1.76 0 O-C-N 121.378 -0.826 . . . . 0.0 109.014 -179.972 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 68' ' ' PRO . . . . . . . . . . . . . 84.8 Cg_exo -47.74 136.91 21.66 Favored 'Trans proline' 0 N--CA 1.499 1.847 0 C-N-CA 121.824 1.683 . . . . 0.0 112.916 179.687 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 69' ' ' VAL . . . . . . . . . . . . . 3.1 t -133.08 162.19 40.37 Favored 'Isoleucine or valine' 0 N--CA 1.503 2.182 0 O-C-N 121.601 -0.687 . . . . 0.0 109.935 -179.847 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 70' ' ' ALA . . . . . 0.821 ' HB3' ' HB2' ' A' ' 73' ' ' ALA . . . -62.22 145.68 52.9 Favored 'General case' 0 N--CA 1.496 1.844 0 O-C-N 121.378 -0.826 . . . . 0.0 110.087 -179.734 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 90.3 m-20 -70.01 -29.96 67.15 Favored 'General case' 0 N--CA 1.491 1.591 0 O-C-N 121.429 -0.795 . . . . 0.0 109.68 179.502 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 72' ' ' ASN . . . . . . . . . . . . . 98.6 m-20 -94.21 6.07 49.79 Favored 'General case' 0 N--CA 1.491 1.614 0 O-C-N 121.596 -0.69 . . . . 0.0 109.188 -179.882 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 73' ' ' ALA . . . . . 0.821 ' HB2' ' HB3' ' A' ' 70' ' ' ALA . . . -87.92 155.08 20.03 Favored 'General case' 0 N--CA 1.491 1.614 0 N-CA-C 108.644 -0.873 . . . . 0.0 108.644 179.583 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 74' ' ' THR . . . . . 0.634 ' O ' ' OG1' ' A' ' 74' ' ' THR . 0.0 OUTLIER -77.82 16.97 0.61 Allowed 'General case' 0 C--N 1.293 -1.881 0 CA-C-O 117.574 -1.203 . . . . 0.0 112.801 -179.808 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -158.81 165.85 33.29 Favored 'General case' 0 N--CA 1.523 3.179 0 C-N-CA 113.187 -3.405 . . . . 0.0 119.864 -175.045 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 76' ' ' LEU . . . . . 0.489 ' C ' HD23 ' A' ' 76' ' ' LEU . 7.5 tt -139.03 131.7 28.94 Favored 'General case' 0 C--N 1.297 -1.68 0 CA-C-N 109.348 -3.569 . . . . 0.0 104.952 -178.802 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 77' ' ' HIS . . . . . 0.488 ' N ' HD23 ' A' ' 76' ' ' LEU . 82.9 t60 -133.76 135.09 43.69 Favored 'General case' 0 N--CA 1.506 2.332 0 O-C-N 120.476 -1.39 . . . . 0.0 107.411 179.54 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -141.19 167.65 21.67 Favored 'General case' 0 N--CA 1.496 1.845 0 O-C-N 121.223 -0.923 . . . . 0.0 109.558 -178.989 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 79' ' ' ARG . . . . . 0.412 HH21 HG11 ' A' ' 31' ' ' VAL . 84.3 mtp180 -123.31 148.79 45.61 Favored 'General case' 0 N--CA 1.498 1.949 0 N-CA-C 108.625 -0.879 . . . . 0.0 108.625 179.827 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 80' ' ' PHE . . . . . . . . . . . . . 62.6 m-85 -130.06 150.27 51.4 Favored 'General case' 0 N--CA 1.5 2.042 0 N-CA-C 109.131 -0.692 . . . . 0.0 109.131 -179.565 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 35.6 ttpt -106.83 119.51 39.54 Favored 'General case' 0 N--CA 1.496 1.848 0 O-C-N 121.429 -0.794 . . . . 0.0 109.319 -179.975 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 82' ' ' PHE . . . . . . . . . . . . . 56.2 m-85 -128.65 153.23 47.5 Favored 'General case' 0 N--CA 1.501 2.078 0 O-C-N 121.606 -0.684 . . . . 0.0 109.299 -179.982 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 83' ' ' GLU . . . . . 0.431 ' O ' ' OD2' ' A' ' 30' ' ' ASP . 27.2 mm-40 -64.84 -41.96 95.3 Favored 'General case' 0 C--N 1.299 -1.594 0 O-C-N 121.51 -0.744 . . . . 0.0 109.854 -179.13 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 84' ' ' VAL . . . . . . . . . . . . . 2.9 m -136.34 160.78 37.91 Favored 'Isoleucine or valine' 0 N--CA 1.501 2.082 0 O-C-N 121.354 -0.841 . . . . 0.0 110.424 -179.145 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 85' ' ' SER . . . . . 0.522 ' O ' ' N ' ' A' ' 88' ' ' LYS . 11.6 t -63.75 -41.06 98.08 Favored 'General case' 0 N--CA 1.491 1.6 0 O-C-N 121.597 -0.689 . . . . 0.0 110.24 179.553 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 86' ' ' ALA . . . . . . . . . . . . . . . -40.75 -36.19 0.58 Allowed 'General case' 0 N--CA 1.5 2.04 0 O-C-N 121.621 -0.675 . . . . 0.0 110.02 -179.005 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 87' ' ' GLU . . . . . 0.478 ' OE1' ' CG1' ' A' ' 58' ' ' VAL . 70.3 mm-40 -65.71 -37.7 87.15 Favored 'General case' 0 C--N 1.301 -1.5 0 O-C-N 121.353 -0.842 . . . . 0.0 109.077 179.249 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 88' ' ' LYS . . . . . 0.522 ' N ' ' O ' ' A' ' 85' ' ' SER . 28.2 tptp -63.65 -46.38 85.92 Favored 'General case' 0 C--N 1.303 -1.428 0 O-C-N 121.26 -0.9 . . . . 0.0 109.398 179.875 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 89' ' ' LEU . . . . . 0.537 HD12 ' N ' ' A' ' 89' ' ' LEU . 10.8 mp -61.56 -46.95 87.72 Favored 'General case' 0 C--N 1.302 -1.48 0 O-C-N 121.319 -0.863 . . . . 0.0 109.465 -179.301 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 90' ' ' ILE . . . . . . . . . . . . . 96.8 mt -68.18 -44.2 84.37 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.522 0 O-C-N 121.212 -0.93 . . . . 0.0 109.668 179.81 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 91' ' ' PHE . . . . . . . . . . . . . 88.8 t80 -61.39 -46.48 90.01 Favored 'General case' 0 N--CA 1.491 1.599 0 O-C-N 121.395 -0.815 . . . . 0.0 109.54 -179.722 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 92' ' ' GLU . . . . . . . . . . . . . 84.0 tt0 -66.11 -40.02 90.4 Favored 'General case' 0 C--N 1.303 -1.441 0 O-C-N 121.272 -0.893 . . . . 0.0 109.151 179.98 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 93' ' ' LEU . . . . . . . . . . . . . 8.2 tp -62.93 -48.71 77.76 Favored 'General case' 0 N--CA 1.488 1.471 0 O-C-N 121.397 -0.814 . . . . 0.0 109.343 -179.701 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 94' ' ' LYS . . . . . 0.654 ' NZ ' HD12 ' A' ' 54' ' ' LEU . 17.3 ttpp -70.17 -45.36 66.87 Favored 'General case' 0 N--CA 1.491 1.609 0 O-C-N 121.475 -0.766 . . . . 0.0 109.827 179.74 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 95' ' ' THR . . . . . 0.461 ' CG2' ' CZ ' ' A' ' 51' ' ' TYR . 92.2 m -62.11 -44.26 97.04 Favored 'General case' 0 C--N 1.301 -1.523 0 O-C-N 121.558 -0.714 . . . . 0.0 109.419 -179.825 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 96' ' ' ARG . . . . . . . . . . . . . 71.1 ttp85 -57.99 -42.44 85.13 Favored 'General case' 0 N--CA 1.489 1.497 0 O-C-N 121.389 -0.819 . . . . 0.0 109.161 179.803 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 97' ' ' ALA . . . . . 0.469 ' O ' ' N ' ' A' ' 101' ' ' LEU . . . -56.39 -46.29 80.18 Favored 'General case' 0 C--N 1.301 -1.507 0 O-C-N 121.379 -0.826 . . . . 0.0 108.86 179.733 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 98' ' ' LEU . . . . . . . . . . . . . 97.8 mt -63.97 -40.18 95.82 Favored 'General case' 0 N--CA 1.489 1.5 0 O-C-N 121.487 -0.758 . . . . 0.0 109.187 179.518 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 99' ' ' ALA . . . . . . . . . . . . . . . -56.0 -49.73 72.83 Favored 'General case' 0 N--CA 1.491 1.584 0 O-C-N 121.517 -0.739 . . . . 0.0 109.777 -179.452 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 100' ' ' ARG . . . . . . . . . . . . . 25.2 mmt85 -92.36 -59.84 1.98 Allowed 'General case' 0 N--CA 1.494 1.745 0 O-C-N 121.281 -0.887 . . . . 0.0 109.478 -179.887 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 101' ' ' LEU . . . . . 0.469 ' N ' ' O ' ' A' ' 97' ' ' ALA . 54.9 tp -176.98 144.55 0.45 Allowed 'General case' 0 N--CA 1.493 1.72 0 O-C-N 121.575 -0.703 . . . . 0.0 109.49 179.882 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 102' ' ' GLU . . . . . 0.413 ' O ' ' O ' ' A' ' 103' ' ' HIS . 37.9 tp10 -82.46 -115.47 0.02 OUTLIER 'General case' 0 N--CA 1.491 1.594 0 O-C-N 121.409 -0.807 . . . . 0.0 109.44 -179.971 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 103' ' ' HIS . . . . . 0.413 ' O ' ' O ' ' A' ' 102' ' ' GLU . 99.2 m-70 41.16 -163.47 0.01 OUTLIER 'General case' 0 N--CA 1.498 1.94 0 O-C-N 121.447 -0.783 . . . . 0.0 110.636 -179.894 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 104' ' ' HIS . . . . . . . . . . . . . 98.9 m-70 -95.58 138.1 33.72 Favored 'General case' 0 N--CA 1.494 1.758 0 O-C-N 121.425 -0.797 . . . . 0.0 109.625 -179.378 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 105' ' ' HIS . . . . . . . . . . . . . 6.0 p80 -85.85 122.6 30.14 Favored 'General case' 0 N--CA 1.492 1.649 0 O-C-N 121.287 -0.883 . . . . 0.0 109.25 -179.68 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 106' ' ' HIS . . . . . . . . . . . . . 81.8 t60 -125.55 119.37 27.98 Favored 'General case' 0 N--CA 1.501 2.118 0 O-C-N 121.396 -0.815 . . . . 0.0 109.281 179.923 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 107' ' ' HIS . . . . . 0.529 ' O ' ' CG ' ' A' ' 108' ' ' HIS . 74.8 t60 -150.53 142.79 24.21 Favored 'General case' 0 N--CA 1.494 1.76 0 O-C-N 121.02 -1.05 . . . . 0.0 109.342 179.908 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 108' ' ' HIS . . . . . 0.529 ' CG ' ' O ' ' A' ' 107' ' ' HIS . 75.4 m80 . . . . . 0 N--CA 1.49 1.557 0 CA-C-O 118.095 -0.955 . . . . 0.0 109.299 179.79 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 97.0 mmm . . . . . 0 N--CA 1.489 1.495 0 CA-C-O 121.614 0.721 . . . . 0.0 109.432 . . . . . . . . . 0 0 . 1 . 015 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 20.0 m -76.93 -17.15 59.1 Favored 'General case' 0 N--CA 1.489 1.509 0 O-C-N 121.498 -0.751 . . . . 0.0 109.289 -179.641 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 3' ' ' ASN . . . . . . . . . . . . . 93.1 m-20 -63.51 -40.55 97.35 Favored 'General case' 0 N--CA 1.49 1.543 0 O-C-N 121.432 -0.793 . . . . 0.0 109.481 179.906 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 99.4 mm-40 -51.32 -85.11 0.0 OUTLIER 'General case' 0 N--CA 1.489 1.499 0 O-C-N 121.476 -0.765 . . . . 0.0 109.99 -179.471 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 60.4 m 44.28 80.28 0.04 OUTLIER 'General case' 0 N--CA 1.491 1.585 0 O-C-N 121.513 -0.742 . . . . 0.0 109.626 -179.407 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 98.9 m -137.66 148.98 46.19 Favored 'General case' 0 N--CA 1.494 1.73 0 O-C-N 121.535 -0.728 . . . . 0.0 109.706 -179.868 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 7' ' ' VAL . . . . . . . . . . . . . 98.1 t -97.65 134.17 36.76 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.722 0 O-C-N 121.332 -0.855 . . . . 0.0 110.078 -179.325 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 82.1 tt0 -56.37 140.74 44.42 Favored 'General case' 0 N--CA 1.49 1.529 0 CA-C-O 121.757 0.789 . . . . 0.0 110.669 -179.433 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 9' ' ' ASN . . . . . 0.573 ' O ' ' N ' ' A' ' 11' ' ' VAL . 95.2 m-20 43.79 -117.53 0.52 Allowed 'General case' 0 N--CA 1.492 1.664 0 O-C-N 121.677 -0.64 . . . . 0.0 110.361 179.493 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 10' ' ' GLU . . . . . 0.482 ' HG3' ' H ' ' A' ' 12' ' ' CYS . 33.1 tp10 59.58 -73.03 0.03 OUTLIER 'General case' 0 N--CA 1.492 1.635 0 CA-C-O 121.324 0.583 . . . . 0.0 109.491 -179.603 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 11' ' ' VAL . . . . . 0.573 ' N ' ' O ' ' A' ' 9' ' ' ASN . 2.0 t 52.11 9.47 0.04 OUTLIER 'Isoleucine or valine' 0 N--CA 1.49 1.565 0 O-C-N 121.605 -0.684 . . . . 0.0 109.182 -179.226 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 12' ' ' CYS . . . . . 0.482 ' H ' ' HG3' ' A' ' 10' ' ' GLU . 50.5 t 39.32 91.46 0.01 OUTLIER 'General case' 0 N--CA 1.493 1.715 0 CA-C-O 121.715 0.769 . . . . 0.0 110.495 -179.908 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 79.1 mm-40 55.11 79.56 0.15 Allowed 'General case' 0 N--CA 1.491 1.61 0 CA-C-O 121.658 0.742 . . . . 0.0 109.677 -179.873 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -66.91 138.66 57.46 Favored 'General case' 0 N--CA 1.489 1.487 0 CA-C-O 121.552 0.691 . . . . 0.0 110.25 -179.47 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 15' ' ' CYS . . . . . 0.456 ' O ' ' N ' ' A' ' 17' ' ' CYS . 10.5 t -145.0 135.83 24.63 Favored 'General case' 0 N--CA 1.49 1.536 0 O-C-N 121.414 -0.804 . . . . 0.0 109.483 179.389 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 48.18 -94.33 0.01 OUTLIER Glycine 0 N--CA 1.49 2.246 0 N-CA-C 110.18 -1.168 . . . . 0.0 110.18 179.329 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 17' ' ' CYS . . . . . 0.456 ' N ' ' O ' ' A' ' 15' ' ' CYS . 8.9 t 63.9 122.21 0.02 OUTLIER 'General case' 0 N--CA 1.49 1.544 0 O-C-N 121.732 -0.863 . . . . 0.0 110.315 -179.534 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -82.44 -5.75 58.87 Favored 'General case' 0 N--CA 1.488 1.468 0 N-CA-C 108.99 -0.744 . . . . 0.0 108.99 179.728 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 90.44 174.73 44.74 Favored Glycine 0 N--CA 1.492 2.408 0 N-CA-C 110.707 -0.957 . . . . 0.0 110.707 179.033 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 80.1 mm-40 -54.54 -79.94 0.02 OUTLIER 'General case' 0 N--CA 1.49 1.534 0 O-C-N 121.73 -0.865 . . . . 0.0 110.083 -179.794 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 21' ' ' ILE . . . . . . . . . . . . . 87.3 mt -102.98 129.28 54.94 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.81 0 O-C-N 121.488 -0.757 . . . . 0.0 110.433 -178.914 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . -80.89 96.7 1.71 Allowed Glycine 0 N--CA 1.487 2.09 0 N-CA-C 109.837 -1.305 . . . . 0.0 109.837 -179.986 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 23' ' ' PHE . . . . . . . . . . . . . 86.9 t80 -101.73 -3.5 28.05 Favored 'General case' 0 N--CA 1.492 1.657 0 O-C-N 121.544 -0.974 . . . . 0.0 108.42 179.227 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 40.7 pt -81.31 -15.71 12.4 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.523 0 N-CA-C 109.103 -0.703 . . . . 0.0 109.103 179.86 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 25' ' ' ILE . . . . . . . . . . . . . 96.1 mt -61.66 88.52 0.04 OUTLIER 'Isoleucine or valine' 0 C--N 1.303 -1.423 0 C-N-CA 119.943 -0.703 . . . . 0.0 110.064 -178.526 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 61.3 ttp180 -111.11 -95.1 0.43 Allowed 'General case' 0 N--CA 1.49 1.536 0 O-C-N 121.678 -0.639 . . . . 0.0 109.39 179.678 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 27' ' ' GLU . . . . . 0.425 ' H ' ' HG3' ' A' ' 27' ' ' GLU . 3.1 pp20? -89.85 148.36 23.23 Favored 'General case' 0 N--CA 1.488 1.458 0 O-C-N 121.481 -0.762 . . . . 0.0 110.563 -179.041 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . 168.33 144.59 4.24 Favored Glycine 0 N--CA 1.486 1.971 0 N-CA-C 109.985 -1.246 . . . . 0.0 109.985 179.198 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 90.5 m-20 -68.99 -17.2 63.89 Favored 'General case' 0 N--CA 1.489 1.493 0 O-C-N 121.554 -0.968 . . . . 0.0 108.998 179.444 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 30' ' ' ASP . . . . . 0.533 ' OD2' ' NZ ' ' A' ' 81' ' ' LYS . 25.9 p-10 -93.75 11.67 28.32 Favored 'General case' 0 N--CA 1.492 1.658 0 O-C-N 121.584 -0.698 . . . . 0.0 109.373 -179.853 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 53.1 t -116.7 135.28 57.54 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.845 0 CA-C-O 121.499 0.666 . . . . 0.0 109.647 -179.381 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -109.01 156.21 20.01 Favored 'General case' 0 N--CA 1.492 1.637 0 N-CA-C 109.191 -0.67 . . . . 0.0 109.191 179.92 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 99.4 mt-10 -107.1 128.15 54.13 Favored 'General case' 0 N--CA 1.496 1.825 0 O-C-N 121.551 -0.718 . . . . 0.0 110.113 -179.111 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 34' ' ' VAL . . . . . . . . . . . . . 53.2 t -123.45 135.17 64.17 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.693 0 O-C-N 121.618 -0.677 . . . . 0.0 109.343 -179.864 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 28.1 p -132.33 142.35 49.31 Favored 'General case' 0 N--CA 1.495 1.781 0 O-C-N 121.518 -0.739 . . . . 0.0 109.273 179.608 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 36' ' ' LEU . . . . . 0.457 HD21 ' CE2' ' A' ' 51' ' ' TYR . 85.6 mt -125.43 148.9 48.63 Favored 'General case' 0 N--CA 1.496 1.854 0 O-C-N 121.651 -0.656 . . . . 0.0 109.283 179.854 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 37' ' ' PHE . . . . . . . . . . . . . 91.9 m-85 -127.07 144.94 50.9 Favored 'General case' 0 N--CA 1.493 1.686 0 O-C-N 121.757 -0.59 . . . . 0.0 109.588 -179.746 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . 164.86 -156.14 27.93 Favored Glycine 0 N--CA 1.485 1.913 0 N-CA-C 109.926 -1.27 . . . . 0.0 109.926 179.92 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 9.8 m -80.4 -141.53 0.04 OUTLIER 'General case' 0 N--CA 1.49 1.546 0 O-C-N 121.547 -0.972 . . . . 0.0 110.655 -179.325 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 40' ' ' ASP . . . . . 0.407 ' CG ' ' H ' ' A' ' 41' ' ' LYS . 44.9 t0 -54.31 179.0 0.02 OUTLIER 'General case' 0 N--CA 1.488 1.471 0 CA-C-O 121.773 0.797 . . . . 0.0 110.59 -179.008 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 41' ' ' LYS . . . . . 0.407 ' H ' ' CG ' ' A' ' 40' ' ' ASP . 26.9 ttmt -61.28 -39.84 91.91 Favored 'General case' 0 N--CA 1.49 1.566 0 O-C-N 121.702 -0.624 . . . . 0.0 110.378 -179.394 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -47.08 -49.78 21.09 Favored 'General case' 0 N--CA 1.494 1.76 0 O-C-N 121.248 -0.908 . . . . 0.0 110.289 -178.788 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 43' ' ' HIS . . . . . . . . . . . . . 6.0 t60 -61.64 -41.98 98.26 Favored 'General case' 0 N--CA 1.49 1.573 0 O-C-N 121.346 -0.846 . . . . 0.0 109.564 -179.353 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 54.8 mt -63.96 -39.03 93.21 Favored 'General case' 0 N--CA 1.49 1.554 0 O-C-N 121.415 -0.803 . . . . 0.0 109.623 -179.861 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 96.6 mt-10 -58.22 -41.23 83.6 Favored 'General case' 0 N--CA 1.489 1.488 0 O-C-N 121.319 -0.863 . . . . 0.0 109.428 -179.743 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . -62.43 -43.41 99.08 Favored Glycine 0 N--CA 1.489 2.189 0 N-CA-C 109.244 -1.542 . . . . 0.0 109.244 179.972 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 68.6 mttm -65.28 -39.82 93.09 Favored 'General case' 0 N--CA 1.489 1.506 0 O-C-N 121.364 -1.08 . . . . 0.0 109.285 179.466 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 53.5 tp -62.02 -40.37 95.47 Favored 'General case' 0 N--CA 1.489 1.519 0 O-C-N 121.477 -0.764 . . . . 0.0 109.604 -179.545 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 49' ' ' ALA . . . . . . . . . . . . . . . -57.25 -40.84 78.45 Favored 'General case' 0 N--CA 1.49 1.535 0 O-C-N 121.346 -0.846 . . . . 0.0 109.505 -179.156 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 75.4 mt-10 -68.64 -37.41 79.68 Favored 'General case' 0 N--CA 1.489 1.505 0 O-C-N 121.515 -0.741 . . . . 0.0 109.443 179.828 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 51' ' ' TYR . . . . . 0.457 ' CE2' HD21 ' A' ' 36' ' ' LEU . 3.7 m-85 -61.78 -43.69 98.35 Favored 'General case' 0 N--CA 1.491 1.587 0 O-C-N 121.656 -0.652 . . . . 0.0 109.533 -179.34 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 52' ' ' ILE . . . . . . . . . . . . . 93.3 mt -63.71 -42.96 97.77 Favored 'Isoleucine or valine' 0 C--N 1.302 -1.46 0 N-CA-C 108.892 -0.781 . . . . 0.0 108.892 -179.904 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 25.2 m -49.75 -55.31 14.47 Favored 'General case' 0 N--CA 1.49 1.552 0 O-C-N 121.368 -0.832 . . . . 0.0 109.747 -179.529 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 54' ' ' LEU . . . . . 0.483 HD22 ' N ' ' A' ' 54' ' ' LEU . 4.0 mm? -65.17 -38.48 90.67 Favored 'General case' 0 N--CA 1.489 1.512 0 O-C-N 121.438 -0.789 . . . . 0.0 109.101 179.725 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -55.78 -46.82 77.88 Favored 'General case' 0 N--CA 1.488 1.429 0 O-C-N 121.487 -0.758 . . . . 0.0 109.391 -179.517 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 56' ' ' LYS . . . . . . . . . . . . . 66.0 mttm -63.65 -41.3 98.23 Favored 'General case' 0 C--N 1.303 -1.455 0 O-C-N 121.575 -0.703 . . . . 0.0 109.816 179.922 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 98.8 mm-40 -63.12 -47.21 83.75 Favored 'General case' 0 N--CA 1.487 1.417 0 O-C-N 121.448 -0.783 . . . . 0.0 109.607 -179.618 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 58' ' ' VAL . . . . . . . . . . . . . 75.1 t -66.13 -45.16 91.04 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.452 0 O-C-N 121.363 -0.836 . . . . 0.0 109.801 -179.916 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 59' ' ' TYR . . . . . . . . . . . . . 83.4 t80 -140.64 119.83 12.9 Favored 'General case' 0 N--CA 1.496 1.85 0 O-C-N 121.381 -0.825 . . . . 0.0 109.924 -179.528 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -71.66 154.66 41.23 Favored 'General case' 0 N--CA 1.491 1.608 0 O-C-N 121.629 -0.669 . . . . 0.0 110.939 -179.679 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 61' ' ' ASN . . . . . . . . . . . . . 10.4 m120 60.23 35.96 20.89 Favored 'General case' 0 N--CA 1.493 1.68 0 CA-C-O 121.465 0.65 . . . . 0.0 109.286 179.828 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 62' ' ' VAL . . . . . . . . . . . . . 12.4 p -71.89 137.88 22.73 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.491 0 O-C-N 121.548 -0.72 . . . . 0.0 109.912 -179.995 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 84.5 tt0 -113.01 146.04 39.8 Favored 'General case' 0 N--CA 1.492 1.675 0 CA-C-O 121.488 0.661 . . . . 0.0 109.397 -179.768 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 64' ' ' TYR . . . . . . . . . . . . . 53.3 p90 -150.89 162.94 39.82 Favored 'General case' 0 N--CA 1.487 1.413 0 O-C-N 121.295 -0.878 . . . . 0.0 110.047 179.964 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 65' ' ' GLU . . . . . 0.485 ' CD ' ' N ' ' A' ' 66' ' ' VAL . 9.6 tm-20 -142.6 148.8 38.08 Favored 'General case' 0 N--CA 1.489 1.523 0 N-CA-C 108.949 -0.76 . . . . 0.0 108.949 179.5 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 66' ' ' VAL . . . . . 0.485 ' N ' ' CD ' ' A' ' 65' ' ' GLU . 54.5 t -116.41 131.0 70.27 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.55 0 CA-C-O 121.741 0.782 . . . . 0.0 109.846 -179.652 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -84.76 156.65 61.33 Favored Pre-proline 0 C--N 1.306 -1.294 0 N-CA-C 108.811 -0.811 . . . . 0.0 108.811 179.526 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 68' ' ' PRO . . . . . . . . . . . . . 96.6 Cg_exo -43.03 138.72 3.94 Favored 'Trans proline' 0 N--CA 1.493 1.484 0 C-N-CA 122.588 2.192 . . . . 0.0 112.801 179.626 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 69' ' ' VAL . . . . . 0.496 ' C ' ' H ' ' A' ' 71' ' ' ASP . 67.2 t -124.42 134.06 67.71 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.735 0 CA-C-O 121.569 0.699 . . . . 0.0 109.828 -179.448 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 70' ' ' ALA . . . . . 0.655 ' O ' ' N ' ' A' ' 72' ' ' ASN . . . -73.2 35.89 0.08 Allowed 'General case' 0 N--CA 1.487 1.408 0 O-C-N 121.606 -0.684 . . . . 0.0 109.556 179.828 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 71' ' ' ASP . . . . . 0.496 ' H ' ' C ' ' A' ' 69' ' ' VAL . 97.9 m-20 53.39 -73.45 0.01 OUTLIER 'General case' 0 N--CA 1.496 1.827 0 CA-C-O 121.59 0.709 . . . . 0.0 110.059 179.76 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 72' ' ' ASN . . . . . 0.655 ' N ' ' O ' ' A' ' 70' ' ' ALA . 51.7 t30 -86.96 18.41 3.56 Favored 'General case' 0 C--N 1.299 -1.618 0 N-CA-C 108.136 -1.061 . . . . 0.0 108.136 179.492 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 73' ' ' ALA . . . . . 0.518 ' C ' ' H ' ' A' ' 75' ' ' GLU . . . -52.78 -6.96 0.06 Allowed 'General case' 0 N--CA 1.492 1.673 0 N-CA-C 109.274 -0.639 . . . . 0.0 109.274 -179.986 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 74' ' ' THR . . . . . 0.544 HG23 ' O ' ' A' ' 72' ' ' ASN . 6.1 p 61.96 -4.65 0.18 Allowed 'General case' 0 N--CA 1.492 1.674 0 O-C-N 121.625 -0.672 . . . . 0.0 109.624 -179.866 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 75' ' ' GLU . . . . . 0.518 ' H ' ' C ' ' A' ' 73' ' ' ALA . 22.4 pt-20 -149.08 150.44 32.76 Favored 'General case' 0 N--CA 1.49 1.534 0 O-C-N 121.161 -0.962 . . . . 0.0 109.41 179.404 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 6.2 tt -122.72 129.44 51.78 Favored 'General case' 0 N--CA 1.493 1.704 0 CA-C-O 121.566 0.698 . . . . 0.0 109.49 179.647 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 77' ' ' HIS . . . . . . . . . . . . . 97.7 m-70 -97.87 130.7 44.75 Favored 'General case' 0 N--CA 1.488 1.462 0 O-C-N 121.562 -0.711 . . . . 0.0 109.651 -179.658 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -146.64 153.88 40.82 Favored 'General case' 0 N--CA 1.489 1.498 0 O-C-N 121.37 -0.831 . . . . 0.0 109.582 179.939 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 99.6 mtt180 -129.78 148.02 51.61 Favored 'General case' 0 N--CA 1.491 1.582 0 N-CA-C 109.249 -0.648 . . . . 0.0 109.249 -179.949 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 80' ' ' PHE . . . . . . . . . . . . . 30.1 m-85 -126.12 149.92 48.6 Favored 'General case' 0 N--CA 1.493 1.722 0 O-C-N 121.629 -0.669 . . . . 0.0 109.419 -179.777 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 81' ' ' LYS . . . . . 0.533 ' NZ ' ' OD2' ' A' ' 30' ' ' ASP . 63.9 tttp -105.93 124.04 48.94 Favored 'General case' 0 N--CA 1.491 1.58 0 O-C-N 121.548 -0.72 . . . . 0.0 109.323 -179.969 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 82' ' ' PHE . . . . . 0.405 ' CD1' ' OE2' ' A' ' 87' ' ' GLU . 62.2 m-85 -124.95 144.52 50.31 Favored 'General case' 0 N--CA 1.493 1.675 0 CA-C-O 121.594 0.711 . . . . 0.0 109.56 -179.876 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 83.9 tt0 -67.03 -29.22 68.98 Favored 'General case' 0 N--CA 1.488 1.429 0 O-C-N 121.61 -0.681 . . . . 0.0 109.8 -179.627 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 84' ' ' VAL . . . . . 0.435 HG23 ' H ' ' A' ' 87' ' ' GLU . 35.0 m -131.51 150.37 34.08 Favored 'Isoleucine or valine' 0 N--CA 1.499 2.015 0 CA-C-O 121.832 0.825 . . . . 0.0 110.37 -179.483 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 36.9 m -72.6 -32.29 65.85 Favored 'General case' 0 N--CA 1.49 1.528 0 CA-C-O 121.451 0.643 . . . . 0.0 109.586 179.939 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 86' ' ' ALA . . . . . . . . . . . . . . . -54.36 -34.98 62.27 Favored 'General case' 0 N--CA 1.489 1.514 0 O-C-N 121.299 -0.875 . . . . 0.0 108.79 -179.669 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 87' ' ' GLU . . . . . 0.435 ' H ' HG23 ' A' ' 84' ' ' VAL . 80.4 tt0 -65.33 -32.17 73.69 Favored 'General case' 0 C--N 1.303 -1.437 0 N-CA-C 109.096 -0.705 . . . . 0.0 109.096 179.765 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 88' ' ' LYS . . . . . . . . . . . . . 88.8 tttt -63.2 -44.33 95.67 Favored 'General case' 0 N--CA 1.49 1.551 0 O-C-N 121.373 -0.829 . . . . 0.0 109.39 179.975 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 93.9 mt -62.05 -49.27 76.67 Favored 'General case' 0 N--CA 1.491 1.607 0 O-C-N 121.39 -0.818 . . . . 0.0 110.145 -179.217 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 90' ' ' ILE . . . . . 0.535 ' N ' HD12 ' A' ' 90' ' ' ILE . 1.4 mp -70.32 -42.11 78.65 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.582 0 O-C-N 121.366 -0.834 . . . . 0.0 109.403 -179.971 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 91' ' ' PHE . . . . . . . . . . . . . 70.3 t80 -57.45 -45.85 84.27 Favored 'General case' 0 C--N 1.303 -1.445 0 O-C-N 121.406 -0.809 . . . . 0.0 108.886 -179.137 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 92' ' ' GLU . . . . . . . . . . . . . 98.1 mt-10 -68.23 -33.58 74.66 Favored 'General case' 0 C--N 1.301 -1.506 0 N-CA-C 109.116 -0.698 . . . . 0.0 109.116 179.263 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 93' ' ' LEU . . . . . . . . . . . . . 59.0 tp -62.82 -43.19 99.46 Favored 'General case' 0 N--CA 1.488 1.459 0 O-C-N 121.496 -0.753 . . . . 0.0 109.401 -179.736 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 94' ' ' LYS . . . . . . . . . . . . . 67.2 mmtt -65.25 -42.5 93.27 Favored 'General case' 0 N--CA 1.487 1.407 0 O-C-N 121.468 -0.77 . . . . 0.0 109.735 -179.581 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 18.0 p -66.11 -43.06 88.28 Favored 'General case' 0 N--CA 1.488 1.454 0 O-C-N 121.253 -0.904 . . . . 0.0 109.497 -179.732 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 96' ' ' ARG . . . . . . . . . . . . . 17.3 tpp180 -62.61 -44.76 95.49 Favored 'General case' 0 N--CA 1.487 1.388 0 O-C-N 121.305 -0.872 . . . . 0.0 109.396 -179.81 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 97' ' ' ALA . . . . . . . . . . . . . . . -62.81 -40.05 96.18 Favored 'General case' 0 N--CA 1.488 1.434 0 N-CA-C 108.778 -0.823 . . . . 0.0 108.778 -179.835 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 98' ' ' LEU . . . . . . . . . . . . . 6.5 tt -63.6 -43.39 97.06 Favored 'General case' 0 C--N 1.301 -1.535 0 CA-C-O 121.683 0.754 . . . . 0.0 109.027 179.558 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 99' ' ' ALA . . . . . . . . . . . . . . . -66.31 -36.17 82.25 Favored 'General case' 0 N--CA 1.489 1.511 0 O-C-N 121.775 -0.578 . . . . 0.0 109.594 -179.793 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 100' ' ' ARG . . . . . 0.541 ' O ' ' N ' ' A' ' 102' ' ' GLU . 99.8 mtt180 -78.3 -8.81 58.84 Favored 'General case' 0 N--CA 1.486 1.373 0 O-C-N 121.536 -0.728 . . . . 0.0 109.18 -179.626 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 101' ' ' LEU . . . . . . . . . . . . . 88.8 mt 42.55 -90.13 0.01 OUTLIER 'General case' 0 N--CA 1.492 1.656 0 CA-C-O 121.512 0.672 . . . . 0.0 110.589 179.625 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 102' ' ' GLU . . . . . 0.541 ' N ' ' O ' ' A' ' 100' ' ' ARG . 79.8 mm-40 -53.49 142.91 20.88 Favored 'General case' 0 N--CA 1.487 1.385 0 CA-C-O 121.837 0.827 . . . . 0.0 110.657 -178.698 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 103' ' ' HIS . . . . . . . . . . . . . 99.1 m-70 -76.09 145.29 40.16 Favored 'General case' 0 N--CA 1.487 1.395 0 CA-C-O 121.57 0.7 . . . . 0.0 110.777 -179.248 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 104' ' ' HIS . . . . . . . . . . . . . 77.3 m-70 60.99 85.17 0.12 Allowed 'General case' 0 N--CA 1.49 1.569 0 CA-C-O 121.527 0.679 . . . . 0.0 110.0 179.559 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 105' ' ' HIS . . . . . . . . . . . . . 71.6 t60 -74.23 -7.8 53.99 Favored 'General case' 0 N--CA 1.487 1.423 0 N-CA-C 108.899 -0.778 . . . . 0.0 108.899 179.553 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 106' ' ' HIS . . . . . . . . . . . . . 94.9 m-70 -71.87 136.35 46.92 Favored 'General case' 0 N--CA 1.487 1.424 0 O-C-N 121.495 -0.753 . . . . 0.0 109.973 -179.451 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 107' ' ' HIS . . . . . 0.484 ' O ' ' ND1' ' A' ' 108' ' ' HIS . 78.8 m80 -86.77 122.32 30.5 Favored 'General case' 0 N--CA 1.488 1.472 0 O-C-N 121.555 -0.716 . . . . 0.0 109.938 -179.613 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 108' ' ' HIS . . . . . 0.484 ' ND1' ' O ' ' A' ' 107' ' ' HIS . 61.3 m80 . . . . . 0 N--CA 1.487 1.412 0 CA-C-O 118.008 -0.996 . . . . 0.0 108.895 179.755 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . 0.539 ' O ' ' N ' ' A' ' 3' ' ' ASN . 2.6 mpt? . . . . . 0 N--CA 1.491 1.62 0 N-CA-C 109.772 -0.455 . . . . 0.0 109.772 . . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . 0.425 ' C ' ' O ' ' A' ' 1' ' ' MET . 30.5 t 35.19 -88.75 0.01 OUTLIER 'General case' 0 N--CA 1.501 2.092 0 CA-C-O 121.157 0.503 . . . . 0.0 110.849 -179.7 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 3' ' ' ASN . . . . . 0.539 ' N ' ' O ' ' A' ' 1' ' ' MET . 37.5 t30 41.95 -110.92 0.14 Allowed 'General case' 0 N--CA 1.492 1.637 0 O-C-N 121.48 -0.762 . . . . 0.0 110.56 179.953 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 4' ' ' GLN . . . . . 0.455 ' N ' ' CG ' ' A' ' 3' ' ' ASN . 95.3 mt-30 -82.35 -88.56 0.09 Allowed 'General case' 0 N--CA 1.488 1.429 0 O-C-N 121.391 -0.818 . . . . 0.0 110.191 -179.263 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 31.3 m -65.28 133.65 51.91 Favored 'General case' 0 N--CA 1.49 1.555 0 O-C-N 121.336 -0.852 . . . . 0.0 110.641 -178.835 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 13.1 p -148.05 43.09 1.05 Allowed 'General case' 0 N--CA 1.488 1.474 0 N-CA-C 108.706 -0.849 . . . . 0.0 108.706 179.331 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 7' ' ' VAL . . . . . . . . . . . . . 53.9 t -107.64 129.88 60.88 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.941 0 O-C-N 121.544 -0.722 . . . . 0.0 109.142 -179.937 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 8' ' ' GLU . . . . . 0.471 ' O ' ' CB ' ' A' ' 9' ' ' ASN . 18.9 pt-20 -173.61 139.0 0.7 Allowed 'General case' 0 N--CA 1.487 1.414 0 N-CA-C 108.723 -0.843 . . . . 0.0 108.723 179.597 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 9' ' ' ASN . . . . . 0.471 ' CB ' ' O ' ' A' ' 8' ' ' GLU . 33.3 t30 77.7 -45.52 0.44 Allowed 'General case' 0 N--CA 1.494 1.772 0 N-CA-C 109.144 -0.687 . . . . 0.0 109.144 -179.377 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 10' ' ' GLU . . . . . 0.539 ' O ' ' N ' ' A' ' 12' ' ' CYS . 17.0 mp0 -72.34 147.9 45.85 Favored 'General case' 0 C--N 1.303 -1.42 0 O-C-N 121.361 -0.837 . . . . 0.0 110.307 -179.208 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 12.8 t 60.54 -68.94 0.09 OUTLIER 'Isoleucine or valine' 0 N--CA 1.494 1.771 0 CA-C-O 121.186 0.517 . . . . 0.0 109.947 -179.979 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 12' ' ' CYS . . . . . 0.539 ' N ' ' O ' ' A' ' 10' ' ' GLU . 12.8 t -68.75 136.08 52.26 Favored 'General case' 0 N--CA 1.489 1.511 0 O-C-N 121.111 -0.993 . . . . 0.0 110.36 -179.296 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 96.3 mt-10 -52.85 142.46 19.09 Favored 'General case' 0 N--CA 1.496 1.863 0 CA-C-O 121.584 0.706 . . . . 0.0 111.439 -179.169 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 14' ' ' ALA . . . . . 0.44 ' HB2' ' OD1' ' A' ' 9' ' ' ASN . . . -86.24 -74.01 0.43 Allowed 'General case' 0 N--CA 1.491 1.592 0 O-C-N 121.751 -0.593 . . . . 0.0 109.55 179.456 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 74.2 m -82.55 145.71 29.6 Favored 'General case' 0 N--CA 1.491 1.619 0 O-C-N 121.224 -0.923 . . . . 0.0 110.482 -179.068 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . -63.44 167.86 22.85 Favored Glycine 0 N--CA 1.491 2.342 0 N-CA-C 111.197 -0.761 . . . . 0.0 111.197 -179.107 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 38.4 t -72.52 135.9 45.76 Favored 'General case' 0 N--CA 1.489 1.499 0 O-C-N 121.666 -0.902 . . . . 0.0 110.348 -179.59 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -65.66 145.69 55.72 Favored 'General case' 0 N--CA 1.491 1.622 0 CA-C-O 121.541 0.686 . . . . 0.0 111.067 -179.218 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 83.36 19.37 62.47 Favored Glycine 0 N--CA 1.491 2.336 0 N-CA-C 109.193 -1.563 . . . . 0.0 109.193 179.797 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 20' ' ' GLU . . . . . 0.413 ' HG3' ' H ' ' A' ' 22' ' ' GLY . 50.8 tp10 -68.51 125.06 25.29 Favored 'General case' 0 N--CA 1.488 1.429 0 O-C-N 121.282 -1.128 . . . . 0.0 110.217 -179.211 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 21' ' ' ILE . . . . . . . . . . . . . 33.4 pt -96.14 -7.56 9.6 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.64 0 O-C-N 121.63 -0.669 . . . . 0.0 109.345 179.324 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 22' ' ' GLY . . . . . 0.413 ' H ' ' HG3' ' A' ' 20' ' ' GLU . . . 118.08 164.52 13.13 Favored Glycine 0 N--CA 1.499 2.882 0 N-CA-C 109.936 -1.266 . . . . 0.0 109.936 179.541 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 23' ' ' PHE . . . . . . . . . . . . . 77.1 t80 -113.35 136.08 53.15 Favored 'General case' 0 N--CA 1.497 1.888 0 O-C-N 121.772 -0.84 . . . . 0.0 109.841 -179.824 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 4.0 pt -78.44 151.43 5.21 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.492 0 CA-C-O 121.687 0.756 . . . . 0.0 110.617 -179.522 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 25' ' ' ILE . . . . . . . . . . . . . 96.7 mt 56.91 93.79 0.04 OUTLIER 'Isoleucine or valine' 0 N--CA 1.488 1.461 0 CA-C-O 121.452 0.644 . . . . 0.0 110.169 179.659 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 22.2 mmm180 -77.16 153.25 34.36 Favored 'General case' 0 N--CA 1.489 1.522 0 CA-C-O 121.644 0.735 . . . . 0.0 109.933 -179.683 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 60.0 mp0 -61.54 142.57 56.98 Favored 'General case' 0 N--CA 1.49 1.539 0 O-C-N 121.397 -0.814 . . . . 0.0 110.547 -178.981 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . -176.79 -170.25 39.07 Favored Glycine 0 N--CA 1.489 2.23 0 N-CA-C 110.05 -1.22 . . . . 0.0 110.05 179.837 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 29' ' ' ASP . . . . . 0.544 ' OD1' ' N ' ' A' ' 30' ' ' ASP . 49.6 p-10 -67.51 -31.4 71.49 Favored 'General case' 0 N--CA 1.494 1.765 0 O-C-N 121.454 -1.027 . . . . 0.0 110.315 -179.64 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 30' ' ' ASP . . . . . 0.544 ' N ' ' OD1' ' A' ' 29' ' ' ASP . 90.7 m-20 -82.14 2.59 30.72 Favored 'General case' 0 C--N 1.302 -1.46 0 O-C-N 121.019 -1.05 . . . . 0.0 109.651 -179.401 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 51.1 t -119.92 133.85 65.33 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.958 0 O-C-N 121.616 -0.678 . . . . 0.0 109.29 -179.828 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -126.65 149.45 49.51 Favored 'General case' 0 N--CA 1.494 1.766 0 CA-C-O 121.505 0.669 . . . . 0.0 109.603 -179.646 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 17.3 pt-20 -91.54 140.14 30.03 Favored 'General case' 0 N--CA 1.49 1.548 0 O-C-N 121.565 -0.709 . . . . 0.0 109.929 -179.577 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 34' ' ' VAL . . . . . 0.46 HG21 ' CD1' ' A' ' 80' ' ' PHE . 48.4 t -130.16 135.42 60.91 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.793 0 N-CA-C 108.566 -0.901 . . . . 0.0 108.566 179.293 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 44.8 t -134.96 142.71 46.55 Favored 'General case' 0 N--CA 1.493 1.709 0 N-CA-C 109.196 -0.668 . . . . 0.0 109.196 179.877 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 36' ' ' LEU . . . . . 0.53 HD21 ' CE2' ' A' ' 51' ' ' TYR . 76.7 mt -119.72 156.75 29.93 Favored 'General case' 0 N--CA 1.498 1.963 0 N-CA-C 109.256 -0.646 . . . . 0.0 109.256 -179.743 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 37' ' ' PHE . . . . . . . . . . . . . 92.4 m-85 -119.48 138.82 52.9 Favored 'General case' 0 N--CA 1.494 1.772 0 N-CA-C 109.445 -0.576 . . . . 0.0 109.445 -179.582 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 38' ' ' GLY . . . . . 0.52 ' N ' HD21 ' A' ' 44' ' ' LEU . . . -178.14 -175.62 45.43 Favored Glycine 0 N--CA 1.486 2.028 0 N-CA-C 109.781 -1.328 . . . . 0.0 109.781 -179.908 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 39' ' ' SER . . . . . 0.514 ' OG ' ' N ' ' A' ' 40' ' ' ASP . 93.7 p -98.93 -77.39 0.52 Allowed 'General case' 0 N--CA 1.494 1.739 0 O-C-N 121.643 -0.916 . . . . 0.0 109.637 179.89 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 40' ' ' ASP . . . . . 0.543 ' OD1' ' N ' ' A' ' 41' ' ' LYS . 58.3 t0 -80.59 156.44 26.43 Favored 'General case' 0 N--CA 1.49 1.558 0 O-C-N 121.322 -0.861 . . . . 0.0 110.015 -179.169 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 41' ' ' LYS . . . . . 0.543 ' N ' ' OD1' ' A' ' 40' ' ' ASP . 4.5 tmtt? -62.26 -42.13 99.06 Favored 'General case' 0 N--CA 1.488 1.44 0 O-C-N 121.316 -0.865 . . . . 0.0 109.757 -179.306 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -55.7 -41.19 73.42 Favored 'General case' 0 N--CA 1.492 1.628 0 O-C-N 120.984 -1.072 . . . . 0.0 110.291 -179.038 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 43' ' ' HIS . . . . . . . . . . . . . 82.0 t60 -61.24 -42.39 98.53 Favored 'General case' 0 C--N 1.301 -1.536 0 O-C-N 121.135 -0.978 . . . . 0.0 109.537 -179.78 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 44' ' ' LEU . . . . . 0.52 HD21 ' N ' ' A' ' 38' ' ' GLY . 84.0 mt -63.4 -40.06 96.19 Favored 'General case' 0 N--CA 1.49 1.534 0 O-C-N 121.346 -0.846 . . . . 0.0 109.838 -179.775 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 96.5 mt-10 -60.83 -37.22 81.29 Favored 'General case' 0 C--N 1.301 -1.516 0 O-C-N 121.197 -0.94 . . . . 0.0 109.139 179.874 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . -62.16 -42.87 99.73 Favored Glycine 0 N--CA 1.489 2.202 0 N-CA-C 109.341 -1.504 . . . . 0.0 109.341 179.855 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 54.9 mtpt -65.48 -36.61 84.39 Favored 'General case' 0 N--CA 1.488 1.454 0 O-C-N 121.312 -1.111 . . . . 0.0 109.577 179.421 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 57.5 tp -60.89 -40.41 92.94 Favored 'General case' 0 N--CA 1.489 1.485 0 O-C-N 121.497 -0.752 . . . . 0.0 109.593 -179.109 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 49' ' ' ALA . . . . . . . . . . . . . . . -56.11 -42.41 76.8 Favored 'General case' 0 C--N 1.302 -1.491 0 O-C-N 121.178 -0.951 . . . . 0.0 109.433 -179.352 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 97.3 mt-10 -66.48 -39.13 88.59 Favored 'General case' 0 C--N 1.302 -1.488 0 O-C-N 121.467 -0.771 . . . . 0.0 109.512 179.834 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 51' ' ' TYR . . . . . 0.53 ' CE2' HD21 ' A' ' 36' ' ' LEU . 4.3 m-85 -62.2 -40.77 97.19 Favored 'General case' 0 N--CA 1.491 1.598 0 O-C-N 121.519 -0.738 . . . . 0.0 109.638 -179.527 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 52' ' ' ILE . . . . . . . . . . . . . 96.8 mt -63.27 -42.61 97.04 Favored 'Isoleucine or valine' 0 C--N 1.298 -1.641 0 O-C-N 121.364 -0.835 . . . . 0.0 109.402 -179.671 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 66.6 m -57.82 -49.99 74.77 Favored 'General case' 0 N--CA 1.491 1.586 0 O-C-N 121.18 -0.95 . . . . 0.0 110.642 -179.022 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 54' ' ' LEU . . . . . 0.448 HD22 ' N ' ' A' ' 54' ' ' LEU . 4.2 mm? -66.05 -41.16 91.2 Favored 'General case' 0 N--CA 1.493 1.683 0 O-C-N 121.05 -1.031 . . . . 0.0 109.495 179.732 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -64.25 -39.14 93.34 Favored 'General case' 0 C--N 1.301 -1.516 0 O-C-N 121.46 -0.775 . . . . 0.0 109.476 -179.512 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 56' ' ' LYS . . . . . . . . . . . . . 88.8 tttt -64.05 -43.98 93.87 Favored 'General case' 0 C--N 1.304 -1.4 0 O-C-N 121.418 -0.801 . . . . 0.0 110.076 -179.478 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 15.5 mm100 -66.54 -41.64 88.41 Favored 'General case' 0 N--CA 1.489 1.497 0 O-C-N 121.236 -0.915 . . . . 0.0 109.635 -179.624 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 58' ' ' VAL . . . . . 0.469 ' CG1' ' OE1' ' A' ' 87' ' ' GLU . 74.7 t -64.92 -45.3 95.21 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.507 0 O-C-N 121.424 -0.797 . . . . 0.0 110.626 -179.27 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 59' ' ' TYR . . . . . . . . . . . . . 83.5 t80 -127.86 129.93 47.74 Favored 'General case' 0 N--CA 1.499 2.0 0 O-C-N 121.499 -0.751 . . . . 0.0 110.111 -178.898 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 60' ' ' ALA . . . . . 0.441 ' O ' ' CG ' ' A' ' 61' ' ' ASN . . . -68.51 154.99 40.81 Favored 'General case' 0 N--CA 1.489 1.478 0 O-C-N 121.59 -0.693 . . . . 0.0 110.234 -179.787 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 61' ' ' ASN . . . . . 0.441 ' CG ' ' O ' ' A' ' 60' ' ' ALA . 12.9 p30 45.4 58.31 4.27 Favored 'General case' 0 N--CA 1.493 1.724 0 CA-C-O 121.749 0.785 . . . . 0.0 109.347 -179.744 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 62' ' ' VAL . . . . . . . . . . . . . 14.7 p -74.09 136.5 25.15 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.458 0 CA-C-O 121.48 0.657 . . . . 0.0 110.211 -179.508 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 96.9 mt-10 -124.44 140.05 53.31 Favored 'General case' 0 N--CA 1.492 1.661 0 N-CA-C 109.248 -0.649 . . . . 0.0 109.248 179.826 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 64' ' ' TYR . . . . . . . . . . . . . 50.7 p90 -149.93 161.79 41.62 Favored 'General case' 0 C--N 1.303 -1.444 0 O-C-N 121.447 -0.783 . . . . 0.0 109.132 -179.854 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 49.4 tp10 -142.57 147.03 35.22 Favored 'General case' 0 N--CA 1.491 1.599 0 N-CA-C 108.66 -0.867 . . . . 0.0 108.66 179.694 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 66' ' ' VAL . . . . . . . . . . . . . 75.5 t -117.45 128.39 74.72 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.699 0 O-C-N 121.763 -0.586 . . . . 0.0 109.563 -179.85 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 67' ' ' ALA . . . . . 0.466 ' HB1' ' HD2' ' A' ' 68' ' ' PRO . . . -81.84 168.29 25.14 Favored Pre-proline 0 N--CA 1.489 1.487 0 O-C-N 121.533 -0.729 . . . . 0.0 109.158 -179.878 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 68' ' ' PRO . . . . . 0.466 ' HD2' ' HB1' ' A' ' 67' ' ' ALA . 51.1 Cg_exo -53.36 131.7 44.7 Favored 'Trans proline' 0 N--CA 1.497 1.717 0 C-N-CA 122.198 1.932 . . . . 0.0 112.537 179.588 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 69' ' ' VAL . . . . . . . . . . . . . 54.4 t -133.75 136.68 53.8 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.872 0 O-C-N 121.613 -0.679 . . . . 0.0 109.632 179.58 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -67.83 150.64 48.34 Favored 'General case' 0 N--CA 1.49 1.534 0 O-C-N 121.54 -0.725 . . . . 0.0 110.489 -179.694 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 96.8 m-20 -63.08 -37.16 86.1 Favored 'General case' 0 N--CA 1.492 1.669 0 O-C-N 121.426 -0.796 . . . . 0.0 109.979 179.904 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 72' ' ' ASN . . . . . . . . . . . . . 20.2 t-20 -86.64 9.33 18.97 Favored 'General case' 0 N--CA 1.493 1.677 0 O-C-N 121.296 -0.877 . . . . 0.0 108.891 -179.916 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -63.24 142.92 58.2 Favored 'General case' 0 N--CA 1.489 1.505 0 O-C-N 121.412 -0.805 . . . . 0.0 110.157 -179.465 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 74' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -105.84 5.54 30.83 Favored 'General case' 0 N--CA 1.493 1.686 0 N-CA-C 108.405 -0.961 . . . . 0.0 108.405 179.245 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 96.8 mt-10 -141.96 160.49 40.1 Favored 'General case' 0 N--CA 1.496 1.835 0 O-C-N 121.402 -0.811 . . . . 0.0 109.141 179.372 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 6.6 tp -129.1 134.09 47.93 Favored 'General case' 0 N--CA 1.496 1.868 0 O-C-N 121.669 -0.645 . . . . 0.0 109.349 179.912 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 77' ' ' HIS . . . . . . . . . . . . . 77.7 m80 -104.94 124.07 48.85 Favored 'General case' 0 N--CA 1.494 1.726 0 CA-C-O 121.425 0.631 . . . . 0.0 109.587 179.688 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -150.66 162.17 41.2 Favored 'General case' 0 N--CA 1.488 1.469 0 O-C-N 121.492 -0.755 . . . . 0.0 109.019 -179.995 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 84.4 mtt85 -128.89 149.54 50.73 Favored 'General case' 0 N--CA 1.493 1.711 0 N-CA-C 109.114 -0.698 . . . . 0.0 109.114 179.872 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 80' ' ' PHE . . . . . 0.46 ' CD1' HG21 ' A' ' 34' ' ' VAL . 34.4 m-85 -128.14 152.1 48.43 Favored 'General case' 0 N--CA 1.494 1.734 0 O-C-N 121.665 -0.647 . . . . 0.0 109.452 -179.821 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 65.7 tttm -107.81 140.21 41.24 Favored 'General case' 0 N--CA 1.492 1.653 0 CA-C-O 121.324 0.583 . . . . 0.0 109.924 -179.373 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 82' ' ' PHE . . . . . . . . . . . . . 82.7 m-85 -141.67 -164.6 1.81 Allowed 'General case' 0 N--CA 1.492 1.67 0 O-C-N 121.52 -0.738 . . . . 0.0 109.404 179.896 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 83.0 tt0 -100.46 -50.56 3.87 Favored 'General case' 0 N--CA 1.492 1.632 0 O-C-N 121.607 -0.683 . . . . 0.0 109.285 179.806 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 84' ' ' VAL . . . . . . . . . . . . . 2.5 m -134.72 164.88 32.82 Favored 'Isoleucine or valine' 0 N--CA 1.499 2.001 0 O-C-N 121.451 -0.781 . . . . 0.0 110.311 -179.534 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 38.1 t -61.87 -19.05 62.21 Favored 'General case' 0 N--CA 1.489 1.523 0 O-C-N 121.755 -0.591 . . . . 0.0 109.61 -179.908 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 86' ' ' ALA . . . . . . . . . . . . . . . -61.45 -37.21 82.73 Favored 'General case' 0 N--CA 1.489 1.487 0 O-C-N 121.241 -0.912 . . . . 0.0 109.618 -179.899 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 87' ' ' GLU . . . . . 0.469 ' OE1' ' CG1' ' A' ' 58' ' ' VAL . 79.6 mm-40 -66.61 -34.99 79.11 Favored 'General case' 0 N--CA 1.49 1.556 0 O-C-N 121.315 -0.865 . . . . 0.0 109.386 -179.916 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 88' ' ' LYS . . . . . . . . . . . . . 88.7 tttt -62.85 -46.48 87.71 Favored 'General case' 0 N--CA 1.49 1.552 0 O-C-N 121.328 -0.858 . . . . 0.0 109.628 -179.791 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 87.1 mt -63.26 -44.38 95.3 Favored 'General case' 0 N--CA 1.488 1.468 0 O-C-N 121.346 -0.846 . . . . 0.0 109.409 -179.669 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 90' ' ' ILE . . . . . . . . . . . . . 97.0 mt -66.55 -45.15 89.47 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.461 0 O-C-N 121.34 -0.85 . . . . 0.0 109.791 -179.954 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 91' ' ' PHE . . . . . . . . . . . . . 86.2 t80 -64.4 -43.41 94.53 Favored 'General case' 0 N--CA 1.489 1.484 0 O-C-N 121.477 -0.764 . . . . 0.0 109.78 -179.919 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 92' ' ' GLU . . . . . . . . . . . . . 47.6 tp10 -59.21 -39.24 82.04 Favored 'General case' 0 N--CA 1.488 1.46 0 O-C-N 121.409 -0.807 . . . . 0.0 108.887 -179.36 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 93' ' ' LEU . . . . . 0.411 ' HA ' ' HE ' ' A' ' 96' ' ' ARG . 5.5 tt -62.96 -43.56 98.47 Favored 'General case' 0 C--N 1.301 -1.529 0 O-C-N 121.434 -0.792 . . . . 0.0 109.633 179.928 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 94' ' ' LYS . . . . . . . . . . . . . 99.2 mttt -64.68 -40.83 96.07 Favored 'General case' 0 N--CA 1.489 1.482 0 O-C-N 121.529 -0.732 . . . . 0.0 109.428 -179.795 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 95' ' ' THR . . . . . 0.506 ' CG2' ' CE2' ' A' ' 51' ' ' TYR . 21.1 p -64.84 -42.97 94.49 Favored 'General case' 0 N--CA 1.49 1.534 0 O-C-N 121.317 -0.864 . . . . 0.0 109.304 -179.914 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 96' ' ' ARG . . . . . 0.411 ' HE ' ' HA ' ' A' ' 93' ' ' LEU . 89.4 mtm180 -63.81 -38.69 92.03 Favored 'General case' 0 N--CA 1.488 1.441 0 O-C-N 121.467 -0.771 . . . . 0.0 109.136 179.483 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 97' ' ' ALA . . . . . . . . . . . . . . . -65.97 -44.72 84.13 Favored 'General case' 0 N--CA 1.488 1.473 0 O-C-N 121.369 -0.832 . . . . 0.0 109.686 -179.931 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 98' ' ' LEU . . . . . . . . . . . . . 83.5 mt -64.78 -43.31 93.65 Favored 'General case' 0 N--CA 1.49 1.556 0 O-C-N 121.245 -0.91 . . . . 0.0 109.41 -179.985 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 99' ' ' ALA . . . . . . . . . . . . . . . -70.95 -51.75 23.97 Favored 'General case' 0 C--N 1.302 -1.482 0 O-C-N 121.411 -0.805 . . . . 0.0 109.975 -179.623 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 100' ' ' ARG . . . . . . . . . . . . . 46.1 mmm-85 -68.03 -39.25 83.14 Favored 'General case' 0 C--N 1.302 -1.476 0 O-C-N 121.44 -0.787 . . . . 0.0 109.535 -179.33 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 101' ' ' LEU . . . . . . . . . . . . . 12.6 tp 41.67 58.58 2.72 Favored 'General case' 0 N--CA 1.491 1.612 0 O-C-N 121.653 -0.655 . . . . 0.0 109.921 -179.71 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 102' ' ' GLU . . . . . . . . . . . . . 80.6 mm-40 -105.95 87.23 2.53 Favored 'General case' 0 N--CA 1.498 1.93 0 O-C-N 121.497 -0.752 . . . . 0.0 109.345 179.989 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 103' ' ' HIS . . . . . 0.54 ' CG ' ' N ' ' A' ' 104' ' ' HIS . 11.7 t-160 -86.03 -107.54 0.05 Allowed 'General case' 0 N--CA 1.49 1.571 0 O-C-N 121.501 -0.749 . . . . 0.0 109.412 179.926 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 104' ' ' HIS . . . . . 0.54 ' N ' ' CG ' ' A' ' 103' ' ' HIS . 51.2 p-80 -86.58 12.78 9.72 Favored 'General case' 0 N--CA 1.487 1.379 0 N-CA-C 108.717 -0.845 . . . . 0.0 108.717 179.641 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 105' ' ' HIS . . . . . . . . . . . . . 79.3 m80 -59.09 -41.22 87.54 Favored 'General case' 0 C--N 1.305 -1.361 0 N-CA-C 108.588 -0.893 . . . . 0.0 108.588 179.577 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 106' ' ' HIS . . . . . . . . . . . . . 51.9 t-80 43.4 43.2 4.22 Favored 'General case' 0 N--CA 1.491 1.621 0 CA-C-O 121.524 0.678 . . . . 0.0 109.466 -179.786 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 107' ' ' HIS . . . . . . . . . . . . . 84.0 t60 -141.81 137.31 31.41 Favored 'General case' 0 N--CA 1.491 1.622 0 O-C-N 121.415 -0.803 . . . . 0.0 109.38 -179.929 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 108' ' ' HIS . . . . . 0.439 ' O ' ' CG ' ' A' ' 108' ' ' HIS . 86.0 t60 . . . . . 0 N--CA 1.488 1.468 0 CA-C-O 117.882 -1.056 . . . . 0.0 110.159 -179.647 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . 0.6 ' N ' ' SD ' ' A' ' 1' ' ' MET . 0.0 OUTLIER . . . . . 0 N--CA 1.49 1.572 0 N-CA-C 108.713 -0.847 . . . . 0.0 108.713 . . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 22.0 m -149.76 150.67 32.39 Favored 'General case' 0 N--CA 1.489 1.502 0 O-C-N 121.284 -0.885 . . . . 0.0 109.51 179.715 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 3' ' ' ASN . . . . . . . . . . . . . 57.4 t-20 -89.08 108.57 19.67 Favored 'General case' 0 N--CA 1.49 1.555 0 O-C-N 121.406 -0.809 . . . . 0.0 109.603 -179.716 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 5.3 tp-100 -158.24 -38.26 0.07 Allowed 'General case' 0 N--CA 1.49 1.533 0 N-CA-C 108.654 -0.869 . . . . 0.0 108.654 179.677 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 4.0 p -93.63 -6.06 47.31 Favored 'General case' 0 N--CA 1.493 1.681 0 N-CA-C 108.854 -0.795 . . . . 0.0 108.854 179.866 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 90.5 m -65.12 -37.7 88.31 Favored 'General case' 0 N--CA 1.488 1.453 0 O-C-N 121.502 -0.749 . . . . 0.0 109.032 179.634 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 7' ' ' VAL . . . . . . . . . . . . . 33.8 m -76.09 138.97 19.7 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.569 0 O-C-N 121.569 -0.707 . . . . 0.0 110.262 -179.268 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 17.6 pt-20 -60.99 142.19 56.75 Favored 'General case' 0 N--CA 1.491 1.595 0 CA-C-O 121.66 0.743 . . . . 0.0 110.716 -179.337 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 9' ' ' ASN . . . . . 0.528 ' CG ' ' H ' ' A' ' 10' ' ' GLU . 11.9 p-10 -85.51 -101.25 0.06 Allowed 'General case' 0 N--CA 1.49 1.557 0 O-C-N 121.596 -0.69 . . . . 0.0 110.321 -179.873 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 10' ' ' GLU . . . . . 0.528 ' H ' ' CG ' ' A' ' 9' ' ' ASN . 79.7 mm-40 -62.98 148.39 47.77 Favored 'General case' 0 N--CA 1.489 1.476 0 O-C-N 121.426 -0.796 . . . . 0.0 110.688 -178.719 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 64.1 t -94.77 128.1 46.24 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.553 0 O-C-N 121.615 -0.678 . . . . 0.0 109.353 -179.845 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 25.0 p -166.81 145.55 5.29 Favored 'General case' 0 N--CA 1.488 1.457 0 O-C-N 121.418 -0.801 . . . . 0.0 109.291 179.553 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 13' ' ' GLU . . . . . 0.555 ' N ' ' OE1' ' A' ' 13' ' ' GLU . 56.7 mp0 -92.27 122.54 34.84 Favored 'General case' 0 N--CA 1.49 1.573 0 O-C-N 121.37 -0.831 . . . . 0.0 109.846 -179.369 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -68.26 141.55 55.86 Favored 'General case' 0 N--CA 1.489 1.504 0 O-C-N 121.58 -0.7 . . . . 0.0 110.266 -179.583 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 71.6 m -146.95 -62.1 0.29 Allowed 'General case' 0 N--CA 1.491 1.587 0 O-C-N 121.562 -0.712 . . . . 0.0 109.178 179.715 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . -70.44 142.48 35.57 Favored Glycine 0 N--CA 1.491 2.307 0 N-CA-C 110.893 -0.883 . . . . 0.0 110.893 -179.192 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 1.6 p -67.54 -35.52 79.22 Favored 'General case' 0 N--CA 1.491 1.581 0 O-C-N 121.545 -0.974 . . . . 0.0 109.333 179.388 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -60.86 142.41 56.24 Favored 'General case' 0 N--CA 1.489 1.488 0 O-C-N 121.406 -0.809 . . . . 0.0 110.481 -178.876 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -84.1 2.63 87.45 Favored Glycine 0 N--CA 1.49 2.235 0 N-CA-C 109.232 -1.547 . . . . 0.0 109.232 179.759 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 79.0 mm-40 -56.36 132.78 51.98 Favored 'General case' 0 N--CA 1.49 1.558 0 O-C-N 121.349 -1.089 . . . . 0.0 109.953 -179.291 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 21' ' ' ILE . . . . . . . . . . . . . 91.0 mt -104.96 129.09 58.15 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.632 0 O-C-N 121.697 -0.627 . . . . 0.0 109.833 -179.896 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . -178.33 168.77 40.15 Favored Glycine 0 N--CA 1.485 1.916 0 N-CA-C 109.645 -1.382 . . . . 0.0 109.645 179.834 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 23' ' ' PHE . . . . . 0.423 ' O ' ' CD1' ' A' ' 23' ' ' PHE . 52.5 p90 -113.05 133.71 54.86 Favored 'General case' 0 N--CA 1.492 1.656 0 O-C-N 121.74 -0.859 . . . . 0.0 109.219 179.828 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 24' ' ' ILE . . . . . 0.44 HG23 ' N ' ' A' ' 25' ' ' ILE . 19.4 tt -130.32 -36.53 0.62 Allowed 'Isoleucine or valine' 0 N--CA 1.494 1.768 0 N-CA-C 108.761 -0.829 . . . . 0.0 108.761 179.715 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 25' ' ' ILE . . . . . 0.486 HG22 ' N ' ' A' ' 26' ' ' ARG . 94.1 mt 56.38 158.13 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.492 1.652 0 CA-C-O 121.503 0.668 . . . . 0.0 110.359 179.861 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 26' ' ' ARG . . . . . 0.486 ' N ' HG22 ' A' ' 25' ' ' ILE . 85.1 mtp180 -88.99 136.87 32.78 Favored 'General case' 0 N--CA 1.492 1.649 0 O-C-N 121.404 -0.81 . . . . 0.0 110.011 -179.178 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 96.4 mt-10 -80.59 144.67 32.22 Favored 'General case' 0 N--CA 1.49 1.554 0 O-C-N 121.542 -0.724 . . . . 0.0 110.741 -179.386 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . 173.03 -177.05 45.69 Favored Glycine 0 N--CA 1.486 2.032 0 N-CA-C 109.586 -1.405 . . . . 0.0 109.586 179.39 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 98.1 m-20 -72.02 -8.79 56.56 Favored 'General case' 0 C--N 1.304 -1.391 0 O-C-N 121.53 -0.982 . . . . 0.0 108.959 179.598 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 31.6 p30 -85.98 1.09 51.49 Favored 'General case' 0 N--CA 1.49 1.537 0 N-CA-C 108.774 -0.824 . . . . 0.0 108.774 179.789 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 53.5 t -126.02 133.7 68.31 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.864 0 N-CA-C 109.27 -0.641 . . . . 0.0 109.27 179.802 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -138.33 151.19 47.32 Favored 'General case' 0 N--CA 1.492 1.665 0 O-C-N 121.469 -0.769 . . . . 0.0 109.573 179.897 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 15.4 pt-20 -94.21 145.91 24.38 Favored 'General case' 0 N--CA 1.492 1.671 0 O-C-N 121.528 -0.733 . . . . 0.0 109.961 -179.552 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 34' ' ' VAL . . . . . . . . . . . . . 92.7 t -119.36 127.57 75.85 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.789 0 N-CA-C 108.64 -0.874 . . . . 0.0 108.64 179.893 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 26.1 t -117.36 128.0 54.61 Favored 'General case' 0 N--CA 1.494 1.736 0 N-CA-C 109.103 -0.703 . . . . 0.0 109.103 -179.829 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 36' ' ' LEU . . . . . 0.562 HD13 ' CZ ' ' A' ' 51' ' ' TYR . 55.1 tp -124.98 142.66 51.34 Favored 'General case' 0 N--CA 1.497 1.922 0 CA-C-O 121.381 0.61 . . . . 0.0 109.614 -179.996 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 37' ' ' PHE . . . . . . . . . . . . . 92.8 m-85 -104.69 147.01 28.14 Favored 'General case' 0 N--CA 1.493 1.723 0 O-C-N 121.685 -0.634 . . . . 0.0 109.818 179.992 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . -172.9 179.31 44.43 Favored Glycine 0 N--CA 1.488 2.128 0 N-CA-C 109.759 -1.336 . . . . 0.0 109.759 179.748 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 19.0 t -78.52 -99.27 0.02 OUTLIER 'General case' 0 N--CA 1.49 1.562 0 O-C-N 121.476 -1.014 . . . . 0.0 110.05 -179.809 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 40' ' ' ASP . . . . . . . . . . . . . 55.7 p-10 -85.59 175.44 8.78 Favored 'General case' 0 N--CA 1.49 1.573 0 O-C-N 121.424 -0.798 . . . . 0.0 110.453 -179.114 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 88.8 tttt -63.32 -41.96 98.95 Favored 'General case' 0 N--CA 1.491 1.581 0 O-C-N 121.528 -0.733 . . . . 0.0 109.196 179.905 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -53.5 -43.13 68.0 Favored 'General case' 0 N--CA 1.49 1.543 0 O-C-N 121.602 -0.686 . . . . 0.0 109.542 -179.65 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 43' ' ' HIS . . . . . . . . . . . . . 28.8 t-80 -63.21 -44.0 96.57 Favored 'General case' 0 N--CA 1.489 1.509 0 O-C-N 121.468 -0.77 . . . . 0.0 109.306 -179.851 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 84.5 mt -63.6 -39.87 95.48 Favored 'General case' 0 N--CA 1.491 1.575 0 O-C-N 121.52 -0.737 . . . . 0.0 109.306 179.982 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 97.1 mt-10 -59.65 -37.87 79.9 Favored 'General case' 0 N--CA 1.488 1.45 0 O-C-N 121.346 -0.846 . . . . 0.0 109.689 -179.782 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . -64.22 -52.01 47.82 Favored Glycine 0 N--CA 1.492 2.41 0 N-CA-C 109.588 -1.405 . . . . 0.0 109.588 -179.445 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 97.3 mttt -67.04 -32.61 73.92 Favored 'General case' 0 N--CA 1.49 1.54 0 O-C-N 121.395 -1.062 . . . . 0.0 109.376 179.299 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 48' ' ' LEU . . . . . 0.483 HD13 ' CD2' ' A' ' 76' ' ' LEU . 52.6 tp -58.07 -40.74 81.8 Favored 'General case' 0 C--N 1.301 -1.53 0 O-C-N 121.569 -0.707 . . . . 0.0 109.286 -179.341 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 49' ' ' ALA . . . . . . . . . . . . . . . -59.74 -39.43 84.71 Favored 'General case' 0 N--CA 1.488 1.468 0 O-C-N 121.395 -0.816 . . . . 0.0 109.442 -179.597 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 97.8 mt-10 -70.17 -39.21 75.41 Favored 'General case' 0 N--CA 1.49 1.565 0 O-C-N 121.452 -0.78 . . . . 0.0 109.616 179.797 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 51' ' ' TYR . . . . . 0.562 ' CZ ' HD13 ' A' ' 36' ' ' LEU . 4.4 m-85 -61.71 -48.61 79.99 Favored 'General case' 0 N--CA 1.492 1.627 0 O-C-N 121.361 -0.837 . . . . 0.0 109.547 -179.514 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 52' ' ' ILE . . . . . . . . . . . . . 95.4 mt -65.61 -44.45 93.71 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.444 0 O-C-N 121.346 -0.846 . . . . 0.0 109.359 -179.664 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 66.2 m -63.03 -42.07 99.69 Favored 'General case' 0 N--CA 1.488 1.465 0 O-C-N 121.557 -0.715 . . . . 0.0 109.637 -179.705 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 54' ' ' LEU . . . . . . . . . . . . . 56.0 tp -63.59 -42.25 98.28 Favored 'General case' 0 N--CA 1.489 1.48 0 O-C-N 121.497 -0.752 . . . . 0.0 109.329 -179.705 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -62.48 -41.4 98.76 Favored 'General case' 0 N--CA 1.489 1.505 0 O-C-N 121.523 -0.736 . . . . 0.0 109.477 -179.04 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 56' ' ' LYS . . . . . 0.479 ' O ' ' N ' ' A' ' 60' ' ' ALA . 97.8 mttt -64.93 -42.5 94.61 Favored 'General case' 0 C--N 1.302 -1.48 0 O-C-N 121.496 -0.752 . . . . 0.0 110.084 -179.797 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 58.4 tt0 -64.65 -42.03 95.71 Favored 'General case' 0 N--CA 1.49 1.534 0 O-C-N 121.118 -0.989 . . . . 0.0 109.314 -179.597 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 58' ' ' VAL . . . . . . . . . . . . . 71.6 t -68.46 -45.71 81.62 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.517 0 O-C-N 121.443 -0.785 . . . . 0.0 110.124 -179.834 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 59' ' ' TYR . . . . . 0.671 ' O ' ' HB3' ' A' ' 60' ' ' ALA . 53.8 t80 -110.39 -57.18 2.25 Favored 'General case' 0 N--CA 1.496 1.866 0 O-C-N 121.56 -0.713 . . . . 0.0 109.913 -178.818 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 60' ' ' ALA . . . . . 0.671 ' HB3' ' O ' ' A' ' 59' ' ' TYR . . . 82.98 145.22 0.07 Allowed 'General case' 0 N--CA 1.499 2.013 0 CA-C-O 121.27 0.557 . . . . 0.0 109.707 -179.757 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 61' ' ' ASN . . . . . . . . . . . . . 5.4 m120 59.49 33.46 22.22 Favored 'General case' 0 N--CA 1.491 1.61 0 N-CA-C 108.534 -0.913 . . . . 0.0 108.534 -179.253 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 62' ' ' VAL . . . . . . . . . . . . . 9.9 p -90.97 152.82 3.29 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.655 0 O-C-N 121.577 -0.702 . . . . 0.0 110.343 -179.524 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 96.9 mt-10 -113.43 132.5 55.61 Favored 'General case' 0 N--CA 1.494 1.727 0 N-CA-C 108.892 -0.781 . . . . 0.0 108.892 179.556 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 64' ' ' TYR . . . . . . . . . . . . . 52.4 p90 -142.83 162.22 36.04 Favored 'General case' 0 N--CA 1.489 1.516 0 O-C-N 121.432 -0.792 . . . . 0.0 109.428 -179.58 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 79.6 mm-40 -138.53 157.72 45.63 Favored 'General case' 0 N--CA 1.49 1.526 0 O-C-N 121.53 -0.731 . . . . 0.0 109.041 -179.946 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 66' ' ' VAL . . . . . . . . . . . . . 3.3 p -125.5 132.47 70.92 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.696 0 CA-C-O 121.648 0.737 . . . . 0.0 109.478 -179.6 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 67' ' ' ALA . . . . . 0.542 ' HB1' ' HD2' ' A' ' 68' ' ' PRO . . . -86.27 170.5 12.48 Favored Pre-proline 0 N--CA 1.489 1.501 0 O-C-N 121.527 -0.733 . . . . 0.0 109.381 -179.719 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 68' ' ' PRO . . . . . 0.542 ' HD2' ' HB1' ' A' ' 67' ' ' ALA . 37.1 Cg_exo -54.73 132.38 51.35 Favored 'Trans proline' 0 N--CA 1.494 1.534 0 C-N-CA 122.171 1.914 . . . . 0.0 112.209 179.776 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 69' ' ' VAL . . . . . 0.446 HG21 HD12 ' A' ' 76' ' ' LEU . 55.0 t -130.51 133.29 63.89 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.792 0 CA-C-O 121.479 0.657 . . . . 0.0 109.599 179.664 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -74.07 156.0 37.9 Favored 'General case' 0 N--CA 1.487 1.425 0 CA-C-O 121.635 0.731 . . . . 0.0 110.529 -179.711 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 92.2 m-20 -62.47 -39.78 94.53 Favored 'General case' 0 N--CA 1.492 1.628 0 O-C-N 121.545 -0.722 . . . . 0.0 109.92 -179.94 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 72' ' ' ASN . . . . . . . . . . . . . 90.9 m-20 -95.38 16.14 17.62 Favored 'General case' 0 N--CA 1.495 1.79 0 O-C-N 121.345 -0.847 . . . . 0.0 109.404 -179.396 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -59.06 143.47 48.4 Favored 'General case' 0 N--CA 1.491 1.624 0 O-C-N 121.364 -0.835 . . . . 0.0 110.311 -179.321 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 74' ' ' THR . . . . . . . . . . . . . 61.2 p -105.44 -1.0 25.5 Favored 'General case' 0 N--CA 1.494 1.735 0 N-CA-C 108.876 -0.787 . . . . 0.0 108.876 179.708 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 95.9 mt-10 -138.99 158.34 44.38 Favored 'General case' 0 N--CA 1.493 1.703 0 O-C-N 121.475 -0.766 . . . . 0.0 109.596 -179.734 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 76' ' ' LEU . . . . . 0.483 ' CD2' HD13 ' A' ' 48' ' ' LEU . 6.2 tp -124.78 133.49 53.12 Favored 'General case' 0 N--CA 1.492 1.632 0 O-C-N 121.641 -0.662 . . . . 0.0 109.419 -179.912 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 77' ' ' HIS . . . . . . . . . . . . . 80.8 m80 -112.13 121.12 44.07 Favored 'General case' 0 N--CA 1.491 1.623 0 N-CA-C 109.085 -0.709 . . . . 0.0 109.085 179.556 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -147.1 160.69 42.11 Favored 'General case' 0 N--CA 1.489 1.522 0 O-C-N 121.239 -0.913 . . . . 0.0 109.12 -179.977 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 95.6 mtt180 -126.63 141.97 51.69 Favored 'General case' 0 N--CA 1.494 1.767 0 CA-C-O 121.593 0.711 . . . . 0.0 109.966 -179.715 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 80' ' ' PHE . . . . . . . . . . . . . 42.9 m-85 -128.66 148.53 50.82 Favored 'General case' 0 N--CA 1.493 1.676 0 N-CA-C 109.041 -0.725 . . . . 0.0 109.041 179.819 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 88.3 tttt -104.54 117.07 33.25 Favored 'General case' 0 N--CA 1.492 1.66 0 O-C-N 121.591 -0.693 . . . . 0.0 109.443 -179.757 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 82' ' ' PHE . . . . . . . . . . . . . 65.0 m-85 -112.68 141.78 46.06 Favored 'General case' 0 N--CA 1.494 1.748 0 CA-C-O 121.55 0.691 . . . . 0.0 109.854 -179.889 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 1.4 tm-20 -66.42 -34.19 77.39 Favored 'General case' 0 N--CA 1.488 1.444 0 N-CA-C 109.042 -0.725 . . . . 0.0 109.042 179.484 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 84' ' ' VAL . . . . . 0.448 HG23 ' H ' ' A' ' 87' ' ' GLU . 31.5 m -135.07 161.3 40.21 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.734 0 CA-C-O 121.607 0.717 . . . . 0.0 109.724 -179.784 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 25.0 m -75.67 -20.55 58.35 Favored 'General case' 0 N--CA 1.491 1.576 0 O-C-N 121.586 -0.696 . . . . 0.0 109.61 -179.903 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 86' ' ' ALA . . . . . . . . . . . . . . . -62.09 -39.38 92.25 Favored 'General case' 0 N--CA 1.494 1.726 0 O-C-N 121.333 -0.854 . . . . 0.0 109.633 -179.468 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 87' ' ' GLU . . . . . 0.448 ' H ' HG23 ' A' ' 84' ' ' VAL . 72.8 mm-40 -67.96 -32.28 72.6 Favored 'General case' 0 C--N 1.299 -1.594 0 O-C-N 121.604 -0.685 . . . . 0.0 109.163 -179.814 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 88' ' ' LYS . . . . . . . . . . . . . 4.6 tmtt? -64.36 -49.83 70.09 Favored 'General case' 0 N--CA 1.49 1.539 0 O-C-N 121.288 -0.882 . . . . 0.0 109.069 -179.712 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 17.9 mt -63.64 -44.84 92.68 Favored 'General case' 0 N--CA 1.489 1.519 0 O-C-N 121.276 -0.89 . . . . 0.0 109.662 -179.68 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 90' ' ' ILE . . . . . . . . . . . . . 97.3 mt -66.41 -43.89 90.93 Favored 'Isoleucine or valine' 0 C--N 1.301 -1.521 0 O-C-N 121.579 -0.701 . . . . 0.0 109.425 -179.745 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 91' ' ' PHE . . . . . 0.41 ' O ' HG23 ' A' ' 95' ' ' THR . 81.9 t80 -61.55 -44.93 96.14 Favored 'General case' 0 N--CA 1.49 1.572 0 O-C-N 121.574 -0.704 . . . . 0.0 109.441 -179.588 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 92' ' ' GLU . . . . . . . . . . . . . 80.5 tt0 -62.13 -46.1 90.5 Favored 'General case' 0 N--CA 1.49 1.573 0 O-C-N 121.524 -0.735 . . . . 0.0 109.583 -179.627 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 93' ' ' LEU . . . . . . . . . . . . . 85.3 mt -63.67 -43.44 96.7 Favored 'General case' 0 N--CA 1.491 1.613 0 O-C-N 121.341 -0.849 . . . . 0.0 109.831 -179.537 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 94' ' ' LYS . . . . . . . . . . . . . 55.7 mtpt -65.05 -40.96 95.49 Favored 'General case' 0 C--N 1.302 -1.457 0 O-C-N 121.328 -0.857 . . . . 0.0 109.691 179.863 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 95' ' ' THR . . . . . 0.41 HG23 ' O ' ' A' ' 91' ' ' PHE . 20.6 p -65.27 -35.79 82.1 Favored 'General case' 0 N--CA 1.488 1.471 0 O-C-N 121.385 -0.822 . . . . 0.0 109.493 -179.743 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 96' ' ' ARG . . . . . . . . . . . . . 24.4 mmt180 -63.46 -42.37 98.61 Favored 'General case' 0 C--N 1.3 -1.562 0 O-C-N 121.436 -0.79 . . . . 0.0 109.4 179.638 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 97' ' ' ALA . . . . . . . . . . . . . . . -67.42 -38.46 84.61 Favored 'General case' 0 C--N 1.3 -1.568 0 O-C-N 121.472 -0.767 . . . . 0.0 108.942 179.539 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 98' ' ' LEU . . . . . 0.501 HD13 ' O ' ' A' ' 98' ' ' LEU . 0.2 OUTLIER -63.4 -45.84 89.16 Favored 'General case' 0 C--N 1.304 -1.396 0 CA-C-O 121.805 0.812 . . . . 0.0 109.067 -179.446 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 99' ' ' ALA . . . . . . . . . . . . . . . -67.27 -37.21 83.1 Favored 'General case' 0 C--N 1.304 -1.409 0 O-C-N 121.497 -0.752 . . . . 0.0 109.644 -179.747 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 100' ' ' ARG . . . . . . . . . . . . . 83.9 mtp180 -80.82 -5.84 57.78 Favored 'General case' 0 N--CA 1.489 1.509 0 O-C-N 121.476 -0.765 . . . . 0.0 109.276 -179.639 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 101' ' ' LEU . . . . . . . . . . . . . 83.9 mt 44.43 75.92 0.09 Allowed 'General case' 0 N--CA 1.493 1.716 0 CA-C-O 121.939 0.876 . . . . 0.0 109.681 -179.659 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 102' ' ' GLU . . . . . . . . . . . . . 80.4 mm-40 -63.14 146.69 52.77 Favored 'General case' 0 N--CA 1.486 1.367 0 CA-C-O 121.575 0.703 . . . . 0.0 110.07 -179.626 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 103' ' ' HIS . . . . . . . . . . . . . 98.6 m-70 -90.56 101.99 14.73 Favored 'General case' 0 N--CA 1.488 1.471 0 O-C-N 121.571 -0.705 . . . . 0.0 109.405 -179.794 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 104' ' ' HIS . . . . . . . . . . . . . 53.9 p-80 -98.78 -12.16 21.15 Favored 'General case' 0 N--CA 1.495 1.806 0 CA-C-O 121.573 0.701 . . . . 0.0 109.118 -179.894 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 105' ' ' HIS . . . . . . . . . . . . . 99.6 m-70 50.52 -178.94 0.02 OUTLIER 'General case' 0 N--CA 1.492 1.661 0 CA-C-O 121.938 0.875 . . . . 0.0 111.416 179.419 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 106' ' ' HIS . . . . . . . . . . . . . 55.3 t-80 46.56 89.89 0.02 OUTLIER 'General case' 0 N--CA 1.488 1.434 0 CA-C-O 121.209 0.528 . . . . 0.0 109.82 -179.834 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 107' ' ' HIS . . . . . . . . . . . . . 63.8 t-80 -120.08 125.04 47.29 Favored 'General case' 0 N--CA 1.496 1.832 0 CA-C-O 121.641 0.734 . . . . 0.0 109.859 179.932 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 108' ' ' HIS . . . . . 0.496 ' CG ' ' O ' ' A' ' 108' ' ' HIS . 86.4 t60 . . . . . 0 N--CA 1.49 1.541 0 CA-C-O 117.984 -1.008 . . . . 0.0 110.065 179.661 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 87.2 mmm . . . . . 0 N--CA 1.488 1.466 0 N-CA-C 108.927 -0.768 . . . . 0.0 108.927 . . . . . . . . . 0 0 . 1 . 018 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 66.6 m -135.0 144.69 47.51 Favored 'General case' 0 N--CA 1.494 1.771 0 O-C-N 121.424 -0.797 . . . . 0.0 109.634 179.847 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 3' ' ' ASN . . . . . 0.545 ' OD1' ' N ' ' A' ' 4' ' ' GLN . 38.4 p-10 -66.92 -40.36 87.63 Favored 'General case' 0 N--CA 1.49 1.572 0 O-C-N 121.533 -0.729 . . . . 0.0 110.195 -179.832 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 4' ' ' GLN . . . . . 0.545 ' N ' ' OD1' ' A' ' 3' ' ' ASN . 6.0 tt0 -107.61 151.77 25.18 Favored 'General case' 0 N--CA 1.495 1.782 0 O-C-N 121.495 -0.753 . . . . 0.0 109.992 -179.339 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 5' ' ' THR . . . . . 0.52 ' O ' ' N ' ' A' ' 7' ' ' VAL . 73.0 p -99.75 3.03 44.71 Favored 'General case' 0 N--CA 1.494 1.729 0 N-CA-C 109.124 -0.695 . . . . 0.0 109.124 179.784 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 6' ' ' CYS . . . . . 0.471 ' H ' ' HG2' ' A' ' 4' ' ' GLN . 26.6 p -58.87 80.81 0.01 OUTLIER 'General case' 0 N--CA 1.49 1.551 0 O-C-N 121.326 -0.858 . . . . 0.0 109.816 -179.636 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 7' ' ' VAL . . . . . 0.52 ' N ' ' O ' ' A' ' 5' ' ' THR . 7.1 p -95.8 -14.54 7.87 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.703 0 O-C-N 121.414 -0.804 . . . . 0.0 108.842 179.473 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 8' ' ' GLU . . . . . 0.404 ' CG ' ' H ' ' A' ' 9' ' ' ASN . 23.0 tp10 39.0 -131.64 0.2 Allowed 'General case' 0 N--CA 1.497 1.909 0 CA-C-O 121.684 0.754 . . . . 0.0 110.906 179.642 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 9' ' ' ASN . . . . . 0.404 ' H ' ' CG ' ' A' ' 8' ' ' GLU . 19.4 t-20 -89.77 108.34 19.64 Favored 'General case' 0 N--CA 1.486 1.356 0 O-C-N 121.343 -0.848 . . . . 0.0 109.718 -178.956 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 80.1 tt0 -162.88 121.8 2.14 Favored 'General case' 0 N--CA 1.488 1.451 0 O-C-N 121.328 -0.857 . . . . 0.0 109.17 179.788 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 11' ' ' VAL . . . . . 0.403 ' O ' HG23 ' A' ' 11' ' ' VAL . 33.7 m -85.5 129.18 38.35 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.687 0 O-C-N 121.487 -0.758 . . . . 0.0 109.597 -179.357 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 5.1 m -89.3 131.22 35.5 Favored 'General case' 0 N--CA 1.489 1.491 0 O-C-N 121.383 -0.823 . . . . 0.0 109.907 -179.2 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 48.1 tp10 -159.51 108.63 1.84 Allowed 'General case' 0 C--N 1.305 -1.351 0 O-C-N 121.325 -0.859 . . . . 0.0 108.939 179.044 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 14' ' ' ALA . . . . . 0.556 ' O ' ' N ' ' A' ' 16' ' ' GLY . . . -178.38 0.03 0.01 OUTLIER 'General case' 0 C--N 1.302 -1.465 0 N-CA-C 108.054 -1.091 . . . . 0.0 108.054 179.765 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 15' ' ' CYS . . . . . 0.42 ' H ' ' H ' ' A' ' 14' ' ' ALA . 67.4 m 51.05 -84.69 0.01 OUTLIER 'General case' 0 N--CA 1.495 1.807 0 CA-C-O 121.416 0.627 . . . . 0.0 110.096 179.847 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 16' ' ' GLY . . . . . 0.556 ' N ' ' O ' ' A' ' 14' ' ' ALA . . . -159.84 -146.79 4.69 Favored Glycine 0 N--CA 1.485 1.951 0 N-CA-C 109.826 -1.309 . . . . 0.0 109.826 -179.483 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 13.8 p -76.6 146.78 38.04 Favored 'General case' 0 N--CA 1.49 1.556 0 O-C-N 121.472 -1.017 . . . . 0.0 110.532 -179.332 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -63.38 144.64 56.79 Favored 'General case' 0 N--CA 1.49 1.57 0 CA-C-O 121.67 0.748 . . . . 0.0 110.565 -179.275 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -154.33 -131.43 1.52 Allowed Glycine 0 N--CA 1.492 2.403 0 N-CA-C 109.689 -1.364 . . . . 0.0 109.689 -179.863 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 17.4 pt-20 -82.44 -5.26 58.57 Favored 'General case' 0 N--CA 1.491 1.583 0 O-C-N 121.546 -0.973 . . . . 0.0 109.586 -179.878 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 21' ' ' ILE . . . . . . . . . . . . . 35.2 mm -66.32 -42.82 91.38 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.568 0 O-C-N 121.232 -0.917 . . . . 0.0 109.463 179.859 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . -149.1 -151.94 5.6 Favored Glycine 0 N--CA 1.493 2.488 0 C-N-CA 119.847 -1.168 . . . . 0.0 110.346 -179.24 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 23' ' ' PHE . . . . . . . . . . . . . 92.2 m-85 -77.35 140.36 39.95 Favored 'General case' 0 N--CA 1.49 1.554 0 O-C-N 121.294 -1.121 . . . . 0.0 110.332 -179.309 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 40.8 pt -87.58 -14.88 9.75 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.61 0 O-C-N 121.529 -0.732 . . . . 0.0 109.64 179.766 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 25' ' ' ILE . . . . . . . . . . . . . 96.6 mt -77.84 -69.97 0.38 Allowed 'Isoleucine or valine' 0 N--CA 1.487 1.41 0 O-C-N 121.276 -0.89 . . . . 0.0 110.232 -179.086 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 72.4 ttt180 43.7 78.83 0.05 OUTLIER 'General case' 0 N--CA 1.498 1.953 0 CA-C-O 121.938 0.875 . . . . 0.0 110.042 -179.374 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 76.6 tt0 53.91 61.01 3.27 Favored 'General case' 0 N--CA 1.49 1.569 0 CA-C-O 121.693 0.759 . . . . 0.0 109.325 179.877 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . -95.18 110.65 4.06 Favored Glycine 0 N--CA 1.494 2.523 0 N-CA-C 109.682 -1.367 . . . . 0.0 109.682 179.941 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 29' ' ' ASP . . . . . 0.435 ' O ' ' O ' ' A' ' 30' ' ' ASP . 44.7 t0 40.29 71.55 0.18 Allowed 'General case' 0 N--CA 1.496 1.835 0 O-C-N 121.741 -0.858 . . . . 0.0 110.685 179.873 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 30' ' ' ASP . . . . . 0.435 ' O ' ' O ' ' A' ' 29' ' ' ASP . 26.2 t0 55.8 117.87 0.01 OUTLIER 'General case' 0 N--CA 1.495 1.792 0 CA-C-O 121.713 0.768 . . . . 0.0 110.716 179.503 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 31' ' ' VAL . . . . . 0.441 HG12 ' N ' ' A' ' 32' ' ' ALA . 20.4 t -125.69 160.98 31.42 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.768 0 O-C-N 121.601 -0.687 . . . . 0.0 109.728 -179.97 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 32' ' ' ALA . . . . . 0.608 ' CB ' ' HZ2' ' A' ' 88' ' ' LYS . . . -128.64 148.61 50.82 Favored 'General case' 0 N--CA 1.495 1.822 0 O-C-N 121.567 -0.708 . . . . 0.0 110.088 -179.555 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 81.1 tt0 -104.24 135.57 45.47 Favored 'General case' 0 N--CA 1.491 1.589 0 O-C-N 121.62 -0.675 . . . . 0.0 109.404 -179.894 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 34' ' ' VAL . . . . . . . . . . . . . 56.0 t -124.98 130.7 73.18 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.816 0 O-C-N 121.617 -0.677 . . . . 0.0 109.188 179.765 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 72.4 m -133.28 121.7 22.81 Favored 'General case' 0 N--CA 1.491 1.588 0 N-CA-C 109.006 -0.739 . . . . 0.0 109.006 179.527 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 50.3 tp -122.03 137.65 54.73 Favored 'General case' 0 N--CA 1.496 1.833 0 CA-C-O 121.416 0.627 . . . . 0.0 109.36 -179.986 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 37' ' ' PHE . . . . . . . . . . . . . 97.0 m-85 -102.92 148.02 26.19 Favored 'General case' 0 N--CA 1.492 1.65 0 O-C-N 121.51 -0.744 . . . . 0.0 109.443 -179.863 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . -170.05 -172.14 36.25 Favored Glycine 0 N--CA 1.49 2.251 0 N-CA-C 109.923 -1.271 . . . . 0.0 109.923 -179.78 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 39' ' ' SER . . . . . 0.505 ' OG ' ' N ' ' A' ' 40' ' ' ASP . 91.9 p -106.55 -82.71 0.54 Allowed 'General case' 0 N--CA 1.497 1.885 0 O-C-N 121.331 -1.1 . . . . 0.0 109.942 -179.774 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 40' ' ' ASP . . . . . 0.505 ' N ' ' OG ' ' A' ' 39' ' ' SER . 30.6 t70 -83.9 161.18 20.93 Favored 'General case' 0 N--CA 1.492 1.639 0 O-C-N 121.248 -0.907 . . . . 0.0 110.773 -179.018 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 65.7 tttm -64.72 -37.05 86.27 Favored 'General case' 0 N--CA 1.492 1.63 0 O-C-N 121.512 -0.742 . . . . 0.0 109.969 179.59 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -56.36 -40.52 74.65 Favored 'General case' 0 N--CA 1.492 1.646 0 O-C-N 121.284 -0.885 . . . . 0.0 110.016 -179.202 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 43' ' ' HIS . . . . . . . . . . . . . 68.2 m80 -66.63 -41.36 88.42 Favored 'General case' 0 N--CA 1.49 1.56 0 O-C-N 121.208 -0.932 . . . . 0.0 109.686 -179.921 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 89.0 mt -63.95 -41.56 97.56 Favored 'General case' 0 N--CA 1.494 1.774 0 O-C-N 121.308 -0.87 . . . . 0.0 109.556 179.944 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 80.6 mm-40 -61.47 -42.06 98.2 Favored 'General case' 0 C--N 1.302 -1.492 0 O-C-N 121.347 -0.845 . . . . 0.0 109.432 -179.696 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . -63.05 -50.76 60.68 Favored Glycine 0 N--CA 1.492 2.414 0 N-CA-C 109.691 -1.363 . . . . 0.0 109.691 -179.655 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 64.7 mttp -65.64 -35.98 82.36 Favored 'General case' 0 N--CA 1.492 1.665 0 O-C-N 121.348 -1.09 . . . . 0.0 109.415 179.545 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 48' ' ' LEU . . . . . 0.501 HD13 ' CD2' ' A' ' 76' ' ' LEU . 53.8 tp -59.6 -38.68 81.88 Favored 'General case' 0 N--CA 1.493 1.714 0 O-C-N 121.538 -0.726 . . . . 0.0 109.498 -179.259 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 49' ' ' ALA . . . . . . . . . . . . . . . -53.15 -32.59 48.44 Favored 'General case' 0 N--CA 1.49 1.556 0 O-C-N 121.177 -0.952 . . . . 0.0 109.789 -179.434 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 73.6 mm-40 -65.31 -40.11 93.33 Favored 'General case' 0 N--CA 1.492 1.645 0 O-C-N 121.203 -0.936 . . . . 0.0 109.423 -179.882 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 51' ' ' TYR . . . . . 0.494 ' CE2' ' CG2' ' A' ' 95' ' ' THR . 31.6 m-85 -62.92 -41.68 99.54 Favored 'General case' 0 N--CA 1.49 1.573 0 O-C-N 121.326 -0.859 . . . . 0.0 109.931 -179.758 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 52' ' ' ILE . . . . . 0.473 HD12 ' CZ ' ' A' ' 64' ' ' TYR . 34.6 mm -63.98 -44.95 98.01 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.641 0 O-C-N 121.14 -0.975 . . . . 0.0 109.482 -179.35 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 76.1 p -65.81 -44.61 85.11 Favored 'General case' 0 N--CA 1.491 1.611 0 O-C-N 121.166 -0.959 . . . . 0.0 110.153 -179.706 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 54' ' ' LEU . . . . . . . . . . . . . 85.2 mt -65.43 -42.23 92.68 Favored 'General case' 0 N--CA 1.493 1.703 0 O-C-N 121.24 -0.913 . . . . 0.0 109.943 -179.636 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -61.16 -49.76 75.92 Favored 'General case' 0 N--CA 1.492 1.648 0 O-C-N 121.408 -0.808 . . . . 0.0 110.702 -178.893 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 56' ' ' LYS . . . . . . . . . . . . . 98.5 mttt -65.11 -43.87 90.58 Favored 'General case' 0 N--CA 1.492 1.627 0 O-C-N 121.188 -0.945 . . . . 0.0 110.056 -179.361 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 59.2 tt0 -65.94 -47.21 75.43 Favored 'General case' 0 N--CA 1.491 1.597 0 O-C-N 121.334 -0.854 . . . . 0.0 109.328 -179.9 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 58' ' ' VAL . . . . . . . . . . . . . 54.6 t -64.97 -45.42 94.73 Favored 'Isoleucine or valine' 0 C--N 1.302 -1.492 0 O-C-N 121.45 -0.781 . . . . 0.0 109.94 -179.926 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 59' ' ' TYR . . . . . . . . . . . . . 54.9 t80 -131.91 124.04 28.66 Favored 'General case' 0 N--CA 1.498 1.964 0 O-C-N 121.365 -0.834 . . . . 0.0 110.042 -179.204 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 60' ' ' ALA . . . . . 0.42 ' O ' ' OD1' ' A' ' 61' ' ' ASN . . . -66.43 148.38 51.96 Favored 'General case' 0 N--CA 1.491 1.59 0 O-C-N 121.688 -0.633 . . . . 0.0 110.902 -179.601 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 61' ' ' ASN . . . . . 0.42 ' OD1' ' O ' ' A' ' 60' ' ' ALA . 7.6 p-10 44.61 52.65 7.59 Favored 'General case' 0 N--CA 1.496 1.829 0 CA-C-O 121.717 0.77 . . . . 0.0 109.425 179.722 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 62' ' ' VAL . . . . . . . . . . . . . 15.0 p -79.09 140.22 17.18 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.499 0 O-C-N 121.635 -0.666 . . . . 0.0 109.911 -179.776 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 96.7 mt-10 -110.1 132.47 54.13 Favored 'General case' 0 N--CA 1.494 1.756 0 CA-C-O 121.58 0.705 . . . . 0.0 109.563 -179.57 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 64' ' ' TYR . . . . . 0.473 ' CZ ' HD12 ' A' ' 52' ' ' ILE . 53.0 p90 -147.99 164.53 33.49 Favored 'General case' 0 N--CA 1.489 1.476 0 O-C-N 121.378 -0.826 . . . . 0.0 109.52 -179.847 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 95.7 mt-10 -139.31 151.95 46.83 Favored 'General case' 0 N--CA 1.492 1.626 0 O-C-N 121.451 -0.781 . . . . 0.0 109.273 179.893 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 66' ' ' VAL . . . . . . . . . . . . . 3.1 p -123.91 130.55 73.84 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.768 0 CA-C-O 121.537 0.684 . . . . 0.0 109.657 -179.493 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 67' ' ' ALA . . . . . 0.609 ' HB1' ' HD2' ' A' ' 68' ' ' PRO . . . -76.7 172.35 9.87 Favored Pre-proline 0 C--N 1.303 -1.448 0 O-C-N 121.683 -0.636 . . . . 0.0 109.68 -179.85 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 68' ' ' PRO . . . . . 0.609 ' HD2' ' HB1' ' A' ' 67' ' ' ALA . 52.5 Cg_exo -54.8 139.07 77.85 Favored 'Trans proline' 0 N--CA 1.498 1.781 0 C-N-CA 122.57 2.18 . . . . 0.0 112.427 179.934 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 69' ' ' VAL . . . . . . . . . . . . . 60.1 t -128.96 132.32 67.46 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.924 0 O-C-N 121.593 -0.692 . . . . 0.0 109.572 179.702 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -87.02 163.49 17.02 Favored 'General case' 0 N--CA 1.489 1.503 0 O-C-N 121.413 -0.804 . . . . 0.0 109.881 -179.968 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 75.4 m-20 -63.25 -40.86 98.6 Favored 'General case' 0 N--CA 1.491 1.59 0 O-C-N 121.385 -0.822 . . . . 0.0 109.543 -179.917 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 72' ' ' ASN . . . . . . . . . . . . . 98.8 m-20 -99.31 19.35 15.62 Favored 'General case' 0 N--CA 1.493 1.71 0 O-C-N 121.423 -0.798 . . . . 0.0 109.372 -179.289 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -54.18 139.35 35.89 Favored 'General case' 0 N--CA 1.491 1.614 0 O-C-N 121.252 -0.905 . . . . 0.0 110.05 -179.279 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 74' ' ' THR . . . . . . . . . . . . . 81.6 p -107.78 -0.98 21.33 Favored 'General case' 0 N--CA 1.494 1.735 0 N-CA-C 108.879 -0.786 . . . . 0.0 108.879 179.6 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 17.3 pt-20 -141.99 160.04 41.02 Favored 'General case' 0 N--CA 1.495 1.813 0 O-C-N 121.208 -0.933 . . . . 0.0 109.34 179.327 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 76' ' ' LEU . . . . . 0.501 ' CD2' HD13 ' A' ' 48' ' ' LEU . 6.6 tp -130.02 130.43 44.96 Favored 'General case' 0 N--CA 1.492 1.657 0 N-CA-C 109.054 -0.721 . . . . 0.0 109.054 179.617 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 77' ' ' HIS . . . . . . . . . . . . . 59.0 t-80 -114.53 113.71 24.79 Favored 'General case' 0 N--CA 1.493 1.676 0 N-CA-C 109.043 -0.725 . . . . 0.0 109.043 179.912 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -135.95 159.37 41.88 Favored 'General case' 0 N--CA 1.493 1.698 0 O-C-N 121.427 -0.796 . . . . 0.0 109.328 -179.778 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 15.9 tpp180 -127.86 141.2 51.62 Favored 'General case' 0 N--CA 1.492 1.641 0 N-CA-C 109.243 -0.651 . . . . 0.0 109.243 -179.764 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 80' ' ' PHE . . . . . . . . . . . . . 52.8 m-85 -126.08 146.62 49.85 Favored 'General case' 0 N--CA 1.494 1.728 0 CA-C-O 121.448 0.642 . . . . 0.0 109.414 -179.883 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 3.3 ttmp? -109.35 127.58 54.44 Favored 'General case' 0 N--CA 1.49 1.53 0 O-C-N 121.753 -0.592 . . . . 0.0 109.551 -179.772 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 82' ' ' PHE . . . . . . . . . . . . . 70.5 m-85 -125.02 147.03 49.15 Favored 'General case' 0 N--CA 1.491 1.616 0 CA-C-O 121.531 0.681 . . . . 0.0 109.607 -179.75 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 83.9 tt0 -67.45 -37.14 82.51 Favored 'General case' 0 C--N 1.302 -1.498 0 O-C-N 121.525 -0.734 . . . . 0.0 109.738 -179.909 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 84' ' ' VAL . . . . . . . . . . . . . 30.1 m -137.02 162.5 34.12 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.876 0 O-C-N 121.258 -0.901 . . . . 0.0 110.467 -179.306 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 74.9 p -69.97 -16.05 63.13 Favored 'General case' 0 N--CA 1.49 1.555 0 O-C-N 121.783 -0.573 . . . . 0.0 110.036 179.747 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 86' ' ' ALA . . . . . . . . . . . . . . . -62.78 -40.85 98.57 Favored 'General case' 0 N--CA 1.495 1.825 0 O-C-N 121.108 -0.995 . . . . 0.0 109.735 -179.623 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 87' ' ' GLU . . . . . 0.53 ' OE1' ' N ' ' A' ' 87' ' ' GLU . 4.9 mp0 -70.2 -30.48 67.6 Favored 'General case' 0 N--CA 1.491 1.624 0 O-C-N 121.411 -0.806 . . . . 0.0 108.848 179.883 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 88' ' ' LYS . . . . . 0.608 ' HZ2' ' CB ' ' A' ' 32' ' ' ALA . 64.6 tttp -62.62 -47.49 83.53 Favored 'General case' 0 C--N 1.3 -1.567 0 O-C-N 121.221 -0.924 . . . . 0.0 109.314 -179.956 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 48.3 tp -64.71 -47.45 78.25 Favored 'General case' 0 N--CA 1.49 1.55 0 O-C-N 121.312 -0.867 . . . . 0.0 109.857 -179.38 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 90' ' ' ILE . . . . . . . . . . . . . 97.0 mt -66.58 -45.07 89.54 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.734 0 O-C-N 121.236 -0.915 . . . . 0.0 109.674 -179.533 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 91' ' ' PHE . . . . . . . . . . . . . 91.2 t80 -64.45 -45.35 87.83 Favored 'General case' 0 N--CA 1.491 1.588 0 O-C-N 121.581 -0.7 . . . . 0.0 110.021 -179.587 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 92' ' ' GLU . . . . . . . . . . . . . 47.1 tp10 -66.25 -37.37 85.34 Favored 'General case' 0 N--CA 1.49 1.544 0 O-C-N 121.334 -0.854 . . . . 0.0 109.63 -179.225 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 93' ' ' LEU . . . . . . . . . . . . . 6.2 tt -62.73 -44.26 96.66 Favored 'General case' 0 C--N 1.3 -1.561 0 O-C-N 121.219 -0.925 . . . . 0.0 109.819 -179.582 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 94' ' ' LYS . . . . . . . . . . . . . 68.0 mttm -65.29 -42.88 92.67 Favored 'General case' 0 N--CA 1.491 1.588 0 O-C-N 121.334 -0.853 . . . . 0.0 110.238 -179.633 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 95' ' ' THR . . . . . 0.494 ' CG2' ' CE2' ' A' ' 51' ' ' TYR . 19.7 p -65.2 -44.23 89.03 Favored 'General case' 0 N--CA 1.492 1.657 0 O-C-N 121.39 -0.819 . . . . 0.0 110.367 -179.048 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 96' ' ' ARG . . . . . 0.45 HH21 ' NH1' ' A' ' 100' ' ' ARG . 83.3 mtp180 -64.4 -39.53 94.03 Favored 'General case' 0 N--CA 1.491 1.597 0 O-C-N 121.176 -0.953 . . . . 0.0 109.659 -179.796 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 97' ' ' ALA . . . . . . . . . . . . . . . -61.65 -49.23 77.36 Favored 'General case' 0 N--CA 1.49 1.545 0 O-C-N 121.291 -0.88 . . . . 0.0 109.911 -179.687 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 98' ' ' LEU . . . . . . . . . . . . . 93.8 mt -65.48 -42.82 91.78 Favored 'General case' 0 N--CA 1.493 1.684 0 O-C-N 121.324 -0.86 . . . . 0.0 109.623 -179.831 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 99' ' ' ALA . . . . . . . . . . . . . . . -66.55 -37.53 85.17 Favored 'General case' 0 N--CA 1.491 1.576 0 O-C-N 121.416 -0.802 . . . . 0.0 109.673 -179.697 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 100' ' ' ARG . . . . . 0.45 ' NH1' HH21 ' A' ' 96' ' ' ARG . 96.6 mtt180 -90.96 1.89 56.68 Favored 'General case' 0 N--CA 1.492 1.63 0 N-CA-C 108.691 -0.855 . . . . 0.0 108.691 -179.769 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 101' ' ' LEU . . . . . . . . . . . . . 85.4 mt 58.29 179.98 0.07 Allowed 'General case' 0 N--CA 1.497 1.921 0 CA-C-O 121.733 0.777 . . . . 0.0 111.022 179.431 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 102' ' ' GLU . . . . . . . . . . . . . 12.7 pt-20 -172.21 134.84 0.73 Allowed 'General case' 0 N--CA 1.488 1.462 0 O-C-N 121.533 -0.729 . . . . 0.0 109.613 -179.908 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 103' ' ' HIS . . . . . . . . . . . . . 80.5 t60 -69.05 130.16 41.97 Favored 'General case' 0 N--CA 1.489 1.514 0 O-C-N 121.536 -0.728 . . . . 0.0 110.298 -179.051 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 104' ' ' HIS . . . . . . . . . . . . . 81.8 t60 -148.86 138.54 21.95 Favored 'General case' 0 N--CA 1.49 1.572 0 O-C-N 121.214 -0.929 . . . . 0.0 109.606 179.681 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 105' ' ' HIS . . . . . . . . . . . . . 80.5 m80 -87.47 120.09 28.42 Favored 'General case' 0 N--CA 1.489 1.48 0 O-C-N 121.395 -0.816 . . . . 0.0 109.786 -179.783 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 106' ' ' HIS . . . . . . . . . . . . . 85.1 t60 -66.16 -40.63 90.68 Favored 'General case' 0 N--CA 1.488 1.439 0 O-C-N 121.462 -0.774 . . . . 0.0 109.39 179.751 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 107' ' ' HIS . . . . . . . . . . . . . 81.9 t60 45.1 87.48 0.02 OUTLIER 'General case' 0 N--CA 1.492 1.631 0 CA-C-O 121.727 0.775 . . . . 0.0 109.883 -179.625 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 108' ' ' HIS . . . . . . . . . . . . . 58.9 t-80 . . . . . 0 N--CA 1.489 1.51 0 CA-C-O 117.998 -1.001 . . . . 0.0 109.959 -179.96 . . . . . . . . 0 0 . 1 . 019 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 85.0 mmm . . . . . 0 N--CA 1.489 1.476 0 N-CA-C 109.143 -0.688 . . . . 0.0 109.143 . . . . . . . . . 0 0 . 1 . 019 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 19.5 m -71.09 146.15 49.42 Favored 'General case' 0 N--CA 1.492 1.633 0 O-C-N 121.443 -0.786 . . . . 0.0 110.142 -179.804 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 3' ' ' ASN . . . . . . . . . . . . . 25.2 t-20 -92.29 107.08 18.95 Favored 'General case' 0 N--CA 1.492 1.625 0 O-C-N 121.422 -0.799 . . . . 0.0 109.831 -179.745 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 99.6 mm-40 -84.86 -81.26 0.19 Allowed 'General case' 0 N--CA 1.49 1.571 0 O-C-N 121.525 -0.735 . . . . 0.0 109.777 179.946 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 68.9 p -82.64 163.22 21.55 Favored 'General case' 0 N--CA 1.494 1.745 0 O-C-N 121.409 -0.807 . . . . 0.0 110.606 -179.102 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 8.1 t -83.52 114.96 21.86 Favored 'General case' 0 N--CA 1.49 1.535 0 CA-C-O 121.808 0.813 . . . . 0.0 109.844 -179.763 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 7' ' ' VAL . . . . . . . . . . . . . 70.9 t -66.73 -43.25 90.14 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.675 0 O-C-N 121.56 -0.712 . . . . 0.0 109.583 179.701 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 96.3 mt-10 -65.91 142.22 57.97 Favored 'General case' 0 N--CA 1.493 1.678 0 O-C-N 121.218 -0.926 . . . . 0.0 110.547 -179.032 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 52.1 p-10 -87.55 -3.35 58.99 Favored 'General case' 0 N--CA 1.49 1.568 0 O-C-N 121.421 -0.8 . . . . 0.0 109.271 179.863 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 52.8 tp10 -87.22 119.01 27.01 Favored 'General case' 0 N--CA 1.49 1.571 0 O-C-N 121.244 -0.91 . . . . 0.0 109.593 -179.821 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 9.0 p -153.3 -21.57 0.06 OUTLIER 'Isoleucine or valine' 0 N--CA 1.49 1.555 0 N-CA-C 108.694 -0.854 . . . . 0.0 108.694 179.728 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 35.1 m -89.98 107.73 19.29 Favored 'General case' 0 N--CA 1.494 1.761 0 O-C-N 121.38 -0.825 . . . . 0.0 109.777 -179.68 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 43.7 tt0 -174.07 -42.22 0.01 OUTLIER 'General case' 0 N--CA 1.49 1.571 0 N-CA-C 108.594 -0.891 . . . . 0.0 108.594 179.98 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 14' ' ' ALA . . . . . 0.555 ' O ' ' N ' ' A' ' 16' ' ' GLY . . . -176.7 147.48 0.63 Allowed 'General case' 0 N--CA 1.493 1.696 0 O-C-N 121.185 -0.947 . . . . 0.0 110.012 179.723 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 63.2 m 44.61 -88.1 0.01 OUTLIER 'General case' 0 N--CA 1.496 1.831 0 CA-C-O 121.426 0.631 . . . . 0.0 110.054 -179.715 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 16' ' ' GLY . . . . . 0.555 ' N ' ' O ' ' A' ' 14' ' ' ALA . . . 81.17 16.31 74.72 Favored Glycine 0 N--CA 1.492 2.402 0 N-CA-C 109.833 -1.307 . . . . 0.0 109.833 -179.917 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 1.2 p -65.42 -35.57 81.33 Favored 'General case' 0 N--CA 1.493 1.706 0 O-C-N 121.218 -1.166 . . . . 0.0 109.473 179.828 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . 52.03 16.92 0.59 Allowed 'General case' 0 N--CA 1.493 1.72 0 O-C-N 121.349 -0.844 . . . . 0.0 109.729 -179.588 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -177.1 139.53 4.44 Favored Glycine 0 N--CA 1.492 2.401 0 C-N-CA 119.937 -1.125 . . . . 0.0 110.393 179.608 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 79.6 tt0 58.32 101.5 0.02 OUTLIER 'General case' 0 N--CA 1.499 1.983 0 O-C-N 121.666 -0.902 . . . . 0.0 110.505 179.654 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 21' ' ' ILE . . . . . 0.408 HG23 ' O ' ' A' ' 21' ' ' ILE . 9.3 tp -89.28 130.99 37.71 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.501 0 O-C-N 121.243 -0.91 . . . . 0.0 110.412 -179.648 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 176.86 -172.76 45.72 Favored Glycine 0 N--CA 1.489 2.209 0 N-CA-C 109.962 -1.255 . . . . 0.0 109.962 179.467 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 23' ' ' PHE . . . . . . . . . . . . . 65.2 m-85 -110.54 132.19 54.4 Favored 'General case' 0 N--CA 1.498 1.957 0 O-C-N 121.508 -0.995 . . . . 0.0 109.469 -179.978 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 35.3 mm -66.23 -43.29 91.88 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.628 0 O-C-N 121.525 -0.734 . . . . 0.0 109.758 -179.751 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 25' ' ' ILE . . . . . 0.415 HG22 ' N ' ' A' ' 26' ' ' ARG . 90.0 mt -92.87 -91.85 0.08 OUTLIER 'Isoleucine or valine' 0 N--CA 1.497 1.916 0 O-C-N 120.894 -1.129 . . . . 0.0 110.277 -179.507 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 26' ' ' ARG . . . . . 0.415 ' N ' HG22 ' A' ' 25' ' ' ILE . 79.0 ttt-85 46.27 81.22 0.04 OUTLIER 'General case' 0 N--CA 1.49 1.554 0 CA-C-O 121.8 0.81 . . . . 0.0 109.774 -179.118 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 79.4 mm-40 -139.73 -164.35 1.67 Allowed 'General case' 0 N--CA 1.493 1.715 0 O-C-N 121.489 -0.757 . . . . 0.0 109.574 179.92 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . -154.56 -39.72 0.02 OUTLIER Glycine 0 N--CA 1.49 2.28 0 N-CA-C 109.133 -1.587 . . . . 0.0 109.133 -179.663 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 59.0 t0 -63.71 -50.76 67.91 Favored 'General case' 0 N--CA 1.496 1.874 0 O-C-N 121.349 -1.089 . . . . 0.0 110.233 -179.936 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 88.4 m-20 -98.8 1.12 45.61 Favored 'General case' 0 N--CA 1.497 1.9 0 O-C-N 121.016 -1.053 . . . . 0.0 109.03 179.725 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 52.0 t -124.61 134.77 65.9 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.934 0 O-C-N 121.482 -0.761 . . . . 0.0 109.324 -179.946 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -110.14 154.93 22.62 Favored 'General case' 0 N--CA 1.495 1.805 0 CA-C-O 121.695 0.76 . . . . 0.0 109.515 -179.946 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 95.8 mt-10 -87.68 126.48 34.99 Favored 'General case' 0 N--CA 1.489 1.518 0 CA-C-O 121.585 0.707 . . . . 0.0 109.653 -179.621 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 34' ' ' VAL . . . . . . . . . . . . . 53.7 t -124.99 134.99 65.52 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.712 0 CA-C-O 121.748 0.785 . . . . 0.0 109.198 -179.626 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 6.0 p -134.81 140.49 45.91 Favored 'General case' 0 N--CA 1.491 1.58 0 N-CA-C 108.89 -0.781 . . . . 0.0 108.89 179.878 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 36' ' ' LEU . . . . . 0.64 HD13 ' N ' ' A' ' 37' ' ' PHE . 0.2 OUTLIER -121.0 124.04 43.89 Favored 'General case' 0 N--CA 1.494 1.761 0 CA-C-O 121.709 0.766 . . . . 0.0 109.131 -179.662 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 37' ' ' PHE . . . . . 0.64 ' N ' HD13 ' A' ' 36' ' ' LEU . 92.5 m-85 -99.79 146.02 27.05 Favored 'General case' 0 N--CA 1.492 1.656 0 O-C-N 121.506 -0.746 . . . . 0.0 109.777 179.872 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . -178.84 -169.31 39.3 Favored Glycine 0 N--CA 1.489 2.171 0 N-CA-C 109.837 -1.305 . . . . 0.0 109.837 -179.975 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 39' ' ' SER . . . . . 0.494 ' OG ' ' N ' ' A' ' 40' ' ' ASP . 3.0 t -82.23 -99.37 0.04 OUTLIER 'General case' 0 N--CA 1.491 1.606 0 O-C-N 121.634 -0.921 . . . . 0.0 109.91 -179.939 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 40' ' ' ASP . . . . . 0.494 ' N ' ' OG ' ' A' ' 39' ' ' SER . 97.4 m-20 -83.6 178.03 8.15 Favored 'General case' 0 N--CA 1.495 1.811 0 O-C-N 121.165 -0.959 . . . . 0.0 110.696 -179.464 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 87.9 tttt -63.62 -33.14 74.95 Favored 'General case' 0 N--CA 1.493 1.676 0 CA-C-O 121.404 0.621 . . . . 0.0 110.092 -179.795 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -60.53 -38.59 84.94 Favored 'General case' 0 N--CA 1.492 1.663 0 O-C-N 121.161 -0.962 . . . . 0.0 109.725 -179.533 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 43' ' ' HIS . . . . . . . . . . . . . 83.6 m-70 -68.43 -37.38 80.23 Favored 'General case' 0 N--CA 1.492 1.671 0 O-C-N 121.313 -0.867 . . . . 0.0 109.931 179.868 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 97.0 mt -63.61 -42.23 98.23 Favored 'General case' 0 N--CA 1.493 1.724 0 O-C-N 121.514 -0.741 . . . . 0.0 110.27 -178.953 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 98.0 mt-10 -69.69 -38.53 77.03 Favored 'General case' 0 C--N 1.299 -1.607 0 O-C-N 121.205 -0.934 . . . . 0.0 109.637 -179.852 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 46' ' ' GLY . . . . . 0.441 ' O ' ' OE1' ' A' ' 50' ' ' GLU . . . -62.78 -40.85 99.73 Favored Glycine 0 N--CA 1.493 2.435 0 N-CA-C 110.178 -1.169 . . . . 0.0 110.178 -179.644 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 56.7 mtpt -81.29 -21.75 39.1 Favored 'General case' 0 N--CA 1.489 1.485 0 O-C-N 121.365 -1.08 . . . . 0.0 109.316 179.905 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 57.6 tp -65.89 -38.15 88.0 Favored 'General case' 0 N--CA 1.492 1.668 0 O-C-N 121.542 -0.724 . . . . 0.0 109.787 179.838 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 49' ' ' ALA . . . . . . . . . . . . . . . -56.96 -34.74 68.35 Favored 'General case' 0 N--CA 1.493 1.725 0 O-C-N 121.359 -0.838 . . . . 0.0 109.861 -179.179 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 50' ' ' GLU . . . . . 0.564 ' OE1' ' N ' ' A' ' 50' ' ' GLU . 51.8 mp0 -67.28 -40.78 86.19 Favored 'General case' 0 C--N 1.299 -1.609 0 O-C-N 121.348 -0.845 . . . . 0.0 109.549 -179.909 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 51' ' ' TYR . . . . . 0.416 ' CZ ' ' CD2' ' A' ' 36' ' ' LEU . 3.9 m-85 -60.24 -42.83 96.12 Favored 'General case' 0 N--CA 1.492 1.665 0 O-C-N 121.407 -0.808 . . . . 0.0 109.821 -179.642 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 52' ' ' ILE . . . . . . . . . . . . . 95.7 mt -64.13 -42.67 96.3 Favored 'Isoleucine or valine' 0 C--N 1.298 -1.653 0 O-C-N 121.361 -0.837 . . . . 0.0 109.613 -179.676 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 48.4 m -52.92 -51.74 60.23 Favored 'General case' 0 N--CA 1.493 1.695 0 O-C-N 121.364 -0.835 . . . . 0.0 110.012 -178.951 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 54' ' ' LEU . . . . . 0.48 HD12 ' HD3' ' A' ' 94' ' ' LYS . 4.2 mm? -65.31 -40.74 94.14 Favored 'General case' 0 N--CA 1.493 1.713 0 O-C-N 121.255 -0.903 . . . . 0.0 110.076 179.807 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -64.73 -38.37 90.77 Favored 'General case' 0 C--N 1.3 -1.563 0 O-C-N 121.373 -0.83 . . . . 0.0 110.08 -179.336 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 56' ' ' LYS . . . . . . . . . . . . . 45.4 tttp -63.77 -42.74 97.72 Favored 'General case' 0 N--CA 1.489 1.521 0 O-C-N 121.283 -0.886 . . . . 0.0 109.68 -179.683 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 77.0 mt-30 -65.75 -43.71 88.13 Favored 'General case' 0 N--CA 1.494 1.745 0 O-C-N 121.37 -0.831 . . . . 0.0 109.687 -179.765 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 58' ' ' VAL . . . . . . . . . . . . . 79.7 t -65.33 -44.74 94.7 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.675 0 O-C-N 121.383 -0.823 . . . . 0.0 109.518 -179.948 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 59' ' ' TYR . . . . . 0.425 ' O ' ' O ' ' A' ' 60' ' ' ALA . 62.6 t80 -126.66 133.14 51.04 Favored 'General case' 0 N--CA 1.497 1.902 0 CA-C-O 121.866 0.841 . . . . 0.0 109.406 -179.793 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 60' ' ' ALA . . . . . 0.425 ' O ' ' O ' ' A' ' 59' ' ' TYR . . . -44.43 -100.01 0.0 OUTLIER 'General case' 0 N--CA 1.493 1.679 0 CA-C-O 121.645 0.736 . . . . 0.0 111.129 -179.229 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 61' ' ' ASN . . . . . . . . . . . . . 10.4 m120 -87.11 90.29 8.3 Favored 'General case' 0 N--CA 1.491 1.59 0 O-C-N 121.334 -0.854 . . . . 0.0 109.351 -179.051 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 62' ' ' VAL . . . . . . . . . . . . . 11.0 p -80.15 136.68 22.93 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.552 0 O-C-N 121.571 -0.706 . . . . 0.0 109.768 -179.978 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 84.8 tt0 -113.64 138.39 50.26 Favored 'General case' 0 N--CA 1.495 1.784 0 CA-C-O 121.623 0.725 . . . . 0.0 109.178 -179.854 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 64' ' ' TYR . . . . . . . . . . . . . 50.7 p90 -148.36 162.64 39.14 Favored 'General case' 0 N--CA 1.491 1.614 0 O-C-N 121.413 -0.804 . . . . 0.0 109.962 -179.499 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 49.3 tp10 -139.69 145.73 38.75 Favored 'General case' 0 N--CA 1.493 1.686 0 N-CA-C 108.789 -0.819 . . . . 0.0 108.789 179.623 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 66' ' ' VAL . . . . . . . . . . . . . 27.2 m -115.52 128.03 72.88 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.764 0 CA-C-O 121.768 0.795 . . . . 0.0 110.018 -179.26 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 67' ' ' ALA . . . . . 0.652 ' HB1' ' HD2' ' A' ' 68' ' ' PRO . . . -80.15 171.82 11.41 Favored Pre-proline 0 N--CA 1.488 1.446 0 N-CA-C 109.569 -0.53 . . . . 0.0 109.569 -179.85 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 68' ' ' PRO . . . . . 0.652 ' HD2' ' HB1' ' A' ' 67' ' ' ALA . 51.0 Cg_exo -51.68 129.5 30.11 Favored 'Trans proline' 0 N--CA 1.494 1.54 0 C-N-CA 122.428 2.085 . . . . 0.0 112.309 179.624 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 69' ' ' VAL . . . . . 0.406 HG21 HD12 ' A' ' 76' ' ' LEU . 51.0 t -131.51 134.1 61.05 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.794 0 CA-C-O 121.803 0.811 . . . . 0.0 109.899 179.911 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -73.01 153.07 41.05 Favored 'General case' 0 N--CA 1.49 1.541 0 CA-C-O 121.735 0.779 . . . . 0.0 110.335 -179.992 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 64.6 t0 -63.6 -36.1 82.7 Favored 'General case' 0 N--CA 1.49 1.563 0 CA-C-O 121.591 0.71 . . . . 0.0 109.322 179.308 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 72' ' ' ASN . . . . . . . . . . . . . 56.5 p30 -95.43 19.1 11.39 Favored 'General case' 0 N--CA 1.493 1.709 0 O-C-N 121.266 -0.897 . . . . 0.0 108.722 179.849 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -64.26 143.86 57.57 Favored 'General case' 0 N--CA 1.49 1.538 0 O-C-N 121.435 -0.791 . . . . 0.0 110.358 -179.715 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 74' ' ' THR . . . . . . . . . . . . . 6.3 p -106.18 -0.62 24.45 Favored 'General case' 0 N--CA 1.492 1.673 0 N-CA-C 108.589 -0.893 . . . . 0.0 108.589 179.268 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 80.9 tt0 -141.74 154.42 45.26 Favored 'General case' 0 N--CA 1.494 1.746 0 O-C-N 121.222 -0.924 . . . . 0.0 109.379 179.884 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 76' ' ' LEU . . . . . 0.406 HD12 HG21 ' A' ' 69' ' ' VAL . 6.7 tp -117.03 131.89 56.83 Favored 'General case' 0 N--CA 1.493 1.699 0 O-C-N 121.569 -0.707 . . . . 0.0 109.512 -179.814 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 77' ' ' HIS . . . . . . . . . . . . . 7.4 t-160 -105.66 108.33 19.79 Favored 'General case' 0 N--CA 1.493 1.703 0 N-CA-C 109.062 -0.718 . . . . 0.0 109.062 179.846 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -147.01 159.35 43.68 Favored 'General case' 0 N--CA 1.492 1.653 0 O-C-N 121.353 -0.842 . . . . 0.0 109.596 -179.413 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 89.7 mtm-85 -131.8 148.95 52.59 Favored 'General case' 0 N--CA 1.496 1.846 0 O-C-N 121.639 -0.663 . . . . 0.0 109.356 -179.917 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 80' ' ' PHE . . . . . . . . . . . . . 28.3 m-85 -121.61 147.43 45.86 Favored 'General case' 0 N--CA 1.5 2.049 0 CA-C-O 121.669 0.747 . . . . 0.0 109.599 -179.802 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 64.2 tttp -109.26 114.02 27.35 Favored 'General case' 0 N--CA 1.491 1.618 0 CA-C-O 121.732 0.777 . . . . 0.0 109.37 179.903 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 82' ' ' PHE . . . . . . . . . . . . . 82.7 m-85 -100.98 -109.25 0.22 Allowed 'General case' 0 N--CA 1.494 1.725 0 CA-C-O 121.635 0.731 . . . . 0.0 109.561 -179.973 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 47.3 tp10 -168.78 -37.96 0.02 OUTLIER 'General case' 0 N--CA 1.489 1.493 0 N-CA-C 108.539 -0.912 . . . . 0.0 108.539 179.926 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 84' ' ' VAL . . . . . 0.426 HG23 ' H ' ' A' ' 87' ' ' GLU . 27.3 m -133.77 161.94 40.24 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.909 0 O-C-N 121.471 -0.768 . . . . 0.0 109.63 -179.998 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 15.5 m -72.9 -19.63 61.24 Favored 'General case' 0 N--CA 1.491 1.597 0 O-C-N 121.464 -0.773 . . . . 0.0 109.274 179.825 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 86' ' ' ALA . . . . . . . . . . . . . . . -63.43 -39.52 94.7 Favored 'General case' 0 N--CA 1.492 1.634 0 O-C-N 121.215 -0.928 . . . . 0.0 109.714 -179.98 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 87' ' ' GLU . . . . . 0.426 ' H ' HG23 ' A' ' 84' ' ' VAL . 97.0 mt-10 -71.01 -32.26 69.01 Favored 'General case' 0 N--CA 1.493 1.691 0 O-C-N 121.334 -0.854 . . . . 0.0 109.37 179.731 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 88' ' ' LYS . . . . . . . . . . . . . 14.4 tmtt? -62.18 -48.01 81.97 Favored 'General case' 0 C--N 1.302 -1.49 0 O-C-N 121.33 -0.856 . . . . 0.0 110.013 -179.803 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 94.0 mt -64.97 -42.94 94.12 Favored 'General case' 0 N--CA 1.492 1.659 0 O-C-N 121.338 -0.851 . . . . 0.0 109.372 -179.68 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 90' ' ' ILE . . . . . . . . . . . . . 95.1 mt -65.36 -45.45 93.19 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.645 0 CA-C-O 121.737 0.779 . . . . 0.0 109.512 -179.91 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 91' ' ' PHE . . . . . . . . . . . . . 80.9 t80 -66.0 -44.07 85.9 Favored 'General case' 0 N--CA 1.49 1.568 0 CA-C-O 121.724 0.773 . . . . 0.0 109.845 -179.909 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 92' ' ' GLU . . . . . . . . . . . . . 48.4 tp10 -59.97 -38.7 83.28 Favored 'General case' 0 N--CA 1.491 1.61 0 O-C-N 121.445 -0.785 . . . . 0.0 109.469 -179.163 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 93' ' ' LEU . . . . . . . . . . . . . 5.5 tt -63.53 -44.35 94.48 Favored 'General case' 0 C--N 1.297 -1.679 0 O-C-N 121.38 -0.825 . . . . 0.0 109.865 179.974 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 94' ' ' LYS . . . . . 0.48 ' HD3' HD12 ' A' ' 54' ' ' LEU . 62.5 mttp -65.7 -41.64 92.13 Favored 'General case' 0 N--CA 1.492 1.674 0 O-C-N 121.433 -0.792 . . . . 0.0 109.77 -179.878 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 23.4 p -66.59 -38.6 87.38 Favored 'General case' 0 N--CA 1.493 1.688 0 O-C-N 121.315 -0.866 . . . . 0.0 109.653 -179.782 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 96' ' ' ARG . . . . . . . . . . . . . 25.1 mmt180 -65.14 -40.97 95.13 Favored 'General case' 0 N--CA 1.492 1.663 0 O-C-N 121.227 -0.921 . . . . 0.0 109.935 179.739 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 97' ' ' ALA . . . . . 0.496 ' O ' ' N ' ' A' ' 101' ' ' LEU . . . -63.39 -48.56 77.38 Favored 'General case' 0 C--N 1.3 -1.578 0 O-C-N 121.323 -0.861 . . . . 0.0 109.839 -179.688 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 98' ' ' LEU . . . . . . . . . . . . . 95.6 mt -64.89 -42.68 94.59 Favored 'General case' 0 N--CA 1.493 1.682 0 O-C-N 121.496 -0.752 . . . . 0.0 109.796 -179.845 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 99' ' ' ALA . . . . . . . . . . . . . . . -67.57 -40.04 84.88 Favored 'General case' 0 N--CA 1.492 1.654 0 O-C-N 121.313 -0.867 . . . . 0.0 109.859 -179.873 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 100' ' ' ARG . . . . . . . . . . . . . 85.9 mmt-85 -90.67 -6.46 54.49 Favored 'General case' 0 N--CA 1.495 1.786 0 CA-C-O 121.889 0.852 . . . . 0.0 109.067 -179.539 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 101' ' ' LEU . . . . . 0.496 ' N ' ' O ' ' A' ' 97' ' ' ALA . 5.9 tp 59.34 153.69 0.02 OUTLIER 'General case' 0 C--N 1.296 -1.726 0 CA-C-O 121.794 0.807 . . . . 0.0 110.604 179.507 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 102' ' ' GLU . . . . . 0.441 ' O ' ' O ' ' A' ' 101' ' ' LEU . 79.8 mm-40 -43.23 167.99 0.0 OUTLIER 'General case' 0 N--CA 1.49 1.54 0 CA-C-O 121.728 0.775 . . . . 0.0 110.357 179.979 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 103' ' ' HIS . . . . . . . . . . . . . 21.2 m170 58.77 13.37 2.66 Favored 'General case' 0 N--CA 1.491 1.594 0 N-CA-C 108.889 -0.782 . . . . 0.0 108.889 -179.491 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 104' ' ' HIS . . . . . . . . . . . . . 92.8 m-70 44.79 55.15 6.19 Favored 'General case' 0 N--CA 1.493 1.72 0 O-C-N 121.413 -0.804 . . . . 0.0 109.918 179.887 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 105' ' ' HIS . . . . . . . . . . . . . 86.3 t60 42.21 89.68 0.01 OUTLIER 'General case' 0 N--CA 1.494 1.77 0 CA-C-O 121.644 0.735 . . . . 0.0 110.035 179.732 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 106' ' ' HIS . . . . . . . . . . . . . 56.8 p-80 -69.04 139.12 54.89 Favored 'General case' 0 N--CA 1.489 1.488 0 CA-C-O 121.789 0.804 . . . . 0.0 110.301 -179.431 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 107' ' ' HIS . . . . . . . . . . . . . 80.3 m80 -77.32 140.72 40.06 Favored 'General case' 0 N--CA 1.489 1.48 0 CA-C-O 121.686 0.755 . . . . 0.0 110.228 -179.392 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 108' ' ' HIS . . . . . . . . . . . . . 86.4 t60 . . . . . 0 N--CA 1.492 1.639 0 CA-C-O 117.91 -1.043 . . . . 0.0 110.45 -179.645 . . . . . . . . 0 0 . 1 . 020 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 78.1 mtm . . . . . 0 N--CA 1.489 1.504 0 CA-C-O 121.588 0.708 . . . . 0.0 109.738 . . . . . . . . . 0 0 . 1 . 020 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 4.6 t 57.03 57.43 4.61 Favored 'General case' 0 N--CA 1.492 1.665 0 CA-C-O 121.869 0.842 . . . . 0.0 109.402 179.99 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 3' ' ' ASN . . . . . . . . . . . . . 92.5 m-20 -85.61 107.44 17.52 Favored 'General case' 0 N--CA 1.494 1.751 0 O-C-N 121.39 -0.819 . . . . 0.0 109.629 179.998 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 99.4 mm-40 -84.04 -122.47 0.03 OUTLIER 'General case' 0 N--CA 1.491 1.622 0 O-C-N 121.387 -0.821 . . . . 0.0 110.083 -179.683 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 5' ' ' THR . . . . . 0.404 ' O ' ' O ' ' A' ' 6' ' ' CYS . 80.3 m -97.77 -17.15 19.54 Favored 'General case' 0 N--CA 1.494 1.734 0 O-C-N 121.351 -0.843 . . . . 0.0 109.488 -179.765 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 6' ' ' CYS . . . . . 0.404 ' O ' ' O ' ' A' ' 5' ' ' THR . 5.1 m 60.86 121.51 0.01 OUTLIER 'General case' 0 N--CA 1.494 1.755 0 O-C-N 121.377 -0.827 . . . . 0.0 110.141 179.953 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 7' ' ' VAL . . . . . . . . . . . . . 2.1 p -100.19 131.08 48.37 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.832 0 CA-C-O 121.86 0.838 . . . . 0.0 109.977 -179.359 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 8' ' ' GLU . . . . . 0.505 ' O ' ' ND2' ' A' ' 9' ' ' ASN . 15.7 pt-20 -70.2 145.76 51.21 Favored 'General case' 0 N--CA 1.492 1.63 0 CA-C-O 121.734 0.778 . . . . 0.0 110.715 -179.413 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 9' ' ' ASN . . . . . 0.505 ' ND2' ' O ' ' A' ' 8' ' ' GLU . 0.8 OUTLIER 43.65 34.89 0.9 Allowed 'General case' 0 N--CA 1.492 1.648 0 CA-C-O 122.01 0.91 . . . . 0.0 109.049 -179.859 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 97.2 mt-10 43.14 -166.54 0.01 OUTLIER 'General case' 0 N--CA 1.489 1.504 0 CA-C-O 121.717 0.77 . . . . 0.0 110.438 -179.97 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 11' ' ' VAL . . . . . 0.433 ' O ' HG12 ' A' ' 11' ' ' VAL . 46.2 t -77.58 -1.87 4.21 Favored 'Isoleucine or valine' 0 C--N 1.299 -1.595 0 O-C-N 121.38 -0.825 . . . . 0.0 109.009 -179.854 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 42.2 t 46.17 40.61 7.59 Favored 'General case' 0 N--CA 1.493 1.725 0 CA-C-O 121.848 0.832 . . . . 0.0 109.498 179.93 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 13' ' ' GLU . . . . . 0.424 ' CD ' ' N ' ' A' ' 14' ' ' ALA . 12.8 tm-20 -64.08 139.77 58.8 Favored 'General case' 0 N--CA 1.489 1.495 0 O-C-N 121.436 -0.79 . . . . 0.0 110.012 -179.905 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 14' ' ' ALA . . . . . 0.424 ' N ' ' CD ' ' A' ' 13' ' ' GLU . . . -159.83 2.21 0.08 Allowed 'General case' 0 C--N 1.3 -1.573 0 N-CA-C 108.645 -0.872 . . . . 0.0 108.645 179.763 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 97.1 m -66.79 -39.1 87.67 Favored 'General case' 0 N--CA 1.496 1.831 0 O-C-N 121.281 -0.887 . . . . 0.0 109.468 179.876 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . -71.31 141.42 32.46 Favored Glycine 0 N--CA 1.493 2.467 0 N-CA-C 110.399 -1.08 . . . . 0.0 110.399 -179.337 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 76.2 m -129.21 153.77 47.43 Favored 'General case' 0 N--CA 1.496 1.87 0 O-C-N 121.454 -1.027 . . . . 0.0 110.257 -179.921 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . 59.6 146.99 0.01 OUTLIER 'General case' 0 N--CA 1.493 1.678 0 CA-C-O 121.646 0.736 . . . . 0.0 110.652 179.589 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 169.86 -161.63 34.93 Favored Glycine 0 N--CA 1.489 2.202 0 C-N-CA 119.947 -1.121 . . . . 0.0 110.556 -179.967 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 20' ' ' GLU . . . . . 0.517 ' OE1' ' N ' ' A' ' 22' ' ' GLY . 2.6 pp20? -52.47 145.18 11.92 Favored 'General case' 0 N--CA 1.493 1.717 0 O-C-N 121.698 -0.884 . . . . 0.0 110.935 -179.092 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 21' ' ' ILE . . . . . . . . . . . . . 90.7 mt -65.11 -42.94 95.67 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.56 0 CA-C-O 121.683 0.754 . . . . 0.0 109.194 179.635 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 22' ' ' GLY . . . . . 0.517 ' N ' ' OE1' ' A' ' 20' ' ' GLU . . . 83.57 -150.99 27.48 Favored Glycine 0 N--CA 1.486 2.005 0 N-CA-C 110.545 -1.022 . . . . 0.0 110.545 179.512 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 23' ' ' PHE . . . . . . . . . . . . . 93.0 m-85 -72.63 151.5 42.27 Favored 'General case' 0 C--N 1.299 -1.624 0 O-C-N 121.697 -0.884 . . . . 0.0 110.093 -179.282 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 97.1 mt -63.48 -42.63 96.91 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.55 0 CA-C-O 121.682 0.753 . . . . 0.0 109.672 179.819 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 25' ' ' ILE . . . . . . . . . . . . . 65.2 mt -63.43 -42.26 95.63 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.651 0 O-C-N 121.293 -0.88 . . . . 0.0 109.556 -179.487 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 26' ' ' ARG . . . . . 0.411 ' O ' ' O ' ' A' ' 27' ' ' GLU . 33.1 ttm180 61.48 59.41 1.88 Allowed 'General case' 0 C--N 1.304 -1.388 0 CA-C-O 121.813 0.816 . . . . 0.0 109.585 -179.909 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 27' ' ' GLU . . . . . 0.411 ' O ' ' O ' ' A' ' 26' ' ' ARG . 82.9 tt0 39.98 93.48 0.01 OUTLIER 'General case' 0 N--CA 1.495 1.798 0 CA-C-O 121.771 0.796 . . . . 0.0 110.374 179.711 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 28' ' ' GLY . . . . . 0.521 ' O ' ' N ' ' A' ' 30' ' ' ASP . . . -84.91 49.2 4.2 Favored Glycine 0 N--CA 1.492 2.38 0 N-CA-C 109.712 -1.355 . . . . 0.0 109.712 -179.818 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 4.0 p-10 41.85 21.91 0.01 OUTLIER 'General case' 0 N--CA 1.497 1.924 0 O-C-N 121.722 -0.869 . . . . 0.0 110.0 179.804 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 30' ' ' ASP . . . . . 0.521 ' N ' ' O ' ' A' ' 28' ' ' GLY . 51.1 p30 -159.83 43.83 0.22 Allowed 'General case' 0 C--N 1.301 -1.501 0 O-C-N 121.336 -0.853 . . . . 0.0 109.18 179.692 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 52.6 t -122.7 135.83 61.48 Favored 'Isoleucine or valine' 0 N--CA 1.502 2.142 0 O-C-N 121.403 -0.811 . . . . 0.0 109.775 -179.609 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -113.83 151.73 31.67 Favored 'General case' 0 N--CA 1.496 1.856 0 CA-C-O 121.42 0.629 . . . . 0.0 109.601 -179.967 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 40.3 tt0 -109.04 145.62 35.29 Favored 'General case' 0 N--CA 1.496 1.867 0 CA-C-O 121.499 0.666 . . . . 0.0 110.266 -179.312 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 34' ' ' VAL . . . . . . . . . . . . . 55.5 t -124.46 131.95 72.03 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.887 0 CA-C-O 121.487 0.661 . . . . 0.0 109.435 179.96 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 56.8 m -108.33 121.83 45.72 Favored 'General case' 0 N--CA 1.496 1.836 0 N-CA-C 109.264 -0.643 . . . . 0.0 109.264 179.542 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 36' ' ' LEU . . . . . 0.445 HD13 ' CZ ' ' A' ' 51' ' ' TYR . 49.5 tp -121.98 135.77 54.88 Favored 'General case' 0 N--CA 1.495 1.793 0 CA-C-O 121.595 0.712 . . . . 0.0 109.656 179.856 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 37' ' ' PHE . . . . . . . . . . . . . 86.1 t80 -113.17 138.12 50.43 Favored 'General case' 0 N--CA 1.494 1.73 0 CA-C-O 121.578 0.704 . . . . 0.0 109.69 -179.851 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 38' ' ' GLY . . . . . 0.45 ' N ' HD21 ' A' ' 44' ' ' LEU . . . -169.11 -170.51 33.79 Favored Glycine 0 N--CA 1.489 2.189 0 N-CA-C 110.15 -1.18 . . . . 0.0 110.15 -179.849 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 32.8 p -82.36 -108.9 0.03 OUTLIER 'General case' 0 N--CA 1.491 1.585 0 O-C-N 121.677 -0.896 . . . . 0.0 110.104 -179.69 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 40' ' ' ASP . . . . . . . . . . . . . 99.4 m-20 -81.05 175.13 10.94 Favored 'General case' 0 N--CA 1.493 1.72 0 O-C-N 121.192 -0.943 . . . . 0.0 110.698 -179.352 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 88.6 tttt -62.71 -41.98 99.42 Favored 'General case' 0 N--CA 1.491 1.624 0 CA-C-O 121.527 0.679 . . . . 0.0 109.966 -179.892 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -54.01 -46.29 71.73 Favored 'General case' 0 N--CA 1.492 1.662 0 O-C-N 121.394 -0.816 . . . . 0.0 109.796 -179.451 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 43' ' ' HIS . . . . . 0.669 ' CE1' ' HZ3' ' A' ' 47' ' ' LYS . 82.9 t60 -66.67 -42.65 86.24 Favored 'General case' 0 N--CA 1.493 1.682 0 O-C-N 121.283 -0.885 . . . . 0.0 109.72 179.829 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 44' ' ' LEU . . . . . 0.45 HD21 ' N ' ' A' ' 38' ' ' GLY . 37.0 mt -63.29 -41.26 98.97 Favored 'General case' 0 N--CA 1.496 1.851 0 O-C-N 121.333 -0.855 . . . . 0.0 109.877 -179.94 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 66.0 mm-40 -62.46 -38.23 88.97 Favored 'General case' 0 N--CA 1.49 1.565 0 O-C-N 121.439 -0.788 . . . . 0.0 109.623 -179.775 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . -59.3 -53.91 42.27 Favored Glycine 0 N--CA 1.494 2.504 0 N-CA-C 109.519 -1.432 . . . . 0.0 109.519 -179.884 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 47' ' ' LYS . . . . . 0.669 ' HZ3' ' CE1' ' A' ' 43' ' ' HIS . 47.6 mttp -66.47 -37.63 85.54 Favored 'General case' 0 N--CA 1.493 1.683 0 O-C-N 121.456 -1.026 . . . . 0.0 109.605 179.02 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 49.0 tp -51.84 -34.07 38.85 Favored 'General case' 0 N--CA 1.494 1.746 0 CA-C-O 121.657 0.742 . . . . 0.0 109.681 -179.373 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 49' ' ' ALA . . . . . . . . . . . . . . . -56.37 -34.46 66.67 Favored 'General case' 0 N--CA 1.491 1.612 0 O-C-N 121.354 -0.841 . . . . 0.0 109.635 -179.698 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 80.5 mm-40 -66.46 -43.16 86.26 Favored 'General case' 0 N--CA 1.495 1.79 0 O-C-N 121.259 -0.9 . . . . 0.0 109.974 -179.923 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 51' ' ' TYR . . . . . 0.445 ' CZ ' HD13 ' A' ' 36' ' ' LEU . 64.0 m-85 -64.1 -44.53 92.02 Favored 'General case' 0 N--CA 1.495 1.816 0 O-C-N 121.325 -0.859 . . . . 0.0 109.872 -179.727 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 52' ' ' ILE . . . . . . . . . . . . . 96.4 mt -65.18 -43.75 95.45 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.732 0 O-C-N 121.287 -0.883 . . . . 0.0 109.677 -179.987 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 60.9 m -61.86 -41.14 97.48 Favored 'General case' 0 N--CA 1.493 1.697 0 O-C-N 121.293 -0.879 . . . . 0.0 109.729 -179.844 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 54' ' ' LEU . . . . . . . . . . . . . 46.6 tp -63.79 -40.98 97.97 Favored 'General case' 0 N--CA 1.491 1.605 0 O-C-N 121.248 -0.907 . . . . 0.0 109.643 -179.988 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -60.12 -40.65 90.46 Favored 'General case' 0 N--CA 1.491 1.604 0 O-C-N 121.378 -0.826 . . . . 0.0 109.392 -179.355 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 56' ' ' LYS . . . . . . . . . . . . . 98.4 mttt -65.19 -41.52 94.48 Favored 'General case' 0 N--CA 1.491 1.582 0 O-C-N 121.456 -0.777 . . . . 0.0 109.551 179.587 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 67.5 tp60 -65.21 -46.33 81.12 Favored 'General case' 0 N--CA 1.493 1.709 0 O-C-N 121.32 -0.862 . . . . 0.0 109.919 -179.399 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 58' ' ' VAL . . . . . . . . . . . . . 88.0 t -65.23 -43.87 95.25 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.572 0 O-C-N 121.199 -0.938 . . . . 0.0 109.118 -179.979 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 59' ' ' TYR . . . . . . . . . . . . . 45.1 t80 -138.54 117.99 12.9 Favored 'General case' 0 N--CA 1.496 1.865 0 O-C-N 121.433 -0.792 . . . . 0.0 109.545 -179.806 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -69.39 149.11 48.73 Favored 'General case' 0 N--CA 1.492 1.64 0 CA-C-O 121.714 0.768 . . . . 0.0 110.625 -179.615 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 61' ' ' ASN . . . . . . . . . . . . . 8.8 t-20 60.09 39.35 19.76 Favored 'General case' 0 N--CA 1.491 1.613 0 CA-C-O 121.779 0.8 . . . . 0.0 109.472 179.806 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 62' ' ' VAL . . . . . . . . . . . . . 14.1 p -76.67 139.15 19.3 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.762 0 O-C-N 121.438 -0.789 . . . . 0.0 110.523 -179.967 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 96.0 mt-10 -106.05 136.09 46.34 Favored 'General case' 0 N--CA 1.497 1.891 0 CA-C-O 121.756 0.789 . . . . 0.0 109.594 179.944 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 64' ' ' TYR . . . . . . . . . . . . . 50.4 p90 -151.03 162.98 39.82 Favored 'General case' 0 N--CA 1.49 1.54 0 O-C-N 121.458 -0.776 . . . . 0.0 109.681 -179.478 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 79.8 mm-40 -139.5 152.45 46.97 Favored 'General case' 0 N--CA 1.495 1.78 0 O-C-N 121.408 -0.808 . . . . 0.0 109.643 179.853 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 66' ' ' VAL . . . . . . . . . . . . . 53.8 t -113.44 129.87 68.45 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.75 0 CA-C-O 121.718 0.771 . . . . 0.0 109.218 -179.679 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 67' ' ' ALA . . . . . 0.454 ' HB1' ' HD2' ' A' ' 68' ' ' PRO . . . -77.06 168.88 24.37 Favored Pre-proline 0 C--N 1.302 -1.486 0 O-C-N 121.727 -0.608 . . . . 0.0 109.766 -179.55 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 68' ' ' PRO . . . . . 0.454 ' HD2' ' HB1' ' A' ' 67' ' ' ALA . 27.8 Cg_exo -59.04 143.25 99.88 Favored 'Trans proline' 0 N--CA 1.493 1.483 0 C-N-CA 122.371 2.047 . . . . 0.0 112.354 179.557 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 69' ' ' VAL . . . . . 0.51 ' C ' ' H ' ' A' ' 71' ' ' ASP . 47.2 t -120.99 132.58 70.12 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.74 0 CA-C-O 121.676 0.751 . . . . 0.0 109.589 -179.856 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 70' ' ' ALA . . . . . 0.62 ' O ' ' N ' ' A' ' 72' ' ' ASN . . . -74.42 30.49 0.08 Allowed 'General case' 0 N--CA 1.491 1.602 0 O-C-N 121.576 -0.703 . . . . 0.0 109.453 179.861 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 71' ' ' ASP . . . . . 0.51 ' H ' ' C ' ' A' ' 69' ' ' VAL . 25.0 t0 55.6 -71.74 0.01 OUTLIER 'General case' 0 N--CA 1.493 1.7 0 CA-C-O 121.625 0.726 . . . . 0.0 110.728 179.658 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 72' ' ' ASN . . . . . 0.62 ' N ' ' O ' ' A' ' 70' ' ' ALA . 64.3 t30 -75.51 -2.15 27.58 Favored 'General case' 0 C--N 1.299 -1.628 0 O-C-N 121.299 -0.876 . . . . 0.0 109.429 -179.723 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -43.95 146.84 0.55 Allowed 'General case' 0 N--CA 1.496 1.843 0 O-C-N 121.306 -0.871 . . . . 0.0 110.125 179.974 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 74' ' ' THR . . . . . . . . . . . . . 5.0 p -96.74 0.15 49.09 Favored 'General case' 0 N--CA 1.492 1.658 0 O-C-N 121.385 -0.822 . . . . 0.0 108.965 -179.922 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 21.6 pt-20 -144.78 156.63 44.15 Favored 'General case' 0 N--CA 1.495 1.782 0 O-C-N 121.133 -0.979 . . . . 0.0 109.862 179.855 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 6.8 tt -126.4 133.26 51.33 Favored 'General case' 0 N--CA 1.492 1.644 0 CA-C-O 121.62 0.724 . . . . 0.0 109.267 -180.0 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 77' ' ' HIS . . . . . . . . . . . . . 73.8 m80 -105.76 129.37 53.97 Favored 'General case' 0 N--CA 1.495 1.819 0 O-C-N 121.626 -0.671 . . . . 0.0 109.639 -179.664 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -140.75 155.87 46.32 Favored 'General case' 0 N--CA 1.494 1.775 0 O-C-N 121.359 -0.838 . . . . 0.0 109.787 -179.774 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 95.7 mtt180 -128.04 147.16 50.51 Favored 'General case' 0 N--CA 1.497 1.876 0 CA-C-O 121.402 0.62 . . . . 0.0 109.83 -179.716 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 80' ' ' PHE . . . . . . . . . . . . . 83.8 m-85 -127.96 148.04 50.5 Favored 'General case' 0 N--CA 1.496 1.871 0 CA-C-O 121.451 0.643 . . . . 0.0 109.568 -179.851 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 63.4 tttp -111.37 127.35 55.63 Favored 'General case' 0 N--CA 1.494 1.739 0 N-CA-C 109.207 -0.664 . . . . 0.0 109.207 179.94 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 82' ' ' PHE . . . . . . . . . . . . . 78.0 m-85 -122.54 145.04 48.69 Favored 'General case' 0 N--CA 1.494 1.746 0 CA-C-O 121.875 0.845 . . . . 0.0 109.649 -179.782 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 32.4 mm-40 -69.46 -32.76 71.89 Favored 'General case' 0 C--N 1.299 -1.608 0 O-C-N 121.751 -0.593 . . . . 0.0 109.638 -179.815 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 84' ' ' VAL . . . . . . . . . . . . . 3.2 m -130.61 157.28 42.98 Favored 'Isoleucine or valine' 0 N--CA 1.499 1.999 0 CA-C-O 121.915 0.864 . . . . 0.0 110.397 -179.427 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 85' ' ' SER . . . . . 0.497 ' O ' ' N ' ' A' ' 88' ' ' LYS . 38.9 t -67.63 -40.2 84.65 Favored 'General case' 0 N--CA 1.492 1.626 0 CA-C-O 121.535 0.683 . . . . 0.0 110.213 179.645 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 86' ' ' ALA . . . . . 0.423 ' C ' ' O ' ' A' ' 85' ' ' SER . . . -40.85 -44.24 2.22 Favored 'General case' 0 N--CA 1.496 1.845 0 O-C-N 121.397 -0.815 . . . . 0.0 110.356 -179.042 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 98.2 mt-10 -66.03 -30.14 70.63 Favored 'General case' 0 C--N 1.299 -1.62 0 O-C-N 121.279 -0.888 . . . . 0.0 110.08 179.895 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 88' ' ' LYS . . . . . 0.497 ' N ' ' O ' ' A' ' 85' ' ' SER . 65.0 tttp -63.38 -46.8 84.8 Favored 'General case' 0 N--CA 1.494 1.727 0 O-C-N 121.068 -1.02 . . . . 0.0 110.062 -179.904 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 89' ' ' LEU . . . . . 0.511 HD22 ' N ' ' A' ' 89' ' ' LEU . 3.6 mm? -63.37 -47.58 81.49 Favored 'General case' 0 N--CA 1.493 1.723 0 O-C-N 121.23 -0.919 . . . . 0.0 110.128 -179.2 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 90' ' ' ILE . . . . . 0.499 ' N ' HD12 ' A' ' 90' ' ' ILE . 1.3 mp -69.19 -43.69 81.3 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.636 0 O-C-N 121.271 -0.893 . . . . 0.0 109.521 179.634 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 91' ' ' PHE . . . . . . . . . . . . . 62.2 t80 -60.37 -46.41 90.04 Favored 'General case' 0 C--N 1.298 -1.651 0 O-C-N 121.456 -0.778 . . . . 0.0 109.869 -179.116 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 92' ' ' GLU . . . . . 0.495 ' OE2' ' NZ ' ' A' ' 88' ' ' LYS . 97.1 mt-10 -67.74 -37.95 82.85 Favored 'General case' 0 N--CA 1.49 1.561 0 O-C-N 121.395 -0.816 . . . . 0.0 109.998 179.903 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 93' ' ' LEU . . . . . . . . . . . . . 6.4 tt -64.05 -46.82 82.71 Favored 'General case' 0 N--CA 1.49 1.575 0 O-C-N 121.129 -0.982 . . . . 0.0 110.156 -179.708 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 94' ' ' LYS . . . . . . . . . . . . . 96.1 mttt -66.91 -45.45 77.89 Favored 'General case' 0 N--CA 1.495 1.794 0 O-C-N 121.383 -0.823 . . . . 0.0 110.2 179.996 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 21.5 p -67.44 -41.47 84.71 Favored 'General case' 0 N--CA 1.492 1.665 0 O-C-N 121.23 -0.919 . . . . 0.0 109.61 -179.698 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 96' ' ' ARG . . . . . 0.435 ' CG ' ' O ' ' A' ' 92' ' ' GLU . 8.0 mmp_? -64.38 -43.81 93.3 Favored 'General case' 0 N--CA 1.49 1.565 0 O-C-N 121.221 -0.924 . . . . 0.0 109.698 179.825 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 97' ' ' ALA . . . . . . . . . . . . . . . -69.49 -40.15 77.22 Favored 'General case' 0 C--N 1.3 -1.55 0 CA-C-O 121.771 0.796 . . . . 0.0 109.204 179.767 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 98' ' ' LEU . . . . . . . . . . . . . 7.0 tt -64.72 -42.22 95.41 Favored 'General case' 0 C--N 1.302 -1.485 0 O-C-N 121.329 -0.857 . . . . 0.0 109.147 179.597 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 99' ' ' ALA . . . . . . . . . . . . . . . -64.15 -37.28 86.87 Favored 'General case' 0 N--CA 1.491 1.583 0 CA-C-O 121.723 0.773 . . . . 0.0 109.092 179.814 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 100' ' ' ARG . . . . . 0.417 ' O ' ' O ' ' A' ' 101' ' ' LEU . 89.3 mtm180 -80.99 -15.4 56.31 Favored 'General case' 0 N--CA 1.493 1.701 0 O-C-N 121.353 -0.842 . . . . 0.0 109.292 179.757 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 101' ' ' LEU . . . . . 0.437 ' O ' ' O ' ' A' ' 102' ' ' GLU . 83.0 mt 53.72 168.33 0.02 OUTLIER 'General case' 0 N--CA 1.495 1.779 0 CA-C-O 121.858 0.837 . . . . 0.0 110.738 179.735 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 102' ' ' GLU . . . . . 0.437 ' O ' ' O ' ' A' ' 101' ' ' LEU . 83.0 tt0 41.52 95.14 0.01 OUTLIER 'General case' 0 N--CA 1.491 1.591 0 CA-C-O 121.582 0.706 . . . . 0.0 110.186 -179.689 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 103' ' ' HIS . . . . . 0.457 ' ND1' ' O ' ' A' ' 103' ' ' HIS . 57.1 t-80 -137.39 27.57 2.82 Favored 'General case' 0 N--CA 1.493 1.68 0 N-CA-C 108.787 -0.82 . . . . 0.0 108.787 179.622 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 104' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -135.72 2.46 2.91 Favored 'General case' 0 N--CA 1.497 1.897 0 N-CA-C 108.692 -0.855 . . . . 0.0 108.692 179.658 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 105' ' ' HIS . . . . . . . . . . . . . 76.6 t60 -66.08 -41.71 90.36 Favored 'General case' 0 N--CA 1.494 1.743 0 O-C-N 121.406 -0.809 . . . . 0.0 109.141 179.331 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 106' ' ' HIS . . . . . . . . . . . . . 38.0 p-80 -150.82 143.1 24.21 Favored 'General case' 0 N--CA 1.493 1.69 0 O-C-N 121.211 -0.93 . . . . 0.0 109.962 -179.988 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 107' ' ' HIS . . . . . 0.445 ' O ' ' OXT' ' A' ' 108' ' ' HIS . 86.0 t60 -87.82 -57.08 3.07 Favored 'General case' 0 N--CA 1.492 1.661 0 O-C-N 121.537 -0.727 . . . . 0.0 109.131 179.69 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 108' ' ' HIS . . . . . 0.445 ' OXT' ' O ' ' A' ' 107' ' ' HIS . 36.9 m-70 . . . . . 0 N--CA 1.5 2.068 0 CA-C-O 117.922 -1.037 . . . . 0.0 110.815 179.577 . . . . . . . . 1 1 . 1 stop_ save_