data_2l56_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 2l56 _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 ' 18' ' ' HIS . . . . . . . . . . . . 0.675 0.9 OUTLIER . . . . . 0 N--CA 1.469 0.51 0 CA-C-O 116.301 -1.809 . . . . 0.0 109.919 . . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER 51.49 -71.33 0.01 OUTLIER 'General case' 0 N--CA 1.47 0.567 0 C-N-CA 127.137 2.175 . . . . 0.0 114.913 146.263 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 20' ' ' GLU . . . . . 0.605 ' CD ' ' H ' ' A' ' 21' ' ' ASN . 2.7 pp20? -81.42 -61.88 1.81 Allowed 'General case' 0 N--CA 1.47 0.529 0 CA-C-N 110.897 -2.865 . . . . 0.0 116.108 174.994 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 21' ' ' ASN . . . . . 0.605 ' H ' ' CD ' ' A' ' 20' ' ' GLU 0.293 5.5 m-80 -83.7 68.39 9.85 Favored 'General case' 0 N--CA 1.47 0.526 0 CA-C-O 121.747 0.784 . . . . 0.0 109.633 163.635 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 1.5 tm-20 -166.56 -37.01 0.03 OUTLIER 'General case' 0 N--CA 1.471 0.58 0 CA-C-N 109.56 -3.473 . . . . 0.0 110.311 175.066 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 60.6 t -74.32 -44.03 49.18 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.553 0 CA-C-N 119.192 0.906 . . . . 0.0 111.807 163.408 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -68.77 -12.57 61.63 Favored 'General case' 0 N--CA 1.47 0.568 0 O-C-N 125.98 2.05 . . . . 0.0 113.399 176.182 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 25' ' ' ARG . . . . . . . . . . . . 0.37 15.8 mtp180 -76.09 -131.57 0.01 OUTLIER 'General case' 0 N--CA 1.471 0.576 0 N-CA-C 106.031 -1.841 . . . . 0.0 106.031 150.777 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 26' ' ' LEU . . . . . . . . . . . . 0.473 0.2 OUTLIER 42.22 -77.35 0.0 OUTLIER 'General case' 0 N--CA 1.47 0.572 1 N-CA-C 122.423 4.231 . . . . 0.0 122.423 157.358 . . . . . . . . 4 3 . 1 . 001 nuclear orig core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 5.7 ttmt -79.44 -24.32 42.55 Favored 'General case' 0 N--CA 1.469 0.517 0 CA-C-N 113.009 -1.905 . . . . 0.0 108.925 -168.692 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 48.0 mttt -76.98 -36.67 56.27 Favored 'General case' 0 N--CA 1.47 0.55 0 C-N-CA 126.384 1.874 . . . . 0.0 115.695 -179.044 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 22.9 mt -80.42 -36.72 33.33 Favored 'General case' 0 N--CA 1.47 0.547 0 CA-C-N 110.329 -3.123 . . . . 0.0 111.87 171.789 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 22.1 t . . . . . 0 N--CA 1.47 0.572 0 CA-C-O 115.873 -2.013 . . . . 0.0 112.349 178.367 . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' A' A ' 18' ' ' HIS . . . . . . . . . . . . 0.522 0.0 OUTLIER . . . . . 0 N--CA 1.471 0.583 1 N-CA-C 123.534 4.642 . . . . 0.0 123.534 . . . . . . . . . 3 2 . 1 . 002 nuclear orig core ' A' A ' 19' ' ' LEU . . . . . . . . . . . . 0.321 1.5 tm? -76.86 -10.85 59.66 Favored 'General case' 0 N--CA 1.469 0.496 0 CA-C-O 124.373 2.035 . . . . 0.0 113.183 -149.429 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 9.7 pt-20 -58.89 -23.17 60.74 Favored 'General case' 0 N--CA 1.47 0.566 0 O-C-N 118.001 -2.937 . . . . 0.0 114.056 169.099 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 12.9 t-20 -81.77 -25.14 35.55 Favored 'General case' 0 N--CA 1.47 0.563 0 C-N-CA 124.225 1.01 . . . . 0.0 109.709 -173.471 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 10.2 mm-40 -71.15 -24.62 62.29 Favored 'General case' 0 N--CA 1.47 0.572 0 C-N-CA 128.208 2.603 . . . . 0.0 111.407 178.96 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 21.8 t -73.9 -54.46 15.04 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.542 0 CA-C-N 110.48 -3.054 . . . . 0.0 114.655 167.543 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -69.56 -15.07 63.16 Favored 'General case' 0 N--CA 1.47 0.569 0 CA-C-O 123.065 1.412 . . . . 0.0 114.764 174.643 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 6.7 mtt180 -71.19 -44.52 65.27 Favored 'General case' 0 N--CA 1.47 0.561 0 O-C-N 117.297 -3.377 . . . . 0.0 114.065 164.743 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 26' ' ' LEU . . . . . . . . . . . . 0.32 4.5 mm? -71.32 -41.1 70.28 Favored 'General case' 0 N--CA 1.47 0.552 0 N-CA-C 119.299 3.074 . . . . 0.0 119.299 172.959 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 52.2 mmtt -87.05 45.79 1.31 Allowed 'General case' 0 N--CA 1.47 0.556 0 C-N-CA 126.678 1.991 . . . . 0.0 108.914 -172.113 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 36.5 mttm -158.33 -39.02 0.06 Allowed 'General case' 0 N--CA 1.47 0.526 1 C-N-CA 132.769 4.428 . . . . 0.0 113.731 176.596 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 9.6 tp -82.1 -50.24 9.28 Favored 'General case' 0 N--CA 1.471 0.608 0 O-C-N 120.983 -1.073 . . . . 0.0 108.64 173.242 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 3.2 m . . . . . 0 N--CA 1.47 0.569 0 CA-C-O 127.828 3.68 . . . . 0.0 112.735 -178.19 . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' A' A ' 18' ' ' HIS . . . . . 0.417 ' C ' ' H ' ' A' ' 20' ' ' GLU 0.355 0.0 OUTLIER . . . . . 0 N--CA 1.47 0.541 1 N-CA-C 124.069 4.84 . . . . 0.0 124.069 . . . . . . . . . 4 3 . 1 . 003 nuclear orig core ' A' A ' 19' ' ' LEU . . . . . . . . . . . . 0.34 0.2 OUTLIER 66.44 -48.69 0.44 Allowed 'General case' 0 N--CA 1.469 0.522 0 C-N-CA 130.169 3.388 . . . . 0.0 115.741 170.59 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 20' ' ' GLU . . . . . 0.417 ' H ' ' C ' ' A' ' 18' ' ' HIS 0.279 19.7 mt-10 -83.64 -48.78 9.83 Favored 'General case' 0 N--CA 1.47 0.554 0 C-N-CA 131.105 3.762 . . . . 0.0 107.637 169.237 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 12.7 m120 -88.51 67.48 8.54 Favored 'General case' 0 N--CA 1.47 0.553 0 CA-C-N 113.275 -1.784 . . . . 0.0 107.362 172.301 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 6.3 mm-40 -175.3 -56.78 0.01 OUTLIER 'General case' 0 N--CA 1.469 0.498 2 C-N-CA 137.266 6.226 . . . . 0.0 109.632 -172.215 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 23' ' ' VAL . . . . . . . . . . . . 0.367 22.4 t -75.42 -37.69 38.5 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.575 0 O-C-N 127.609 3.068 . . . . 0.0 114.495 171.429 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -80.6 42.1 0.59 Allowed 'General case' 0 N--CA 1.47 0.55 0 CA-C-N 112.857 -1.974 . . . . 0.0 112.467 162.161 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 25' ' ' ARG . . . . . . . . . . . . 0.348 17.3 mtt180 -154.99 18.01 0.43 Allowed 'General case' 0 N--CA 1.471 0.588 0 CA-C-N 114.821 -1.081 . . . . 0.0 111.233 168.355 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 4.3 tp -170.35 29.23 0.02 OUTLIER 'General case' 0 N--CA 1.471 0.581 0 CA-C-O 124.727 2.203 . . . . 0.0 111.146 -172.875 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 27.2 tptt -154.07 -20.43 0.13 Allowed 'General case' 0 N--CA 1.469 0.497 0 C-N-CA 129.011 2.925 . . . . 0.0 116.357 178.879 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 16.3 ptmt -153.28 58.84 0.77 Allowed 'General case' 0 N--CA 1.47 0.568 0 CA-C-N 124.168 3.167 . . . . 0.0 107.99 171.97 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 29' ' ' LEU . . . . . . . . . . . . 0.431 12.1 tp 36.62 -82.7 0.0 OUTLIER 'General case' 0 N--CA 1.471 0.612 3 C-N-CA 138.541 6.736 . . . . 0.0 127.759 29.293 . . . . . . . . 3 2 . 1 . 003 nuclear orig core ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 45.2 t . . . . . 0 N--CA 1.47 0.563 0 O-C-N 125.875 1.984 . . . . 0.0 109.807 -174.403 . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' A' A ' 18' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.47 0.574 0 N-CA-C 116.39 1.996 . . . . 0.0 116.39 . . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 19' ' ' LEU . . . . . . . . . . . . 0.317 1.5 tp -160.06 111.47 1.96 Allowed 'General case' 0 N--CA 1.47 0.553 0 CA-C-O 128.06 3.79 . . . . 0.0 110.503 28.982 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -164.08 -48.31 0.03 OUTLIER 'General case' 0 N--CA 1.469 0.505 1 CA-C-N 104.112 -5.949 . . . . 0.0 115.953 -155.28 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 21' ' ' ASN . . . . . . . . . . . . 0.297 21.9 t30 -86.52 49.08 1.73 Allowed 'General case' 0 N--CA 1.47 0.549 1 CA-C-O 130.841 5.115 . . . . 0.0 111.637 176.374 . . . . . . . . 3 2 . 1 . 004 nuclear orig core ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 10.3 mt-10 -164.38 -39.76 0.03 OUTLIER 'General case' 0 N--CA 1.469 0.523 1 CA-C-N 106.201 -5.0 . . . . 0.0 117.198 -172.409 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 41.3 t -61.84 -48.81 86.91 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.538 0 O-C-N 119.495 -2.003 . . . . 0.0 112.42 148.76 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -86.73 31.17 0.69 Allowed 'General case' 0 N--CA 1.469 0.496 0 CA-C-O 126.791 3.186 . . . . 0.0 112.174 176.331 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 15.0 mtp180 -165.33 55.63 0.12 Allowed 'General case' 0 N--CA 1.47 0.538 0 CA-C-N 108.492 -3.958 . . . . 0.0 114.254 173.806 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 5.5 tp -179.37 -53.54 0.01 OUTLIER 'General case' 0 N--CA 1.47 0.56 1 CA-C-N 105.333 -5.394 . . . . 0.0 116.017 174.833 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . 0.269 0.1 OUTLIER -86.46 -27.96 23.77 Favored 'General case' 0 N--CA 1.47 0.541 0 N-CA-C 115.567 1.691 . . . . 0.0 115.567 -168.126 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 73.0 mmtt -81.61 -29.56 33.25 Favored 'General case' 0 N--CA 1.47 0.543 0 O-C-N 118.681 -2.512 . . . . 0.0 108.45 178.246 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 38.2 tp -82.8 -43.63 16.48 Favored 'General case' 0 N--CA 1.471 0.589 0 CA-C-N 122.274 2.306 . . . . 0.0 116.193 161.944 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 30' ' ' VAL . . . . . . . . . . . . 0.332 1.1 t . . . . . 0 N--CA 1.47 0.561 0 O-C-N 119.268 -2.145 . . . . 0.0 107.934 175.424 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 18' ' ' HIS . . . . . 0.612 ' C ' ' H ' ' A' ' 20' ' ' GLU . 0.0 OUTLIER . . . . . 0 N--CA 1.471 0.598 0 CA-C-O 122.872 1.32 . . . . 0.0 108.043 . . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 4.9 tp -71.31 41.36 0.07 Allowed 'General case' 0 N--CA 1.47 0.549 1 C-N-CA 131.845 4.058 . . . . 0.0 116.819 178.34 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 20' ' ' GLU . . . . . 0.612 ' H ' ' C ' ' A' ' 18' ' ' HIS 0.253 1.1 pp20? -161.69 -47.02 0.04 OUTLIER 'General case' 0 N--CA 1.47 0.565 1 CA-C-N 102.886 -6.506 . . . . 0.0 117.062 -169.581 . . . . . . . . 4 3 . 1 . 005 nuclear orig core ' A' A ' 21' ' ' ASN . . . . . 0.419 ' H ' ' CD ' ' A' ' 20' ' ' GLU . 5.4 t-20 -92.63 63.77 4.07 Favored 'General case' 0 N--CA 1.47 0.527 0 CA-C-O 128.383 3.944 . . . . 0.0 106.854 158.808 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 11.8 mm-40 -170.15 -55.27 0.02 OUTLIER 'General case' 0 N--CA 1.47 0.552 1 C-N-CA 133.898 4.879 . . . . 0.0 108.111 -177.95 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 3.2 t -73.9 -29.97 27.12 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.545 0 CA-C-N 113.991 -1.458 . . . . 0.0 111.291 178.27 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -81.69 -26.85 34.32 Favored 'General case' 0 N--CA 1.47 0.574 0 N-CA-C 119.682 3.216 . . . . 0.0 119.682 163.909 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 11.5 mtp180 -70.78 -46.78 62.27 Favored 'General case' 0 N--CA 1.472 0.632 0 CA-C-O 113.577 -3.106 . . . . 0.0 113.861 177.615 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 1.1 mt -85.61 -149.35 0.13 Allowed 'General case' 0 N--CA 1.47 0.556 0 CA-C-O 115.052 -2.404 . . . . 0.0 106.948 168.86 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 78.9 mttt 46.33 -58.06 0.0 OUTLIER 'General case' 0 N--CA 1.47 0.549 1 C-N-CA 131.804 4.042 . . . . 0.0 120.898 163.035 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 19.5 tptm -70.43 -40.17 73.95 Favored 'General case' 0 N--CA 1.47 0.57 0 C-N-CA 123.116 0.567 . . . . 0.0 109.551 168.359 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 14.4 tp -87.54 -34.71 18.5 Favored 'General case' 0 N--CA 1.471 0.591 0 N-CA-C 117.058 2.244 . . . . 0.0 117.058 -179.518 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 48.1 t . . . . . 0 N--CA 1.47 0.573 0 C-N-CA 130.733 3.613 . . . . 0.0 108.725 -179.859 . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' A' A ' 18' ' ' HIS . . . . . 0.586 ' CE1' ' H ' ' A' ' 21' ' ' ASN 0.871 86.9 m-70 . . . . . 0 N--CA 1.469 0.518 0 N-CA-C 120.886 3.661 . . . . 0.0 120.886 . . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 19' ' ' LEU . . . . . . . . . . . . 0.492 2.7 tt 65.64 99.0 0.04 OUTLIER 'General case' 0 N--CA 1.47 0.542 2 N-CA-C 130.135 7.087 . . . . 0.0 130.135 -35.814 . . . . . . . . 3 2 . 1 . 006 nuclear orig core ' A' A ' 20' ' ' GLU . . . . . . . . . . . . 0.253 6.0 pt-20 75.28 6.9 4.13 Favored 'General case' 0 N--CA 1.469 0.486 3 N-CA-C 126.54 5.756 . . . . 0.0 126.54 173.009 . . . . . . . . 3 2 . 1 . 006 nuclear orig core ' A' A ' 21' ' ' ASN . . . . . 0.586 ' H ' ' CE1' ' A' ' 18' ' ' HIS . 57.8 t-20 -85.21 -81.99 0.19 Allowed 'General case' 0 N--CA 1.47 0.57 1 N-CA-C 98.397 -4.668 . . . . 0.0 98.397 141.7 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 11.5 mm-40 42.42 -95.57 0.02 OUTLIER 'General case' 0 N--CA 1.469 0.49 0 N-CA-C 116.119 1.896 . . . . 0.0 116.119 162.39 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 23' ' ' VAL . . . . . . . . . . . . 0.541 0.6 OUTLIER 14.4 -76.97 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.47 0.561 1 N-CA-C 123.365 4.579 . . . . 0.0 123.365 140.969 . . . . . . . . 4 3 . 1 . 006 nuclear orig core ' A' A ' 24' ' ' ALA . . . . . . . . . . . . 0.251 . . -76.03 36.95 0.15 Allowed 'General case' 0 N--CA 1.47 0.538 1 CA-C-N 106.582 -4.826 . . . . 0.0 116.762 167.852 . . . . . . . . 3 2 . 1 . 006 nuclear orig core ' A' A ' 25' ' ' ARG . . . . . . . . . . . . 0.353 31.5 mtp180 -163.85 -48.19 0.03 OUTLIER 'General case' 0 N--CA 1.471 0.578 0 O-C-N 119.468 -2.02 . . . . 0.0 110.002 -179.413 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 16.2 mt -77.91 -128.35 0.01 OUTLIER 'General case' 0 N--CA 1.47 0.553 0 O-C-N 125.668 1.855 . . . . 0.0 107.475 165.361 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . 0.323 46.0 mttp 23.53 -72.69 0.0 OUTLIER 'General case' 0 N--CA 1.47 0.532 0 C-N-CA 129.665 3.186 . . . . 0.0 117.792 153.76 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 28' ' ' LYS . . . . . . . . . . . . 0.369 47.4 mtpt -91.24 13.71 16.42 Favored 'General case' 0 N--CA 1.471 0.589 0 O-C-N 118.436 -2.665 . . . . 0.0 117.147 -170.086 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 40.4 tp -149.7 -47.92 0.14 Allowed 'General case' 0 N--CA 1.47 0.553 0 CA-C-N 110.726 -2.943 . . . . 0.0 108.329 -174.464 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 62.1 t . . . . . 0 N--CA 1.471 0.582 0 C-N-CA 124.459 1.103 . . . . 0.0 113.179 -179.291 . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' A' A ' 18' ' ' HIS . . . . . . . . . . . . . 0.5 OUTLIER . . . . . 0 N--CA 1.47 0.529 0 CA-C-O 114.24 -2.791 . . . . 0.0 107.232 . . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 1.6 tp -78.25 -20.33 51.9 Favored 'General case' 0 N--CA 1.47 0.562 0 CA-C-O 125.616 2.626 . . . . 0.0 116.522 -171.487 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 6.4 pt-20 -74.18 -47.76 33.53 Favored 'General case' 0 N--CA 1.47 0.563 2 CA-C-N 106.613 -4.812 . . . . 0.0 122.829 161.179 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 57.3 m-80 -97.77 61.18 1.56 Allowed 'General case' 0 N--CA 1.47 0.544 0 CA-C-O 127.315 3.436 . . . . 0.0 108.552 167.471 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -163.25 -39.49 0.03 OUTLIER 'General case' 0 N--CA 1.471 0.588 0 CA-C-N 109.415 -3.538 . . . . 0.0 112.08 -179.602 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 98.2 t -68.86 -45.28 80.96 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.604 1 CA-C-O 111.268 -4.206 . . . . 0.0 107.686 155.292 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -82.03 69.91 8.84 Favored 'General case' 0 N--CA 1.47 0.557 0 N-CA-C 116.772 2.138 . . . . 0.0 116.772 159.179 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 30.4 mtt-85 -171.89 -52.42 0.02 OUTLIER 'General case' 0 N--CA 1.471 0.592 1 CA-C-N 107.822 -4.263 . . . . 0.0 109.739 175.897 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 86.9 mt -83.05 -26.79 30.8 Favored 'General case' 0 N--CA 1.47 0.527 1 O-C-N 116.068 -4.145 . . . . 0.0 110.637 -167.196 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 24.9 tptp -82.86 -27.77 30.54 Favored 'General case' 0 N--CA 1.469 0.498 0 C-N-CA 115.128 -2.629 . . . . 0.0 109.506 -169.993 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 74.0 mttt -84.5 26.83 0.76 Allowed 'General case' 0 N--CA 1.47 0.539 0 C-N-CA 128.111 2.565 . . . . 0.0 116.388 166.431 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 29' ' ' LEU . . . . . . . . . . . . 0.342 3.4 pp -147.15 -21.37 0.4 Allowed 'General case' 0 N--CA 1.47 0.542 0 CA-C-O 115.731 -2.08 . . . . 0.0 114.257 158.991 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 0.9 OUTLIER . . . . . 0 N--CA 1.471 0.579 0 CA-C-N 119.749 1.158 . . . . 0.0 111.924 170.21 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 18' ' ' HIS . . . . . . . . . . . . 0.263 0.7 OUTLIER . . . . . 0 N--CA 1.471 0.607 1 N-CA-C 128.05 6.315 . . . . 0.0 128.05 . . . . . . . . . 3 2 . 1 . 008 nuclear orig core ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER 74.51 0.86 3.69 Favored 'General case' 0 N--CA 1.47 0.572 2 C-N-CA 144.464 9.105 . . . . 0.0 113.977 -18.658 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 11.2 mt-10 -164.53 -77.06 0.03 OUTLIER 'General case' 0 N--CA 1.47 0.53 0 CA-C-N 112.594 -2.093 . . . . 0.0 115.56 -173.718 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 10.3 t-20 -85.98 78.07 9.53 Favored 'General case' 0 N--CA 1.47 0.569 0 N-CA-C 109.135 -0.691 . . . . 0.0 109.135 164.667 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 23.6 mt-10 -164.72 -54.4 0.03 OUTLIER 'General case' 0 N--CA 1.47 0.532 2 C-N-CA 138.718 6.807 . . . . 0.0 105.578 168.994 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 23' ' ' VAL . . . . . . . . . . . . 0.344 3.2 t -72.93 -35.52 49.21 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.478 0 CA-C-O 112.131 -3.795 . . . . 0.0 114.657 170.567 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -80.76 51.42 1.51 Allowed 'General case' 0 N--CA 1.47 0.56 0 CA-C-O 123.937 1.827 . . . . 0.0 111.448 167.918 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 46.7 mtp85 -163.8 -10.82 0.03 OUTLIER 'General case' 0 N--CA 1.47 0.565 0 N-CA-C 119.862 3.282 . . . . 0.0 119.862 178.704 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 1.7 pp -163.18 20.16 0.08 Allowed 'General case' 0 N--CA 1.469 0.497 0 N-CA-C 117.22 2.304 . . . . 0.0 117.22 177.638 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -156.49 45.46 0.42 Allowed 'General case' 0 N--CA 1.469 0.499 0 CA-C-N 112.446 -2.161 . . . . 0.0 105.433 -176.605 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 47.2 tptt 121.35 79.31 0.0 OUTLIER 'General case' 0 N--CA 1.47 0.562 1 C-N-CA 132.819 4.447 . . . . 0.0 108.008 -152.958 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 29' ' ' LEU . . . . . . . . . . . . 0.553 32.9 tp 40.29 -118.99 0.34 Allowed 'General case' 0 N--CA 1.47 0.552 1 C-N-CA 144.141 8.976 . . . . 0.0 118.569 2.691 . . . . . . . . 3 2 . 1 . 008 nuclear orig core ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 60.2 t . . . . . 0 N--CA 1.47 0.563 0 C-N-CA 129.797 3.239 . . . . 0.0 113.798 170.954 . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' A' A ' 18' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.47 0.531 0 CA-C-O 124.209 1.957 . . . . 0.0 113.759 . . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 1.3 pp -152.83 84.72 1.22 Allowed 'General case' 0 N--CA 1.47 0.536 0 O-C-N 118.206 -2.809 . . . . 0.0 117.319 12.093 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 6.3 pt-20 -76.18 -51.48 12.04 Favored 'General case' 0 N--CA 1.47 0.542 1 CA-C-N 103.367 -6.288 . . . . 0.0 112.589 162.483 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 2.4 t-20 -85.02 65.07 9.05 Favored 'General case' 0 N--CA 1.469 0.518 0 CA-C-N 114.84 -1.073 . . . . 0.0 112.257 168.039 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 12.1 mm-40 -164.24 -36.81 0.03 OUTLIER 'General case' 0 N--CA 1.47 0.56 1 O-C-N 131.439 5.462 . . . . 0.0 111.384 167.13 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 95.7 t -75.31 -27.23 19.25 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.555 0 CA-C-O 113.395 -3.193 . . . . 0.0 118.952 160.467 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 24' ' ' ALA . . . . . . . . . . . . 0.287 . . -165.7 94.27 0.59 Allowed 'General case' 0 N--CA 1.47 0.534 1 O-C-N 131.329 5.393 . . . . 0.0 103.393 168.781 . . . . . . . . 3 2 . 1 . 009 nuclear orig core ' A' A ' 25' ' ' ARG . . . . . . . . . . . . 0.797 51.2 mtt85 43.38 -76.02 0.0 OUTLIER 'General case' 0 N--CA 1.47 0.545 2 N-CA-C 130.16 7.096 . . . . 0.0 130.16 -6.319 . . . . . . . . 3 2 . 1 . 009 nuclear orig core ' A' A ' 26' ' ' LEU . . . . . . . . . . . . 0.429 68.8 tp -79.94 10.12 4.6 Favored 'General case' 0 N--CA 1.47 0.559 0 O-C-N 118.789 -2.444 . . . . 0.0 110.927 -167.607 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 34.6 tptt -154.22 31.95 0.43 Allowed 'General case' 0 N--CA 1.47 0.56 0 C-N-CA 129.298 3.039 . . . . 0.0 110.866 175.209 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 13.6 mmtt -147.18 33.79 0.89 Allowed 'General case' 0 N--CA 1.47 0.541 0 CA-C-N 110.792 -2.913 . . . . 0.0 116.562 -178.038 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 25.9 tp -155.29 -47.86 0.08 Allowed 'General case' 0 N--CA 1.47 0.547 0 CA-C-N 113.521 -1.672 . . . . 0.0 111.306 -168.019 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 22.2 t . . . . . 0 N--CA 1.47 0.538 0 O-C-N 120.236 -1.54 . . . . 0.0 113.916 171.753 . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' A' A ' 18' ' ' HIS . . . . . 0.524 ' CG ' ' H ' ' A' ' 19' ' ' LEU 0.466 0.1 OUTLIER . . . . . 0 N--CA 1.471 0.597 0 CA-C-O 114.668 -2.587 . . . . 0.0 114.385 . . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 19' ' ' LEU . . . . . 0.524 ' H ' ' CG ' ' A' ' 18' ' ' HIS . 2.5 tp 50.87 -70.93 0.0 OUTLIER 'General case' 0 N--CA 1.47 0.528 1 CA-C-O 128.603 4.049 . . . . 0.0 111.113 140.009 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 2.6 pp20? -71.4 -47.15 57.86 Favored 'General case' 0 N--CA 1.47 0.531 0 C-N-CA 131.181 3.792 . . . . 0.0 117.779 -176.47 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER -93.71 -12.41 29.31 Favored 'General case' 0 N--CA 1.471 0.585 0 CA-C-O 113.739 -3.029 . . . . 0.0 114.072 171.918 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 29.8 mm-40 -63.86 -41.51 97.76 Favored 'General case' 0 N--CA 1.47 0.566 0 O-C-N 124.916 1.385 . . . . 0.0 108.165 165.407 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 53.8 t -79.27 59.24 0.14 Allowed 'Isoleucine or valine' 0 N--CA 1.471 0.585 0 O-C-N 119.035 -2.291 . . . . 0.0 115.544 166.183 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . 179.19 -33.48 0.01 OUTLIER 'General case' 0 N--CA 1.47 0.559 1 C-N-CA 134.514 5.125 . . . . 0.0 109.318 179.668 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 27.1 mtp85 -71.03 -75.08 0.13 Allowed 'General case' 0 N--CA 1.469 0.521 0 CA-C-O 117.418 -1.277 . . . . 0.0 113.539 167.178 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 26' ' ' LEU . . . . . . . . . . . . 0.405 1.0 OUTLIER 39.57 -75.28 0.0 OUTLIER 'General case' 0 N--CA 1.471 0.583 1 N-CA-C 126.058 5.577 . . . . 0.0 126.058 153.18 . . . . . . . . 4 3 . 1 . 010 nuclear orig core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . 0.265 35.4 tttt -85.47 -15.24 43.54 Favored 'General case' 0 N--CA 1.47 0.548 1 CA-C-N 106.157 -5.02 . . . . 0.0 112.449 -178.059 . . . . . . . . 3 2 . 1 . 010 nuclear orig core ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 58.3 mttp -92.11 18.4 8.13 Favored 'General case' 0 N--CA 1.471 0.585 0 O-C-N 119.13 -2.232 . . . . 0.0 114.724 170.259 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 13.0 tp -150.08 -46.88 0.13 Allowed 'General case' 0 N--CA 1.47 0.534 0 CA-C-O 114.467 -2.682 . . . . 0.0 109.576 -173.171 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 30' ' ' VAL . . . . . . . . . . . . 0.438 2.0 t . . . . . 0 N--CA 1.47 0.533 0 N-CA-C 118.096 2.628 . . . . 0.0 118.096 -172.183 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 15' ' ' ACE . . . . . . . . . . . . . . . . . . . . 0 C--O 1.231 0.084 . . . . . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' A' A ' 16' ' ' ASN . . . . . . . . . . . . 0.365 61.4 t30 -98.47 -72.74 0.64 Allowed 'General case' 0 N--CA 1.471 0.589 0 C-N-CA 127.299 2.24 . . . . 0.0 114.887 . . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 17' ' ' TYR . . . . . . . . . . . . . 4.1 t80 62.04 153.56 0.03 OUTLIER 'General case' 0 N--CA 1.47 0.541 2 C-N-CA 142.825 8.45 . . . . 0.0 118.94 -12.185 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 18' ' ' HIS . . . . . . . . . . . . 0.675 0.9 OUTLIER 34.59 -127.61 0.09 Allowed 'General case' 0 N--CA 1.469 0.51 0 CA-C-O 116.301 -1.809 . . . . 0.0 109.919 -178.005 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER 51.49 -71.33 0.01 OUTLIER 'General case' 0 N--CA 1.47 0.567 0 C-N-CA 127.137 2.175 . . . . 0.0 114.913 146.263 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 20' ' ' GLU . . . . . 0.605 ' CD ' ' H ' ' A' ' 21' ' ' ASN . 2.7 pp20? -81.42 -61.88 1.81 Allowed 'General case' 0 N--CA 1.47 0.529 0 CA-C-N 110.897 -2.865 . . . . 0.0 116.108 174.994 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 21' ' ' ASN . . . . . 0.605 ' H ' ' CD ' ' A' ' 20' ' ' GLU 0.293 5.5 m-80 -83.7 68.39 9.85 Favored 'General case' 0 N--CA 1.47 0.526 0 CA-C-O 121.747 0.784 . . . . 0.0 109.633 163.635 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 1.5 tm-20 -166.56 -37.01 0.03 OUTLIER 'General case' 0 N--CA 1.471 0.58 0 CA-C-N 109.56 -3.473 . . . . 0.0 110.311 175.066 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 60.6 t -74.32 -44.03 49.18 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.553 0 CA-C-N 119.192 0.906 . . . . 0.0 111.807 163.408 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -68.77 -12.57 61.63 Favored 'General case' 0 N--CA 1.47 0.568 0 O-C-N 125.98 2.05 . . . . 0.0 113.399 176.182 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 25' ' ' ARG . . . . . . . . . . . . 0.37 15.8 mtp180 -76.09 -131.57 0.01 OUTLIER 'General case' 0 N--CA 1.471 0.576 0 N-CA-C 106.031 -1.841 . . . . 0.0 106.031 150.777 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 26' ' ' LEU . . . . . . . . . . . . 0.473 0.2 OUTLIER 42.22 -77.35 0.0 OUTLIER 'General case' 0 N--CA 1.47 0.572 1 N-CA-C 122.423 4.231 . . . . 0.0 122.423 157.358 . . . . . . . . 4 3 . 1 . 001 nuclear orig full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 5.7 ttmt -79.44 -24.32 42.55 Favored 'General case' 0 N--CA 1.469 0.517 0 CA-C-N 113.009 -1.905 . . . . 0.0 108.925 -168.692 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 48.0 mttt -76.98 -36.67 56.27 Favored 'General case' 0 N--CA 1.47 0.55 0 C-N-CA 126.384 1.874 . . . . 0.0 115.695 -179.044 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 22.9 mt -80.42 -36.72 33.33 Favored 'General case' 0 N--CA 1.47 0.547 0 CA-C-N 110.329 -3.123 . . . . 0.0 111.87 171.789 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 22.1 t -96.98 -89.84 0.11 Allowed 'Isoleucine or valine' 0 N--CA 1.47 0.572 0 CA-C-O 115.873 -2.013 . . . . 0.0 112.349 178.367 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . -179.16 -140.82 4.18 Favored Glycine 0 CA--C 1.53 1.0 1 O-C-N 132.029 5.831 . . . . 0.0 114.796 174.597 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 32' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.33 -0.241 0 O-C-N 117.218 -3.519 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' A' A ' 15' ' ' ACE . . . . . . . . . . . . . . . . . . . . 0 C--O 1.23 0.055 . . . . . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' A' A ' 16' ' ' ASN . . . . . . . . . . . . 0.359 26.8 t30 83.61 107.68 0.06 Allowed 'General case' 0 N--CA 1.47 0.559 1 C-N-CA 135.089 5.355 . . . . 0.0 110.028 . . . . . . . . . 3 2 . 1 . 002 nuclear orig full ' A' A ' 17' ' ' TYR . . . . . . . . . . . . . 24.8 m-85 58.32 74.2 0.44 Allowed 'General case' 0 N--CA 1.471 0.601 0 O-C-N 128.636 3.71 . . . . 0.0 112.1 -173.822 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 18' ' ' HIS . . . . . . . . . . . . 0.522 0.0 OUTLIER 67.58 -54.0 0.49 Allowed 'General case' 0 N--CA 1.471 0.583 2 C-N-CA 134.534 5.134 . . . . 0.0 123.534 -0.75 . . . . . . . . 4 3 . 1 . 002 nuclear orig full ' A' A ' 19' ' ' LEU . . . . . . . . . . . . 0.321 1.5 tm? -76.86 -10.85 59.66 Favored 'General case' 0 N--CA 1.469 0.496 0 CA-C-O 124.373 2.035 . . . . 0.0 113.183 -149.429 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 9.7 pt-20 -58.89 -23.17 60.74 Favored 'General case' 0 N--CA 1.47 0.566 0 O-C-N 118.001 -2.937 . . . . 0.0 114.056 169.099 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 12.9 t-20 -81.77 -25.14 35.55 Favored 'General case' 0 N--CA 1.47 0.563 0 C-N-CA 124.225 1.01 . . . . 0.0 109.709 -173.471 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 10.2 mm-40 -71.15 -24.62 62.29 Favored 'General case' 0 N--CA 1.47 0.572 0 C-N-CA 128.208 2.603 . . . . 0.0 111.407 178.96 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 21.8 t -73.9 -54.46 15.04 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.542 0 CA-C-N 110.48 -3.054 . . . . 0.0 114.655 167.543 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -69.56 -15.07 63.16 Favored 'General case' 0 N--CA 1.47 0.569 0 CA-C-O 123.065 1.412 . . . . 0.0 114.764 174.643 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 6.7 mtt180 -71.19 -44.52 65.27 Favored 'General case' 0 N--CA 1.47 0.561 0 O-C-N 117.297 -3.377 . . . . 0.0 114.065 164.743 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 26' ' ' LEU . . . . . . . . . . . . 0.32 4.5 mm? -71.32 -41.1 70.28 Favored 'General case' 0 N--CA 1.47 0.552 0 N-CA-C 119.299 3.074 . . . . 0.0 119.299 172.959 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 52.2 mmtt -87.05 45.79 1.31 Allowed 'General case' 0 N--CA 1.47 0.556 0 C-N-CA 126.678 1.991 . . . . 0.0 108.914 -172.113 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 36.5 mttm -158.33 -39.02 0.06 Allowed 'General case' 0 N--CA 1.47 0.526 1 C-N-CA 132.769 4.428 . . . . 0.0 113.731 176.596 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 9.6 tp -82.1 -50.24 9.28 Favored 'General case' 0 N--CA 1.471 0.608 0 O-C-N 120.983 -1.073 . . . . 0.0 108.64 173.242 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 3.2 m -154.81 92.82 0.08 OUTLIER 'Isoleucine or valine' 0 N--CA 1.47 0.569 0 CA-C-O 127.828 3.68 . . . . 0.0 112.735 -178.19 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . -170.18 106.47 0.24 Allowed Glycine 0 CA--C 1.529 0.945 1 CA-C-N 108.166 -4.106 . . . . 0.0 117.013 -176.664 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 32' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.331 -0.213 0 O-C-N 120.435 -1.626 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' A' A ' 15' ' ' ACE . . . . . . . . . . . . . . . . . . . . 0 C--O 1.23 0.043 . . . . . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER 48.17 88.08 0.02 OUTLIER 'General case' 0 N--CA 1.469 0.519 1 C-N-CA 134.84 5.256 . . . . 0.0 113.444 . . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 17' ' ' TYR . . . . . . . . . . . . . 10.4 m-30 -79.43 145.62 33.23 Favored 'General case' 0 N--CA 1.47 0.551 0 C-N-CA 129.774 3.23 . . . . 0.0 115.025 -13.345 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 18' ' ' HIS . . . . . 0.417 ' C ' ' H ' ' A' ' 20' ' ' GLU 0.355 0.0 OUTLIER 42.33 -167.77 0.01 OUTLIER 'General case' 0 N--CA 1.47 0.541 3 C-N-CA 133.878 4.871 . . . . 0.0 124.069 7.116 . . . . . . . . 5 4 . 1 . 003 nuclear orig full ' A' A ' 19' ' ' LEU . . . . . . . . . . . . 0.34 0.2 OUTLIER 66.44 -48.69 0.44 Allowed 'General case' 0 N--CA 1.469 0.522 0 C-N-CA 130.169 3.388 . . . . 0.0 115.741 170.59 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 20' ' ' GLU . . . . . 0.417 ' H ' ' C ' ' A' ' 18' ' ' HIS 0.279 19.7 mt-10 -83.64 -48.78 9.83 Favored 'General case' 0 N--CA 1.47 0.554 0 C-N-CA 131.105 3.762 . . . . 0.0 107.637 169.237 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 12.7 m120 -88.51 67.48 8.54 Favored 'General case' 0 N--CA 1.47 0.553 0 CA-C-N 113.275 -1.784 . . . . 0.0 107.362 172.301 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 6.3 mm-40 -175.3 -56.78 0.01 OUTLIER 'General case' 0 N--CA 1.469 0.498 2 C-N-CA 137.266 6.226 . . . . 0.0 109.632 -172.215 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 23' ' ' VAL . . . . . . . . . . . . 0.367 22.4 t -75.42 -37.69 38.5 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.575 0 O-C-N 127.609 3.068 . . . . 0.0 114.495 171.429 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -80.6 42.1 0.59 Allowed 'General case' 0 N--CA 1.47 0.55 0 CA-C-N 112.857 -1.974 . . . . 0.0 112.467 162.161 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 25' ' ' ARG . . . . . . . . . . . . 0.348 17.3 mtt180 -154.99 18.01 0.43 Allowed 'General case' 0 N--CA 1.471 0.588 0 CA-C-N 114.821 -1.081 . . . . 0.0 111.233 168.355 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 4.3 tp -170.35 29.23 0.02 OUTLIER 'General case' 0 N--CA 1.471 0.581 0 CA-C-O 124.727 2.203 . . . . 0.0 111.146 -172.875 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 27.2 tptt -154.07 -20.43 0.13 Allowed 'General case' 0 N--CA 1.469 0.497 0 C-N-CA 129.011 2.925 . . . . 0.0 116.357 178.879 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 16.3 ptmt -153.28 58.84 0.77 Allowed 'General case' 0 N--CA 1.47 0.568 0 CA-C-N 124.168 3.167 . . . . 0.0 107.99 171.97 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 29' ' ' LEU . . . . . . . . . . . . 0.431 12.1 tp 36.62 -82.7 0.0 OUTLIER 'General case' 0 N--CA 1.471 0.612 3 C-N-CA 138.541 6.736 . . . . 0.0 127.759 29.293 . . . . . . . . 3 2 . 1 . 003 nuclear orig full ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 45.2 t -161.2 128.41 0.59 Allowed 'Isoleucine or valine' 0 N--CA 1.47 0.563 0 O-C-N 125.875 1.984 . . . . 0.0 109.807 -174.403 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . -118.08 -153.61 9.61 Favored Glycine 0 CA--C 1.532 1.098 0 O-C-N 124.597 1.186 . . . . 0.0 115.392 -178.937 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 32' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.329 -0.31 0 CA-C-N 115.029 -0.585 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' A' A ' 15' ' ' ACE . . . . . . . . . . . . . . . . . . . . 0 C--O 1.23 0.047 . . . . . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' A' A ' 16' ' ' ASN . . . . . . . . . . . . 0.276 21.3 p-10 28.97 103.64 0.0 OUTLIER 'General case' 0 N--CA 1.47 0.562 2 N-CA-C 127.425 6.083 . . . . 0.0 127.425 . . . . . . . . . 3 2 . 1 . 004 nuclear orig full ' A' A ' 17' ' ' TYR . . . . . 0.401 ' CD2' ' CD2' ' A' ' 18' ' ' HIS 0.751 0.0 OUTLIER 66.42 -131.71 0.18 Allowed 'General case' 0 N--CA 1.471 0.591 0 C-N-CA 130.915 3.686 . . . . 0.0 113.635 8.696 . . . . . . . . 4 4 . 1 . 004 nuclear orig full ' A' A ' 18' ' ' HIS . . . . . 0.401 ' CD2' ' CD2' ' A' ' 17' ' ' TYR . 0.0 OUTLIER -155.9 128.67 7.91 Favored 'General case' 0 N--CA 1.47 0.574 2 C-N-CA 139.175 6.99 . . . . 0.0 116.39 0.902 . . . . . . . . 4 4 . 1 . 004 nuclear orig full ' A' A ' 19' ' ' LEU . . . . . . . . . . . . 0.317 1.5 tp -160.06 111.47 1.96 Allowed 'General case' 0 N--CA 1.47 0.553 0 CA-C-O 128.06 3.79 . . . . 0.0 110.503 28.982 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -164.08 -48.31 0.03 OUTLIER 'General case' 0 N--CA 1.469 0.505 1 CA-C-N 104.112 -5.949 . . . . 0.0 115.953 -155.28 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . 0.297 21.9 t30 -86.52 49.08 1.73 Allowed 'General case' 0 N--CA 1.47 0.549 1 CA-C-O 130.841 5.115 . . . . 0.0 111.637 176.374 . . . . . . . . 3 2 . 1 . 004 nuclear orig full ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 10.3 mt-10 -164.38 -39.76 0.03 OUTLIER 'General case' 0 N--CA 1.469 0.523 1 CA-C-N 106.201 -5.0 . . . . 0.0 117.198 -172.409 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 41.3 t -61.84 -48.81 86.91 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.538 0 O-C-N 119.495 -2.003 . . . . 0.0 112.42 148.76 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -86.73 31.17 0.69 Allowed 'General case' 0 N--CA 1.469 0.496 0 CA-C-O 126.791 3.186 . . . . 0.0 112.174 176.331 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 15.0 mtp180 -165.33 55.63 0.12 Allowed 'General case' 0 N--CA 1.47 0.538 0 CA-C-N 108.492 -3.958 . . . . 0.0 114.254 173.806 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 5.5 tp -179.37 -53.54 0.01 OUTLIER 'General case' 0 N--CA 1.47 0.56 1 CA-C-N 105.333 -5.394 . . . . 0.0 116.017 174.833 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . 0.269 0.1 OUTLIER -86.46 -27.96 23.77 Favored 'General case' 0 N--CA 1.47 0.541 0 N-CA-C 115.567 1.691 . . . . 0.0 115.567 -168.126 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 73.0 mmtt -81.61 -29.56 33.25 Favored 'General case' 0 N--CA 1.47 0.543 0 O-C-N 118.681 -2.512 . . . . 0.0 108.45 178.246 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 38.2 tp -82.8 -43.63 16.48 Favored 'General case' 0 N--CA 1.471 0.589 0 CA-C-N 122.274 2.306 . . . . 0.0 116.193 161.944 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 30' ' ' VAL . . . . . . . . . . . . 0.332 1.1 t -94.34 95.28 5.04 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.561 0 O-C-N 119.268 -2.145 . . . . 0.0 107.934 175.424 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . 97.2 -55.01 1.3 Allowed Glycine 0 CA--C 1.53 0.981 0 N-CA-C 121.535 3.374 . . . . 0.0 121.535 176.39 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 32' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.331 -0.23 1 O-C-N 112.674 -6.192 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 15' ' ' ACE . . . . . . . . . . . . . . . . . . . . 0 C--O 1.23 0.056 . . . . . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' A' A ' 16' ' ' ASN . . . . . . . . . . . . 0.324 25.7 t-20 76.91 139.75 0.07 Allowed 'General case' 0 N--CA 1.469 0.496 1 C-N-CA 132.468 4.307 . . . . 0.0 109.498 . . . . . . . . . 3 2 . 1 . 005 nuclear orig full ' A' A ' 17' ' ' TYR . . . . . . . . . . . . . 24.6 t80 54.41 95.46 0.02 OUTLIER 'General case' 0 N--CA 1.47 0.541 0 CA-C-N 109.691 -3.413 . . . . 0.0 116.361 -169.469 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 18' ' ' HIS . . . . . 0.612 ' C ' ' H ' ' A' ' 20' ' ' GLU . 0.0 OUTLIER 83.57 -48.04 0.13 Allowed 'General case' 0 N--CA 1.471 0.598 0 C-N-CA 129.81 3.244 . . . . 0.0 108.043 171.002 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 4.9 tp -71.31 41.36 0.07 Allowed 'General case' 0 N--CA 1.47 0.549 1 C-N-CA 131.845 4.058 . . . . 0.0 116.819 178.34 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 20' ' ' GLU . . . . . 0.612 ' H ' ' C ' ' A' ' 18' ' ' HIS 0.253 1.1 pp20? -161.69 -47.02 0.04 OUTLIER 'General case' 0 N--CA 1.47 0.565 1 CA-C-N 102.886 -6.506 . . . . 0.0 117.062 -169.581 . . . . . . . . 4 3 . 1 . 005 nuclear orig full ' A' A ' 21' ' ' ASN . . . . . 0.419 ' H ' ' CD ' ' A' ' 20' ' ' GLU . 5.4 t-20 -92.63 63.77 4.07 Favored 'General case' 0 N--CA 1.47 0.527 0 CA-C-O 128.383 3.944 . . . . 0.0 106.854 158.808 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 11.8 mm-40 -170.15 -55.27 0.02 OUTLIER 'General case' 0 N--CA 1.47 0.552 1 C-N-CA 133.898 4.879 . . . . 0.0 108.111 -177.95 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 3.2 t -73.9 -29.97 27.12 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.545 0 CA-C-N 113.991 -1.458 . . . . 0.0 111.291 178.27 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -81.69 -26.85 34.32 Favored 'General case' 0 N--CA 1.47 0.574 0 N-CA-C 119.682 3.216 . . . . 0.0 119.682 163.909 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 11.5 mtp180 -70.78 -46.78 62.27 Favored 'General case' 0 N--CA 1.472 0.632 0 CA-C-O 113.577 -3.106 . . . . 0.0 113.861 177.615 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 1.1 mt -85.61 -149.35 0.13 Allowed 'General case' 0 N--CA 1.47 0.556 0 CA-C-O 115.052 -2.404 . . . . 0.0 106.948 168.86 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 78.9 mttt 46.33 -58.06 0.0 OUTLIER 'General case' 0 N--CA 1.47 0.549 1 C-N-CA 131.804 4.042 . . . . 0.0 120.898 163.035 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 19.5 tptm -70.43 -40.17 73.95 Favored 'General case' 0 N--CA 1.47 0.57 0 C-N-CA 123.116 0.567 . . . . 0.0 109.551 168.359 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 14.4 tp -87.54 -34.71 18.5 Favored 'General case' 0 N--CA 1.471 0.591 0 N-CA-C 117.058 2.244 . . . . 0.0 117.058 -179.518 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 48.1 t -154.01 106.49 0.2 Allowed 'Isoleucine or valine' 0 N--CA 1.47 0.573 0 C-N-CA 130.733 3.613 . . . . 0.0 108.725 -179.859 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . -48.69 -87.13 0.01 OUTLIER Glycine 0 CA--C 1.53 0.994 1 O-C-N 130.232 4.707 . . . . 0.0 113.552 172.893 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 32' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.33 -0.25 1 O-C-N 110.707 -7.349 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 15' ' ' ACE . . . . . . . . . . . . . . . . . . . . 0 C--O 1.23 0.064 . . . . . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 13.5 m-80 -148.72 45.39 1.02 Allowed 'General case' 0 N--CA 1.471 0.6 0 N-CA-C 117.998 2.592 . . . . 0.0 117.998 . . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 17' ' ' TYR . . . . . . . . . . . . 0.473 0.1 OUTLIER 54.39 109.36 0.01 OUTLIER 'General case' 0 N--CA 1.47 0.563 1 C-N-CA 136.916 6.086 . . . . 0.0 120.809 -3.712 . . . . . . . . 4 3 . 1 . 006 nuclear orig full ' A' A ' 18' ' ' HIS . . . . . 0.586 ' CE1' ' H ' ' A' ' 21' ' ' ASN 0.871 86.9 m-70 76.12 72.61 0.08 Allowed 'General case' 0 N--CA 1.469 0.518 1 CA-C-N 100.364 -7.653 . . . . 0.0 120.886 -161.519 . . . . . . . . 4 3 . 1 . 006 nuclear orig full ' A' A ' 19' ' ' LEU . . . . . . . . . . . . 0.492 2.7 tt 65.64 99.0 0.04 OUTLIER 'General case' 0 N--CA 1.47 0.542 2 N-CA-C 130.135 7.087 . . . . 0.0 130.135 -35.814 . . . . . . . . 3 2 . 1 . 006 nuclear orig full ' A' A ' 20' ' ' GLU . . . . . . . . . . . . 0.253 6.0 pt-20 75.28 6.9 4.13 Favored 'General case' 0 N--CA 1.469 0.486 3 N-CA-C 126.54 5.756 . . . . 0.0 126.54 173.009 . . . . . . . . 3 2 . 1 . 006 nuclear orig full ' A' A ' 21' ' ' ASN . . . . . 0.586 ' H ' ' CE1' ' A' ' 18' ' ' HIS . 57.8 t-20 -85.21 -81.99 0.19 Allowed 'General case' 0 N--CA 1.47 0.57 1 N-CA-C 98.397 -4.668 . . . . 0.0 98.397 141.7 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 11.5 mm-40 42.42 -95.57 0.02 OUTLIER 'General case' 0 N--CA 1.469 0.49 0 N-CA-C 116.119 1.896 . . . . 0.0 116.119 162.39 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 23' ' ' VAL . . . . . . . . . . . . 0.541 0.6 OUTLIER 14.4 -76.97 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.47 0.561 1 N-CA-C 123.365 4.579 . . . . 0.0 123.365 140.969 . . . . . . . . 4 3 . 1 . 006 nuclear orig full ' A' A ' 24' ' ' ALA . . . . . . . . . . . . 0.251 . . -76.03 36.95 0.15 Allowed 'General case' 0 N--CA 1.47 0.538 1 CA-C-N 106.582 -4.826 . . . . 0.0 116.762 167.852 . . . . . . . . 3 2 . 1 . 006 nuclear orig full ' A' A ' 25' ' ' ARG . . . . . . . . . . . . 0.353 31.5 mtp180 -163.85 -48.19 0.03 OUTLIER 'General case' 0 N--CA 1.471 0.578 0 O-C-N 119.468 -2.02 . . . . 0.0 110.002 -179.413 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 16.2 mt -77.91 -128.35 0.01 OUTLIER 'General case' 0 N--CA 1.47 0.553 0 O-C-N 125.668 1.855 . . . . 0.0 107.475 165.361 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . 0.323 46.0 mttp 23.53 -72.69 0.0 OUTLIER 'General case' 0 N--CA 1.47 0.532 0 C-N-CA 129.665 3.186 . . . . 0.0 117.792 153.76 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 28' ' ' LYS . . . . . . . . . . . . 0.369 47.4 mtpt -91.24 13.71 16.42 Favored 'General case' 0 N--CA 1.471 0.589 0 O-C-N 118.436 -2.665 . . . . 0.0 117.147 -170.086 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 40.4 tp -149.7 -47.92 0.14 Allowed 'General case' 0 N--CA 1.47 0.553 0 CA-C-N 110.726 -2.943 . . . . 0.0 108.329 -174.464 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 62.1 t -86.23 -54.56 8.07 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.582 0 C-N-CA 124.459 1.103 . . . . 0.0 113.179 -179.291 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . 160.12 -86.89 0.11 Allowed Glycine 0 CA--C 1.53 0.992 0 CA-C-O 125.888 2.938 . . . . 0.0 115.484 -173.077 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 32' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.329 -0.299 0 O-C-N 120.363 -1.669 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' A' A ' 15' ' ' ACE . . . . . . . . . . . . . . . . . . . . 0 C--O 1.23 0.059 . . . . . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' A' A ' 16' ' ' ASN . . . . . . . . . . . . 0.461 4.5 m120 74.1 -117.46 0.04 OUTLIER 'General case' 0 N--CA 1.469 0.492 1 C-N-CA 134.085 4.954 . . . . 0.0 114.128 . . . . . . . . . 3 2 . 1 . 007 nuclear orig full ' A' A ' 17' ' ' TYR . . . . . . . . . . . . 0.582 0.1 OUTLIER 49.82 -68.06 0.0 OUTLIER 'General case' 0 N--CA 1.471 0.586 1 N-CA-C 132.138 7.829 . . . . 0.0 132.138 171.383 . . . . . . . . 4 3 . 1 . 007 nuclear orig full ' A' A ' 18' ' ' HIS . . . . . . . . . . . . . 0.5 OUTLIER -149.13 -11.45 0.32 Allowed 'General case' 0 N--CA 1.47 0.529 1 O-C-N 130.487 4.867 . . . . 0.0 107.232 176.196 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 1.6 tp -78.25 -20.33 51.9 Favored 'General case' 0 N--CA 1.47 0.562 0 CA-C-O 125.616 2.626 . . . . 0.0 116.522 -171.487 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 6.4 pt-20 -74.18 -47.76 33.53 Favored 'General case' 0 N--CA 1.47 0.563 2 CA-C-N 106.613 -4.812 . . . . 0.0 122.829 161.179 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 57.3 m-80 -97.77 61.18 1.56 Allowed 'General case' 0 N--CA 1.47 0.544 0 CA-C-O 127.315 3.436 . . . . 0.0 108.552 167.471 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -163.25 -39.49 0.03 OUTLIER 'General case' 0 N--CA 1.471 0.588 0 CA-C-N 109.415 -3.538 . . . . 0.0 112.08 -179.602 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 98.2 t -68.86 -45.28 80.96 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.604 1 CA-C-O 111.268 -4.206 . . . . 0.0 107.686 155.292 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -82.03 69.91 8.84 Favored 'General case' 0 N--CA 1.47 0.557 0 N-CA-C 116.772 2.138 . . . . 0.0 116.772 159.179 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 30.4 mtt-85 -171.89 -52.42 0.02 OUTLIER 'General case' 0 N--CA 1.471 0.592 1 CA-C-N 107.822 -4.263 . . . . 0.0 109.739 175.897 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 86.9 mt -83.05 -26.79 30.8 Favored 'General case' 0 N--CA 1.47 0.527 1 O-C-N 116.068 -4.145 . . . . 0.0 110.637 -167.196 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 24.9 tptp -82.86 -27.77 30.54 Favored 'General case' 0 N--CA 1.469 0.498 0 C-N-CA 115.128 -2.629 . . . . 0.0 109.506 -169.993 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 74.0 mttt -84.5 26.83 0.76 Allowed 'General case' 0 N--CA 1.47 0.539 0 C-N-CA 128.111 2.565 . . . . 0.0 116.388 166.431 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 29' ' ' LEU . . . . . . . . . . . . 0.342 3.4 pp -147.15 -21.37 0.4 Allowed 'General case' 0 N--CA 1.47 0.542 0 CA-C-O 115.731 -2.08 . . . . 0.0 114.257 158.991 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 0.9 OUTLIER -151.44 145.27 16.32 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.579 0 CA-C-N 119.749 1.158 . . . . 0.0 111.924 170.21 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . -101.33 -43.27 2.21 Favored Glycine 0 CA--C 1.529 0.929 0 C-N-CA 128.272 2.844 . . . . 0.0 111.967 177.718 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 32' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.331 -0.232 1 O-C-N 113.688 -5.595 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 15' ' ' ACE . . . . . . . . . . . . . . . . . . . . 0 C--O 1.23 0.046 . . . . . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' A' A ' 16' ' ' ASN . . . . . . . . . . . . 0.338 25.0 t-20 44.02 90.17 0.01 OUTLIER 'General case' 0 N--CA 1.471 0.576 1 C-N-CA 135.038 5.335 . . . . 0.0 120.399 . . . . . . . . . 3 2 . 1 . 008 nuclear orig full ' A' A ' 17' ' ' TYR . . . . . 0.466 ' O ' ' CD2' ' A' ' 18' ' ' HIS . 34.0 t80 -161.9 140.16 9.13 Favored 'General case' 0 N--CA 1.471 0.592 0 CA-C-N 124.415 3.28 . . . . 0.0 109.883 12.38 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 18' ' ' HIS . . . . . 0.466 ' CD2' ' O ' ' A' ' 17' ' ' TYR 0.263 0.7 OUTLIER 77.14 29.18 0.59 Allowed 'General case' 0 N--CA 1.471 0.607 2 N-CA-C 128.05 6.315 . . . . 0.0 128.05 -176.324 . . . . . . . . 5 4 . 1 . 008 nuclear orig full ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER 74.51 0.86 3.69 Favored 'General case' 0 N--CA 1.47 0.572 2 C-N-CA 144.464 9.105 . . . . 0.0 113.977 -18.658 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 11.2 mt-10 -164.53 -77.06 0.03 OUTLIER 'General case' 0 N--CA 1.47 0.53 0 CA-C-N 112.594 -2.093 . . . . 0.0 115.56 -173.718 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 10.3 t-20 -85.98 78.07 9.53 Favored 'General case' 0 N--CA 1.47 0.569 0 N-CA-C 109.135 -0.691 . . . . 0.0 109.135 164.667 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 23.6 mt-10 -164.72 -54.4 0.03 OUTLIER 'General case' 0 N--CA 1.47 0.532 2 C-N-CA 138.718 6.807 . . . . 0.0 105.578 168.994 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 23' ' ' VAL . . . . . . . . . . . . 0.344 3.2 t -72.93 -35.52 49.21 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.478 0 CA-C-O 112.131 -3.795 . . . . 0.0 114.657 170.567 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -80.76 51.42 1.51 Allowed 'General case' 0 N--CA 1.47 0.56 0 CA-C-O 123.937 1.827 . . . . 0.0 111.448 167.918 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 46.7 mtp85 -163.8 -10.82 0.03 OUTLIER 'General case' 0 N--CA 1.47 0.565 0 N-CA-C 119.862 3.282 . . . . 0.0 119.862 178.704 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 1.7 pp -163.18 20.16 0.08 Allowed 'General case' 0 N--CA 1.469 0.497 0 N-CA-C 117.22 2.304 . . . . 0.0 117.22 177.638 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -156.49 45.46 0.42 Allowed 'General case' 0 N--CA 1.469 0.499 0 CA-C-N 112.446 -2.161 . . . . 0.0 105.433 -176.605 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 47.2 tptt 121.35 79.31 0.0 OUTLIER 'General case' 0 N--CA 1.47 0.562 1 C-N-CA 132.819 4.447 . . . . 0.0 108.008 -152.958 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 29' ' ' LEU . . . . . . . . . . . . 0.553 32.9 tp 40.29 -118.99 0.34 Allowed 'General case' 0 N--CA 1.47 0.552 1 C-N-CA 144.141 8.976 . . . . 0.0 118.569 2.691 . . . . . . . . 3 2 . 1 . 008 nuclear orig full ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 60.2 t -85.37 127.93 39.57 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.563 0 C-N-CA 129.797 3.239 . . . . 0.0 113.798 170.954 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . 146.47 88.96 0.08 OUTLIER Glycine 0 CA--C 1.53 1.002 0 CA-C-O 127.607 3.893 . . . . 0.0 114.813 179.877 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 32' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.33 -0.26 1 O-C-N 116.395 -4.003 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 15' ' ' ACE . . . . . . . . . . . . . . . . . . . . 0 C--O 1.23 0.045 . . . . . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' A' A ' 16' ' ' ASN . . . . . . . . . . . . 0.514 32.1 p30 41.47 84.81 0.02 OUTLIER 'General case' 0 N--CA 1.47 0.551 1 N-CA-C 128.069 6.322 . . . . 0.0 128.069 . . . . . . . . . 3 2 . 1 . 009 nuclear orig full ' A' A ' 17' ' ' TYR . . . . . . . . . . . . 0.961 0.0 OUTLIER 61.53 -120.9 0.76 Allowed 'General case' 0 N--CA 1.469 0.518 2 C-N-CA 136.736 6.014 . . . . 0.0 119.613 15.891 . . . . . . . . 4 3 . 1 . 009 nuclear orig full ' A' A ' 18' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -150.62 112.55 4.54 Favored 'General case' 0 N--CA 1.47 0.531 2 C-N-CA 135.058 5.343 . . . . 0.0 113.759 1.358 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 1.3 pp -152.83 84.72 1.22 Allowed 'General case' 0 N--CA 1.47 0.536 0 O-C-N 118.206 -2.809 . . . . 0.0 117.319 12.093 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 6.3 pt-20 -76.18 -51.48 12.04 Favored 'General case' 0 N--CA 1.47 0.542 1 CA-C-N 103.367 -6.288 . . . . 0.0 112.589 162.483 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 2.4 t-20 -85.02 65.07 9.05 Favored 'General case' 0 N--CA 1.469 0.518 0 CA-C-N 114.84 -1.073 . . . . 0.0 112.257 168.039 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 12.1 mm-40 -164.24 -36.81 0.03 OUTLIER 'General case' 0 N--CA 1.47 0.56 1 O-C-N 131.439 5.462 . . . . 0.0 111.384 167.13 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 95.7 t -75.31 -27.23 19.25 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.555 0 CA-C-O 113.395 -3.193 . . . . 0.0 118.952 160.467 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 24' ' ' ALA . . . . . . . . . . . . 0.287 . . -165.7 94.27 0.59 Allowed 'General case' 0 N--CA 1.47 0.534 1 O-C-N 131.329 5.393 . . . . 0.0 103.393 168.781 . . . . . . . . 3 2 . 1 . 009 nuclear orig full ' A' A ' 25' ' ' ARG . . . . . . . . . . . . 0.797 51.2 mtt85 43.38 -76.02 0.0 OUTLIER 'General case' 0 N--CA 1.47 0.545 2 N-CA-C 130.16 7.096 . . . . 0.0 130.16 -6.319 . . . . . . . . 3 2 . 1 . 009 nuclear orig full ' A' A ' 26' ' ' LEU . . . . . . . . . . . . 0.429 68.8 tp -79.94 10.12 4.6 Favored 'General case' 0 N--CA 1.47 0.559 0 O-C-N 118.789 -2.444 . . . . 0.0 110.927 -167.607 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 34.6 tptt -154.22 31.95 0.43 Allowed 'General case' 0 N--CA 1.47 0.56 0 C-N-CA 129.298 3.039 . . . . 0.0 110.866 175.209 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 13.6 mmtt -147.18 33.79 0.89 Allowed 'General case' 0 N--CA 1.47 0.541 0 CA-C-N 110.792 -2.913 . . . . 0.0 116.562 -178.038 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 25.9 tp -155.29 -47.86 0.08 Allowed 'General case' 0 N--CA 1.47 0.547 0 CA-C-N 113.521 -1.672 . . . . 0.0 111.306 -168.019 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 22.2 t -82.97 103.11 9.81 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.538 0 O-C-N 120.236 -1.54 . . . . 0.0 113.916 171.753 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . -83.54 106.39 2.82 Favored Glycine 0 CA--C 1.531 1.041 1 CA-C-O 128.499 4.388 . . . . 0.0 115.106 -158.144 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 32' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.329 -0.288 1 O-C-N 115.808 -4.348 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 15' ' ' ACE . . . . . . . . . . . . . . . . . . . . 0 C--O 1.23 0.042 . . . . . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' A' A ' 16' ' ' ASN . . . . . . . . . . . . 0.455 19.2 t-20 -98.81 -71.07 0.7 Allowed 'General case' 0 N--CA 1.471 0.596 0 N-CA-C 120.976 3.695 . . . . 0.0 120.976 . . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 17' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER 58.36 135.62 0.01 OUTLIER 'General case' 0 N--CA 1.471 0.579 2 C-N-CA 140.068 7.347 . . . . 0.0 122.267 8.283 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 18' ' ' HIS . . . . . 0.524 ' CG ' ' H ' ' A' ' 19' ' ' LEU 0.466 0.1 OUTLIER 33.85 -115.36 0.07 Allowed 'General case' 0 N--CA 1.471 0.597 0 O-C-N 128.362 3.539 . . . . 0.0 114.385 169.814 . . . . . . . . 4 4 . 1 . 010 nuclear orig full ' A' A ' 19' ' ' LEU . . . . . 0.524 ' H ' ' CG ' ' A' ' 18' ' ' HIS . 2.5 tp 50.87 -70.93 0.0 OUTLIER 'General case' 0 N--CA 1.47 0.528 1 CA-C-O 128.603 4.049 . . . . 0.0 111.113 140.009 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 2.6 pp20? -71.4 -47.15 57.86 Favored 'General case' 0 N--CA 1.47 0.531 0 C-N-CA 131.181 3.792 . . . . 0.0 117.779 -176.47 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER -93.71 -12.41 29.31 Favored 'General case' 0 N--CA 1.471 0.585 0 CA-C-O 113.739 -3.029 . . . . 0.0 114.072 171.918 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 29.8 mm-40 -63.86 -41.51 97.76 Favored 'General case' 0 N--CA 1.47 0.566 0 O-C-N 124.916 1.385 . . . . 0.0 108.165 165.407 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 53.8 t -79.27 59.24 0.14 Allowed 'Isoleucine or valine' 0 N--CA 1.471 0.585 0 O-C-N 119.035 -2.291 . . . . 0.0 115.544 166.183 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . 179.19 -33.48 0.01 OUTLIER 'General case' 0 N--CA 1.47 0.559 1 C-N-CA 134.514 5.125 . . . . 0.0 109.318 179.668 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 27.1 mtp85 -71.03 -75.08 0.13 Allowed 'General case' 0 N--CA 1.469 0.521 0 CA-C-O 117.418 -1.277 . . . . 0.0 113.539 167.178 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 26' ' ' LEU . . . . . . . . . . . . 0.405 1.0 OUTLIER 39.57 -75.28 0.0 OUTLIER 'General case' 0 N--CA 1.471 0.583 1 N-CA-C 126.058 5.577 . . . . 0.0 126.058 153.18 . . . . . . . . 4 3 . 1 . 010 nuclear orig full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . 0.265 35.4 tttt -85.47 -15.24 43.54 Favored 'General case' 0 N--CA 1.47 0.548 1 CA-C-N 106.157 -5.02 . . . . 0.0 112.449 -178.059 . . . . . . . . 3 2 . 1 . 010 nuclear orig full ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 58.3 mttp -92.11 18.4 8.13 Favored 'General case' 0 N--CA 1.471 0.585 0 O-C-N 119.13 -2.232 . . . . 0.0 114.724 170.259 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 13.0 tp -150.08 -46.88 0.13 Allowed 'General case' 0 N--CA 1.47 0.534 0 CA-C-O 114.467 -2.682 . . . . 0.0 109.576 -173.171 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 30' ' ' VAL . . . . . . . . . . . . 0.438 2.0 t -96.76 -88.27 0.12 Allowed 'Isoleucine or valine' 0 N--CA 1.47 0.533 0 N-CA-C 118.096 2.628 . . . . 0.0 118.096 -172.183 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . -123.54 69.51 0.46 Allowed Glycine 0 CA--C 1.53 1.011 0 O-C-N 127.11 2.756 . . . . 0.0 106.295 179.95 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 32' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.33 -0.268 0 CA-C-N 119.36 1.58 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 001 nuclear build core ' A' A ' 18' ' ' HIS . . . . . . . . . . . . 0.675 0.0 OUTLIER . . . . . 0 N--CA 1.469 0.51 0 CA-C-O 116.301 -1.809 . . . . 0.0 109.919 . . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER 51.49 -71.33 0.01 OUTLIER 'General case' 0 N--CA 1.47 0.567 0 C-N-CA 127.137 2.175 . . . . 0.0 114.913 146.263 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 20' ' ' GLU . . . . . 0.49 ' CD ' ' H ' ' A' ' 21' ' ' ASN . 2.7 pp20? -81.42 -61.88 1.81 Allowed 'General case' 0 N--CA 1.47 0.529 0 CA-C-N 110.897 -2.865 . . . . 0.0 116.108 174.994 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 21' ' ' ASN . . . . . 0.49 ' H ' ' CD ' ' A' ' 20' ' ' GLU 0.293 5.5 m-80 -83.7 68.39 9.85 Favored 'General case' 0 N--CA 1.47 0.526 0 CA-C-O 121.747 0.784 . . . . 0.0 109.633 163.635 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 1.5 tm-20 -166.56 -37.01 0.03 OUTLIER 'General case' 0 N--CA 1.471 0.58 0 CA-C-N 109.56 -3.473 . . . . 0.0 110.311 175.066 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 60.6 t -74.32 -44.03 49.18 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.553 0 CA-C-N 119.192 0.906 . . . . 0.0 111.807 163.408 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -68.77 -12.57 61.63 Favored 'General case' 0 N--CA 1.47 0.568 0 O-C-N 125.98 2.05 . . . . 0.0 113.399 176.182 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 25' ' ' ARG . . . . . . . . . . . . 0.37 15.8 mtp180 -76.09 -131.57 0.01 OUTLIER 'General case' 0 N--CA 1.471 0.576 0 N-CA-C 106.031 -1.841 . . . . 0.0 106.031 150.777 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 26' ' ' LEU . . . . . . . . . . . . 0.473 0.2 OUTLIER 42.22 -77.35 0.0 OUTLIER 'General case' 0 N--CA 1.47 0.572 1 N-CA-C 122.423 4.231 . . . . 0.0 122.423 157.358 . . . . . . . . 4 3 . 1 . 001 nuclear build core ' A' A ' 27' ' ' LYS . . . . . 0.414 ' HE3' ' HB2' ' A' ' 27' ' ' LYS . 5.7 ttmt -79.44 -24.32 42.55 Favored 'General case' 0 N--CA 1.469 0.517 0 CA-C-N 113.009 -1.905 . . . . 0.0 108.925 -168.692 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 48.0 mttt -76.98 -36.67 56.27 Favored 'General case' 0 N--CA 1.47 0.55 0 C-N-CA 126.384 1.874 . . . . 0.0 115.695 -179.044 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 22.9 mt -80.42 -36.72 33.33 Favored 'General case' 0 N--CA 1.47 0.547 0 CA-C-N 110.329 -3.123 . . . . 0.0 111.87 171.789 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 22.1 t . . . . . 0 N--CA 1.47 0.572 0 CA-C-O 115.873 -2.013 . . . . 0.0 112.349 178.367 . . . . . . . . 0 0 . 1 . 002 nuclear build core ' A' A ' 18' ' ' HIS . . . . . . . . . . . . 0.522 0.0 OUTLIER . . . . . 0 N--CA 1.471 0.583 1 N-CA-C 123.534 4.642 . . . . 0.0 123.534 . . . . . . . . . 3 2 . 1 . 002 nuclear build core ' A' A ' 19' ' ' LEU . . . . . 0.558 HD22 ' HG3' ' A' ' 22' ' ' GLU 0.321 1.5 tm? -76.86 -10.85 59.66 Favored 'General case' 0 N--CA 1.469 0.496 0 CA-C-O 124.373 2.035 . . . . 0.0 113.183 -149.429 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 9.7 pt-20 -58.89 -23.17 60.74 Favored 'General case' 0 N--CA 1.47 0.566 0 O-C-N 118.001 -2.937 . . . . 0.0 114.056 169.099 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 12.9 t-20 -81.77 -25.14 35.55 Favored 'General case' 0 N--CA 1.47 0.563 0 C-N-CA 124.225 1.01 . . . . 0.0 109.709 -173.471 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 22' ' ' GLU . . . . . 0.558 ' HG3' HD22 ' A' ' 19' ' ' LEU . 10.2 mm-40 -71.15 -24.62 62.29 Favored 'General case' 0 N--CA 1.47 0.572 0 C-N-CA 128.208 2.603 . . . . 0.0 111.407 178.96 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 21.8 t -73.9 -54.46 15.04 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.542 0 CA-C-N 110.48 -3.054 . . . . 0.0 114.655 167.543 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -69.56 -15.07 63.16 Favored 'General case' 0 N--CA 1.47 0.569 0 CA-C-O 123.065 1.412 . . . . 0.0 114.764 174.643 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 6.7 mtt180 -71.19 -44.52 65.27 Favored 'General case' 0 N--CA 1.47 0.561 0 O-C-N 117.297 -3.377 . . . . 0.0 114.065 164.743 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 26' ' ' LEU . . . . . . . . . . . . 0.32 4.5 mm? -71.32 -41.1 70.28 Favored 'General case' 0 N--CA 1.47 0.552 0 N-CA-C 119.299 3.074 . . . . 0.0 119.299 172.959 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 52.2 mmtt -87.05 45.79 1.31 Allowed 'General case' 0 N--CA 1.47 0.556 0 C-N-CA 126.678 1.991 . . . . 0.0 108.914 -172.113 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 36.5 mttm -158.33 -39.02 0.06 Allowed 'General case' 0 N--CA 1.47 0.526 1 C-N-CA 132.769 4.428 . . . . 0.0 113.731 176.596 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 9.6 tp -82.1 -50.24 9.28 Favored 'General case' 0 N--CA 1.471 0.608 0 O-C-N 120.983 -1.073 . . . . 0.0 108.64 173.242 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 3.2 m . . . . . 0 N--CA 1.47 0.569 0 CA-C-O 127.828 3.68 . . . . 0.0 112.735 -178.19 . . . . . . . . 0 0 . 1 . 003 nuclear build core ' A' A ' 18' ' ' HIS . . . . . 0.468 ' ND1' ' HB2' ' A' ' 19' ' ' LEU 0.355 0.0 OUTLIER . . . . . 0 N--CA 1.47 0.541 1 N-CA-C 124.069 4.84 . . . . 0.0 124.069 . . . . . . . . . 4 3 . 1 . 003 nuclear build core ' A' A ' 19' ' ' LEU . . . . . 0.468 ' HB2' ' ND1' ' A' ' 18' ' ' HIS 0.34 0.2 OUTLIER 66.44 -48.69 0.44 Allowed 'General case' 0 N--CA 1.469 0.522 0 C-N-CA 130.169 3.388 . . . . 0.0 115.741 170.59 . . . . . . . . 4 4 . 1 . 003 nuclear build core ' A' A ' 20' ' ' GLU . . . . . . . . . . . . 0.279 19.7 mt-10 -83.64 -48.78 9.83 Favored 'General case' 0 N--CA 1.47 0.554 0 C-N-CA 131.105 3.762 . . . . 0.0 107.637 169.237 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 21' ' ' ASN . . . . . 0.52 ' O ' ' HG2' ' A' ' 22' ' ' GLU . 12.7 m120 -88.51 67.48 8.54 Favored 'General case' 0 N--CA 1.47 0.553 0 CA-C-N 113.275 -1.784 . . . . 0.0 107.362 172.301 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 22' ' ' GLU . . . . . 0.543 ' O ' ' HB2' ' A' ' 25' ' ' ARG . 6.3 mm-40 -175.3 -56.78 0.01 OUTLIER 'General case' 0 N--CA 1.469 0.498 2 C-N-CA 137.266 6.226 . . . . 0.0 109.632 -172.215 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 23' ' ' VAL . . . . . . . . . . . . 0.367 22.4 t -75.42 -37.69 38.5 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.575 0 O-C-N 127.609 3.068 . . . . 0.0 114.495 171.429 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -80.6 42.1 0.59 Allowed 'General case' 0 N--CA 1.47 0.55 0 CA-C-N 112.857 -1.974 . . . . 0.0 112.467 162.161 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 25' ' ' ARG . . . . . 0.543 ' HB2' ' O ' ' A' ' 22' ' ' GLU 0.348 17.3 mtt180 -154.99 18.01 0.43 Allowed 'General case' 0 N--CA 1.471 0.588 0 CA-C-N 114.821 -1.081 . . . . 0.0 111.233 168.355 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 4.3 tp -170.35 29.23 0.02 OUTLIER 'General case' 0 N--CA 1.471 0.581 0 CA-C-O 124.727 2.203 . . . . 0.0 111.146 -172.875 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 27.2 tptt -154.07 -20.43 0.13 Allowed 'General case' 0 N--CA 1.469 0.497 0 C-N-CA 129.011 2.925 . . . . 0.0 116.357 178.879 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 16.3 ptmt -153.28 58.84 0.77 Allowed 'General case' 0 N--CA 1.47 0.568 0 CA-C-N 124.168 3.167 . . . . 0.0 107.99 171.97 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 29' ' ' LEU . . . . . 0.462 ' HG ' HG23 ' A' ' 30' ' ' VAL 0.431 12.1 tp 36.62 -82.7 0.0 OUTLIER 'General case' 0 N--CA 1.471 0.612 3 C-N-CA 138.541 6.736 . . . . 0.0 127.759 29.293 . . . . . . . . 4 3 . 1 . 003 nuclear build core ' A' A ' 30' ' ' VAL . . . . . 0.462 HG23 ' HG ' ' A' ' 29' ' ' LEU . 45.2 t . . . . . 0 N--CA 1.47 0.563 0 O-C-N 125.875 1.984 . . . . 0.0 109.807 -174.403 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 18' ' ' HIS . . . . . 0.854 ' CD2' ' HB2' ' A' ' 19' ' ' LEU . 0.0 OUTLIER . . . . . 0 N--CA 1.47 0.574 0 N-CA-C 116.39 1.996 . . . . 0.0 116.39 . . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 19' ' ' LEU . . . . . 0.854 ' HB2' ' CD2' ' A' ' 18' ' ' HIS 0.317 1.5 tp -160.06 111.47 1.96 Allowed 'General case' 0 N--CA 1.47 0.553 0 CA-C-O 128.06 3.79 . . . . 0.0 110.503 28.982 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 20' ' ' GLU . . . . . 0.725 ' OE2' ' HB2' ' A' ' 21' ' ' ASN . 0.0 OUTLIER -164.08 -48.31 0.03 OUTLIER 'General case' 0 N--CA 1.469 0.505 1 CA-C-N 104.112 -5.949 . . . . 0.0 115.953 -155.28 . . . . . . . . 4 4 . 1 . 004 nuclear build core ' A' A ' 21' ' ' ASN . . . . . 0.725 ' HB2' ' OE2' ' A' ' 20' ' ' GLU 0.297 21.9 t30 -86.52 49.08 1.73 Allowed 'General case' 0 N--CA 1.47 0.549 1 CA-C-O 130.841 5.115 . . . . 0.0 111.637 176.374 . . . . . . . . 4 3 . 1 . 004 nuclear build core ' A' A ' 22' ' ' GLU . . . . . 0.442 ' HA ' ' HB2' ' A' ' 25' ' ' ARG . 10.3 mt-10 -164.38 -39.76 0.03 OUTLIER 'General case' 0 N--CA 1.469 0.523 1 CA-C-N 106.201 -5.0 . . . . 0.0 117.198 -172.409 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 23' ' ' VAL . . . . . 0.454 ' C ' ' H ' ' A' ' 25' ' ' ARG . 41.3 t -61.84 -48.81 86.91 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.538 0 O-C-N 119.495 -2.003 . . . . 0.0 112.42 148.76 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -86.73 31.17 0.69 Allowed 'General case' 0 N--CA 1.469 0.496 0 CA-C-O 126.791 3.186 . . . . 0.0 112.174 176.331 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 25' ' ' ARG . . . . . 0.454 ' H ' ' C ' ' A' ' 23' ' ' VAL . 15.0 mtp180 -165.33 55.63 0.12 Allowed 'General case' 0 N--CA 1.47 0.538 0 CA-C-N 108.492 -3.958 . . . . 0.0 114.254 173.806 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 26' ' ' LEU . . . . . 0.441 HD12 ' HA ' ' A' ' 26' ' ' LEU . 5.5 tp -179.37 -53.54 0.01 OUTLIER 'General case' 0 N--CA 1.47 0.56 1 CA-C-N 105.333 -5.394 . . . . 0.0 116.017 174.833 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . 0.269 0.1 OUTLIER -86.46 -27.96 23.77 Favored 'General case' 0 N--CA 1.47 0.541 0 N-CA-C 115.567 1.691 . . . . 0.0 115.567 -168.126 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 73.0 mmtt -81.61 -29.56 33.25 Favored 'General case' 0 N--CA 1.47 0.543 0 O-C-N 118.681 -2.512 . . . . 0.0 108.45 178.246 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 38.2 tp -82.8 -43.63 16.48 Favored 'General case' 0 N--CA 1.471 0.589 0 CA-C-N 122.274 2.306 . . . . 0.0 116.193 161.944 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 30' ' ' VAL . . . . . . . . . . . . 0.332 1.1 t . . . . . 0 N--CA 1.47 0.561 0 O-C-N 119.268 -2.145 . . . . 0.0 107.934 175.424 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 18' ' ' HIS . . . . . 0.453 ' C ' ' H ' ' A' ' 20' ' ' GLU . 0.0 OUTLIER . . . . . 0 N--CA 1.471 0.598 0 CA-C-O 122.872 1.32 . . . . 0.0 108.043 . . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 19' ' ' LEU . . . . . 0.437 ' HA ' HD12 ' A' ' 19' ' ' LEU . 4.9 tp -71.31 41.36 0.07 Allowed 'General case' 0 N--CA 1.47 0.549 1 C-N-CA 131.845 4.058 . . . . 0.0 116.819 178.34 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 20' ' ' GLU . . . . . 0.453 ' H ' ' C ' ' A' ' 18' ' ' HIS 0.253 1.1 pp20? -161.69 -47.02 0.04 OUTLIER 'General case' 0 N--CA 1.47 0.565 1 CA-C-N 102.886 -6.506 . . . . 0.0 117.062 -169.581 . . . . . . . . 4 3 . 1 . 005 nuclear build core ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 5.4 t-20 -92.63 63.77 4.07 Favored 'General case' 0 N--CA 1.47 0.527 0 CA-C-O 128.383 3.944 . . . . 0.0 106.854 158.808 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 11.8 mm-40 -170.15 -55.27 0.02 OUTLIER 'General case' 0 N--CA 1.47 0.552 1 C-N-CA 133.898 4.879 . . . . 0.0 108.111 -177.95 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 3.2 t -73.9 -29.97 27.12 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.545 0 CA-C-N 113.991 -1.458 . . . . 0.0 111.291 178.27 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -81.69 -26.85 34.32 Favored 'General case' 0 N--CA 1.47 0.574 0 N-CA-C 119.682 3.216 . . . . 0.0 119.682 163.909 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 11.5 mtp180 -70.78 -46.78 62.27 Favored 'General case' 0 N--CA 1.472 0.632 0 CA-C-O 113.577 -3.106 . . . . 0.0 113.861 177.615 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 1.1 mt -85.61 -149.35 0.13 Allowed 'General case' 0 N--CA 1.47 0.556 0 CA-C-O 115.052 -2.404 . . . . 0.0 106.948 168.86 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 78.9 mttt 46.33 -58.06 0.0 OUTLIER 'General case' 0 N--CA 1.47 0.549 1 C-N-CA 131.804 4.042 . . . . 0.0 120.898 163.035 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 19.5 tptm -70.43 -40.17 73.95 Favored 'General case' 0 N--CA 1.47 0.57 0 C-N-CA 123.116 0.567 . . . . 0.0 109.551 168.359 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 29' ' ' LEU . . . . . 0.545 ' HG ' HG23 ' A' ' 30' ' ' VAL . 14.4 tp -87.54 -34.71 18.5 Favored 'General case' 0 N--CA 1.471 0.591 0 N-CA-C 117.058 2.244 . . . . 0.0 117.058 -179.518 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 30' ' ' VAL . . . . . 0.545 HG23 ' HG ' ' A' ' 29' ' ' LEU . 48.1 t . . . . . 0 N--CA 1.47 0.573 0 C-N-CA 130.733 3.613 . . . . 0.0 108.725 -179.859 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 18' ' ' HIS . . . . . 0.435 ' CD2' ' H ' ' A' ' 21' ' ' ASN 0.871 70.9 m80 . . . . . 0 N--CA 1.469 0.518 0 N-CA-C 120.886 3.661 . . . . 0.0 120.886 . . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 19' ' ' LEU . . . . . 0.642 ' H ' ' HG3' ' A' ' 22' ' ' GLU 0.492 2.7 tt 65.64 99.0 0.04 OUTLIER 'General case' 0 N--CA 1.47 0.542 2 N-CA-C 130.135 7.087 . . . . 0.0 130.135 -35.814 . . . . . . . . 4 3 . 1 . 006 nuclear build core ' A' A ' 20' ' ' GLU . . . . . . . . . . . . 0.253 6.0 pt-20 75.28 6.9 4.13 Favored 'General case' 0 N--CA 1.469 0.486 3 N-CA-C 126.54 5.756 . . . . 0.0 126.54 173.009 . . . . . . . . 3 2 . 1 . 006 nuclear build core ' A' A ' 21' ' ' ASN . . . . . 0.435 ' H ' ' CD2' ' A' ' 18' ' ' HIS . 57.8 t-20 -85.21 -81.99 0.19 Allowed 'General case' 0 N--CA 1.47 0.57 1 N-CA-C 98.397 -4.668 . . . . 0.0 98.397 141.7 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 22' ' ' GLU . . . . . 0.642 ' HG3' ' H ' ' A' ' 19' ' ' LEU . 11.5 mm-40 42.42 -95.57 0.02 OUTLIER 'General case' 0 N--CA 1.469 0.49 0 N-CA-C 116.119 1.896 . . . . 0.0 116.119 162.39 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 23' ' ' VAL . . . . . . . . . . . . 0.541 0.6 OUTLIER 14.4 -76.97 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.47 0.561 1 N-CA-C 123.365 4.579 . . . . 0.0 123.365 140.969 . . . . . . . . 4 3 . 1 . 006 nuclear build core ' A' A ' 24' ' ' ALA . . . . . . . . . . . . 0.251 . . -76.03 36.95 0.15 Allowed 'General case' 0 N--CA 1.47 0.538 1 CA-C-N 106.582 -4.826 . . . . 0.0 116.762 167.852 . . . . . . . . 3 2 . 1 . 006 nuclear build core ' A' A ' 25' ' ' ARG . . . . . . . . . . . . 0.353 31.5 mtp180 -163.85 -48.19 0.03 OUTLIER 'General case' 0 N--CA 1.471 0.578 0 O-C-N 119.468 -2.02 . . . . 0.0 110.002 -179.413 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 16.2 mt -77.91 -128.35 0.01 OUTLIER 'General case' 0 N--CA 1.47 0.553 0 O-C-N 125.668 1.855 . . . . 0.0 107.475 165.361 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . 0.323 46.0 mttp 23.53 -72.69 0.0 OUTLIER 'General case' 0 N--CA 1.47 0.532 0 C-N-CA 129.665 3.186 . . . . 0.0 117.792 153.76 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 28' ' ' LYS . . . . . . . . . . . . 0.369 47.4 mtpt -91.24 13.71 16.42 Favored 'General case' 0 N--CA 1.471 0.589 0 O-C-N 118.436 -2.665 . . . . 0.0 117.147 -170.086 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 40.4 tp -149.7 -47.92 0.14 Allowed 'General case' 0 N--CA 1.47 0.553 0 CA-C-N 110.726 -2.943 . . . . 0.0 108.329 -174.464 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 62.1 t . . . . . 0 N--CA 1.471 0.582 0 C-N-CA 124.459 1.103 . . . . 0.0 113.179 -179.291 . . . . . . . . 0 0 . 1 . 007 nuclear build core ' A' A ' 18' ' ' HIS . . . . . 0.475 ' CE1' HD13 ' A' ' 19' ' ' LEU . 0.0 OUTLIER . . . . . 0 N--CA 1.47 0.529 0 CA-C-O 114.24 -2.791 . . . . 0.0 107.232 . . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 19' ' ' LEU . . . . . 0.502 ' HA ' HD12 ' A' ' 19' ' ' LEU . 1.6 tp -78.25 -20.33 51.9 Favored 'General case' 0 N--CA 1.47 0.562 0 CA-C-O 125.616 2.626 . . . . 0.0 116.522 -171.487 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 20' ' ' GLU . . . . . 0.414 ' HG2' ' H ' ' A' ' 20' ' ' GLU . 6.4 pt-20 -74.18 -47.76 33.53 Favored 'General case' 0 N--CA 1.47 0.563 2 CA-C-N 106.613 -4.812 . . . . 0.0 122.829 161.179 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 57.3 m-80 -97.77 61.18 1.56 Allowed 'General case' 0 N--CA 1.47 0.544 0 CA-C-O 127.315 3.436 . . . . 0.0 108.552 167.471 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -163.25 -39.49 0.03 OUTLIER 'General case' 0 N--CA 1.471 0.588 0 CA-C-N 109.415 -3.538 . . . . 0.0 112.08 -179.602 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 98.2 t -68.86 -45.28 80.96 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.604 1 CA-C-O 111.268 -4.206 . . . . 0.0 107.686 155.292 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -82.03 69.91 8.84 Favored 'General case' 0 N--CA 1.47 0.557 0 N-CA-C 116.772 2.138 . . . . 0.0 116.772 159.179 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 30.4 mtt-85 -171.89 -52.42 0.02 OUTLIER 'General case' 0 N--CA 1.471 0.592 1 CA-C-N 107.822 -4.263 . . . . 0.0 109.739 175.897 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 86.9 mt -83.05 -26.79 30.8 Favored 'General case' 0 N--CA 1.47 0.527 1 O-C-N 116.068 -4.145 . . . . 0.0 110.637 -167.196 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 24.9 tptp -82.86 -27.77 30.54 Favored 'General case' 0 N--CA 1.469 0.498 0 C-N-CA 115.128 -2.629 . . . . 0.0 109.506 -169.993 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 74.0 mttt -84.5 26.83 0.76 Allowed 'General case' 0 N--CA 1.47 0.539 0 C-N-CA 128.111 2.565 . . . . 0.0 116.388 166.431 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 29' ' ' LEU . . . . . 0.417 HD12 HG22 ' A' ' 30' ' ' VAL 0.342 3.4 pp -147.15 -21.37 0.4 Allowed 'General case' 0 N--CA 1.47 0.542 0 CA-C-O 115.731 -2.08 . . . . 0.0 114.257 158.991 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 30' ' ' VAL . . . . . 0.417 HG22 HD12 ' A' ' 29' ' ' LEU . 0.9 OUTLIER . . . . . 0 N--CA 1.471 0.579 0 CA-C-N 119.749 1.158 . . . . 0.0 111.924 170.21 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 18' ' ' HIS . . . . . . . . . . . . 0.263 0.0 OUTLIER . . . . . 0 N--CA 1.471 0.607 1 N-CA-C 128.05 6.315 . . . . 0.0 128.05 . . . . . . . . . 3 2 . 1 . 008 nuclear build core ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER 74.51 0.86 3.69 Favored 'General case' 0 N--CA 1.47 0.572 2 C-N-CA 144.464 9.105 . . . . 0.0 113.977 -18.658 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 11.2 mt-10 -164.53 -77.06 0.03 OUTLIER 'General case' 0 N--CA 1.47 0.53 0 CA-C-N 112.594 -2.093 . . . . 0.0 115.56 -173.718 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 10.3 t-20 -85.98 78.07 9.53 Favored 'General case' 0 N--CA 1.47 0.569 0 N-CA-C 109.135 -0.691 . . . . 0.0 109.135 164.667 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 23.6 mt-10 -164.72 -54.4 0.03 OUTLIER 'General case' 0 N--CA 1.47 0.532 2 C-N-CA 138.718 6.807 . . . . 0.0 105.578 168.994 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 23' ' ' VAL . . . . . 0.599 HG13 ' HB3' ' A' ' 27' ' ' LYS 0.344 3.2 t -72.93 -35.52 49.21 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.478 0 CA-C-O 112.131 -3.795 . . . . 0.0 114.657 170.567 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -80.76 51.42 1.51 Allowed 'General case' 0 N--CA 1.47 0.56 0 CA-C-O 123.937 1.827 . . . . 0.0 111.448 167.918 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 46.7 mtp85 -163.8 -10.82 0.03 OUTLIER 'General case' 0 N--CA 1.47 0.565 0 N-CA-C 119.862 3.282 . . . . 0.0 119.862 178.704 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 1.7 pp -163.18 20.16 0.08 Allowed 'General case' 0 N--CA 1.469 0.497 0 N-CA-C 117.22 2.304 . . . . 0.0 117.22 177.638 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 27' ' ' LYS . . . . . 0.599 ' HB3' HG13 ' A' ' 23' ' ' VAL . 0.3 OUTLIER -156.49 45.46 0.42 Allowed 'General case' 0 N--CA 1.469 0.499 0 CA-C-N 112.446 -2.161 . . . . 0.0 105.433 -176.605 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 47.2 tptt 121.35 79.31 0.0 OUTLIER 'General case' 0 N--CA 1.47 0.562 1 C-N-CA 132.819 4.447 . . . . 0.0 108.008 -152.958 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 29' ' ' LEU . . . . . 0.406 ' HG ' ' H ' ' A' ' 30' ' ' VAL 0.553 32.9 tp 40.29 -118.99 0.34 Allowed 'General case' 0 N--CA 1.47 0.552 1 C-N-CA 144.141 8.976 . . . . 0.0 118.569 2.691 . . . . . . . . 4 3 . 1 . 008 nuclear build core ' A' A ' 30' ' ' VAL . . . . . 0.406 ' H ' ' HG ' ' A' ' 29' ' ' LEU . 60.2 t . . . . . 0 N--CA 1.47 0.563 0 C-N-CA 129.797 3.239 . . . . 0.0 113.798 170.954 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 18' ' ' HIS . . . . . 0.525 ' ND1' ' HB3' ' A' ' 19' ' ' LEU . 0.1 OUTLIER . . . . . 0 N--CA 1.47 0.531 0 CA-C-O 124.209 1.957 . . . . 0.0 113.759 . . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 19' ' ' LEU . . . . . 0.65 ' HB2' ' HB2' ' A' ' 22' ' ' GLU . 1.3 pp -152.83 84.72 1.22 Allowed 'General case' 0 N--CA 1.47 0.536 0 O-C-N 118.206 -2.809 . . . . 0.0 117.319 12.093 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 20' ' ' GLU . . . . . 0.607 ' HG3' ' H ' ' A' ' 21' ' ' ASN . 6.3 pt-20 -76.18 -51.48 12.04 Favored 'General case' 0 N--CA 1.47 0.542 1 CA-C-N 103.367 -6.288 . . . . 0.0 112.589 162.483 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 21' ' ' ASN . . . . . 0.607 ' H ' ' HG3' ' A' ' 20' ' ' GLU . 2.4 t-20 -85.02 65.07 9.05 Favored 'General case' 0 N--CA 1.469 0.518 0 CA-C-N 114.84 -1.073 . . . . 0.0 112.257 168.039 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 22' ' ' GLU . . . . . 0.65 ' HB2' ' HB2' ' A' ' 19' ' ' LEU . 12.1 mm-40 -164.24 -36.81 0.03 OUTLIER 'General case' 0 N--CA 1.47 0.56 1 O-C-N 131.439 5.462 . . . . 0.0 111.384 167.13 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 95.7 t -75.31 -27.23 19.25 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.555 0 CA-C-O 113.395 -3.193 . . . . 0.0 118.952 160.467 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 24' ' ' ALA . . . . . . . . . . . . 0.287 . . -165.7 94.27 0.59 Allowed 'General case' 0 N--CA 1.47 0.534 1 O-C-N 131.329 5.393 . . . . 0.0 103.393 168.781 . . . . . . . . 3 2 . 1 . 009 nuclear build core ' A' A ' 25' ' ' ARG . . . . . 0.498 ' HG3' ' OD1' ' A' ' 21' ' ' ASN 0.797 51.2 mtt85 43.38 -76.02 0.0 OUTLIER 'General case' 0 N--CA 1.47 0.545 2 N-CA-C 130.16 7.096 . . . . 0.0 130.16 -6.319 . . . . . . . . 4 3 . 1 . 009 nuclear build core ' A' A ' 26' ' ' LEU . . . . . . . . . . . . 0.429 68.8 tp -79.94 10.12 4.6 Favored 'General case' 0 N--CA 1.47 0.559 0 O-C-N 118.789 -2.444 . . . . 0.0 110.927 -167.607 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 34.6 tptt -154.22 31.95 0.43 Allowed 'General case' 0 N--CA 1.47 0.56 0 C-N-CA 129.298 3.039 . . . . 0.0 110.866 175.209 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 13.6 mmtt -147.18 33.79 0.89 Allowed 'General case' 0 N--CA 1.47 0.541 0 CA-C-N 110.792 -2.913 . . . . 0.0 116.562 -178.038 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 25.9 tp -155.29 -47.86 0.08 Allowed 'General case' 0 N--CA 1.47 0.547 0 CA-C-N 113.521 -1.672 . . . . 0.0 111.306 -168.019 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 22.2 t . . . . . 0 N--CA 1.47 0.538 0 O-C-N 120.236 -1.54 . . . . 0.0 113.916 171.753 . . . . . . . . 0 0 . 1 . 010 nuclear build core ' A' A ' 18' ' ' HIS . . . . . 0.411 ' CG ' ' N ' ' A' ' 19' ' ' LEU 0.466 0.1 OUTLIER . . . . . 0 N--CA 1.471 0.597 0 CA-C-O 114.668 -2.587 . . . . 0.0 114.385 . . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 19' ' ' LEU . . . . . 0.535 ' HA ' HD12 ' A' ' 19' ' ' LEU . 2.5 tp 50.87 -70.93 0.0 OUTLIER 'General case' 0 N--CA 1.47 0.528 1 CA-C-O 128.603 4.049 . . . . 0.0 111.113 140.009 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 2.6 pp20? -71.4 -47.15 57.86 Favored 'General case' 0 N--CA 1.47 0.531 0 C-N-CA 131.181 3.792 . . . . 0.0 117.779 -176.47 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 21' ' ' ASN . . . . . 0.444 ' O ' ' HG3' ' A' ' 25' ' ' ARG . 1.3 m120 -93.71 -12.41 29.31 Favored 'General case' 0 N--CA 1.471 0.585 0 CA-C-O 113.739 -3.029 . . . . 0.0 114.072 171.918 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 22' ' ' GLU . . . . . 0.448 ' O ' ' HB2' ' A' ' 26' ' ' LEU . 29.8 mm-40 -63.86 -41.51 97.76 Favored 'General case' 0 N--CA 1.47 0.566 0 O-C-N 124.916 1.385 . . . . 0.0 108.165 165.407 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 53.8 t -79.27 59.24 0.14 Allowed 'Isoleucine or valine' 0 N--CA 1.471 0.585 0 O-C-N 119.035 -2.291 . . . . 0.0 115.544 166.183 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . 179.19 -33.48 0.01 OUTLIER 'General case' 0 N--CA 1.47 0.559 1 C-N-CA 134.514 5.125 . . . . 0.0 109.318 179.668 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 25' ' ' ARG . . . . . 0.444 ' HG3' ' O ' ' A' ' 21' ' ' ASN . 27.1 mtp85 -71.03 -75.08 0.13 Allowed 'General case' 0 N--CA 1.469 0.521 0 CA-C-O 117.418 -1.277 . . . . 0.0 113.539 167.178 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 26' ' ' LEU . . . . . 0.48 ' HA ' HD12 ' A' ' 26' ' ' LEU 0.405 1.0 OUTLIER 39.57 -75.28 0.0 OUTLIER 'General case' 0 N--CA 1.471 0.583 1 N-CA-C 126.058 5.577 . . . . 0.0 126.058 153.18 . . . . . . . . 5 4 . 1 . 010 nuclear build core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . 0.265 35.4 tttt -85.47 -15.24 43.54 Favored 'General case' 0 N--CA 1.47 0.548 1 CA-C-N 106.157 -5.02 . . . . 0.0 112.449 -178.059 . . . . . . . . 3 2 . 1 . 010 nuclear build core ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 58.3 mttp -92.11 18.4 8.13 Favored 'General case' 0 N--CA 1.471 0.585 0 O-C-N 119.13 -2.232 . . . . 0.0 114.724 170.259 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 13.0 tp -150.08 -46.88 0.13 Allowed 'General case' 0 N--CA 1.47 0.534 0 CA-C-O 114.467 -2.682 . . . . 0.0 109.576 -173.171 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 30' ' ' VAL . . . . . . . . . . . . 0.438 2.0 t . . . . . 0 N--CA 1.47 0.533 0 N-CA-C 118.096 2.628 . . . . 0.0 118.096 -172.183 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 15' ' ' ACE . . . . . . . . . . . . . . . . . . . . 0 C--O 1.231 0.084 . . . . . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 001 nuclear build full ' A' A ' 16' ' ' ASN . . . . . 0.585 ' HB3' ' HB3' ' A' ' 17' ' ' TYR 0.365 61.4 t30 -98.47 -72.74 0.64 Allowed 'General case' 0 N--CA 1.471 0.589 0 C-N-CA 127.299 2.24 . . . . 0.0 114.887 . . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 17' ' ' TYR . . . . . 0.664 ' O ' ' HB2' ' A' ' 19' ' ' LEU . 4.1 t80 62.04 153.56 0.03 OUTLIER 'General case' 0 N--CA 1.47 0.541 2 C-N-CA 142.825 8.45 . . . . 0.0 118.94 -12.185 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 18' ' ' HIS . . . . . . . . . . . . 0.675 0.0 OUTLIER 34.59 -127.61 0.09 Allowed 'General case' 0 N--CA 1.469 0.51 0 CA-C-O 116.301 -1.809 . . . . 0.0 109.919 -178.005 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 19' ' ' LEU . . . . . 0.664 ' HB2' ' O ' ' A' ' 17' ' ' TYR . 0.1 OUTLIER 51.49 -71.33 0.01 OUTLIER 'General case' 0 N--CA 1.47 0.567 0 C-N-CA 127.137 2.175 . . . . 0.0 114.913 146.263 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 20' ' ' GLU . . . . . 0.49 ' CD ' ' H ' ' A' ' 21' ' ' ASN . 2.7 pp20? -81.42 -61.88 1.81 Allowed 'General case' 0 N--CA 1.47 0.529 0 CA-C-N 110.897 -2.865 . . . . 0.0 116.108 174.994 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 21' ' ' ASN . . . . . 0.49 ' H ' ' CD ' ' A' ' 20' ' ' GLU 0.293 5.5 m-80 -83.7 68.39 9.85 Favored 'General case' 0 N--CA 1.47 0.526 0 CA-C-O 121.747 0.784 . . . . 0.0 109.633 163.635 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 1.5 tm-20 -166.56 -37.01 0.03 OUTLIER 'General case' 0 N--CA 1.471 0.58 0 CA-C-N 109.56 -3.473 . . . . 0.0 110.311 175.066 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 60.6 t -74.32 -44.03 49.18 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.553 0 CA-C-N 119.192 0.906 . . . . 0.0 111.807 163.408 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -68.77 -12.57 61.63 Favored 'General case' 0 N--CA 1.47 0.568 0 O-C-N 125.98 2.05 . . . . 0.0 113.399 176.182 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 25' ' ' ARG . . . . . . . . . . . . 0.37 15.8 mtp180 -76.09 -131.57 0.01 OUTLIER 'General case' 0 N--CA 1.471 0.576 0 N-CA-C 106.031 -1.841 . . . . 0.0 106.031 150.777 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 26' ' ' LEU . . . . . . . . . . . . 0.473 0.2 OUTLIER 42.22 -77.35 0.0 OUTLIER 'General case' 0 N--CA 1.47 0.572 1 N-CA-C 122.423 4.231 . . . . 0.0 122.423 157.358 . . . . . . . . 4 3 . 1 . 001 nuclear build full ' A' A ' 27' ' ' LYS . . . . . 0.414 ' HE3' ' HB2' ' A' ' 27' ' ' LYS . 5.7 ttmt -79.44 -24.32 42.55 Favored 'General case' 0 N--CA 1.469 0.517 0 CA-C-N 113.009 -1.905 . . . . 0.0 108.925 -168.692 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 48.0 mttt -76.98 -36.67 56.27 Favored 'General case' 0 N--CA 1.47 0.55 0 C-N-CA 126.384 1.874 . . . . 0.0 115.695 -179.044 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 22.9 mt -80.42 -36.72 33.33 Favored 'General case' 0 N--CA 1.47 0.547 0 CA-C-N 110.329 -3.123 . . . . 0.0 111.87 171.789 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 22.1 t -96.98 -89.84 0.11 Allowed 'Isoleucine or valine' 0 N--CA 1.47 0.572 0 CA-C-O 115.873 -2.013 . . . . 0.0 112.349 178.367 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . -179.16 -140.82 4.18 Favored Glycine 0 CA--C 1.53 1.0 1 O-C-N 132.029 5.831 . . . . 0.0 114.796 174.597 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 32' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.33 -0.241 0 O-C-N 117.218 -3.519 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 002 nuclear build full ' A' A ' 15' ' ' ACE . . . . . . . . . . . . . . . . . . . . 0 C--O 1.23 0.055 . . . . . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 002 nuclear build full ' A' A ' 16' ' ' ASN . . . . . . . . . . . . 0.359 26.8 t30 83.61 107.68 0.06 Allowed 'General case' 0 N--CA 1.47 0.559 1 C-N-CA 135.089 5.355 . . . . 0.0 110.028 . . . . . . . . . 3 2 . 1 . 002 nuclear build full ' A' A ' 17' ' ' TYR . . . . . 0.776 ' HA ' ' H ' ' A' ' 19' ' ' LEU . 24.8 m-85 58.32 74.2 0.44 Allowed 'General case' 0 N--CA 1.471 0.601 0 O-C-N 128.636 3.71 . . . . 0.0 112.1 -173.822 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 18' ' ' HIS . . . . . . . . . . . . 0.522 0.0 OUTLIER 67.58 -54.0 0.49 Allowed 'General case' 0 N--CA 1.471 0.583 2 C-N-CA 134.534 5.134 . . . . 0.0 123.534 -0.75 . . . . . . . . 4 3 . 1 . 002 nuclear build full ' A' A ' 19' ' ' LEU . . . . . 0.776 ' H ' ' HA ' ' A' ' 17' ' ' TYR 0.321 1.5 tm? -76.86 -10.85 59.66 Favored 'General case' 0 N--CA 1.469 0.496 0 CA-C-O 124.373 2.035 . . . . 0.0 113.183 -149.429 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 9.7 pt-20 -58.89 -23.17 60.74 Favored 'General case' 0 N--CA 1.47 0.566 0 O-C-N 118.001 -2.937 . . . . 0.0 114.056 169.099 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 12.9 t-20 -81.77 -25.14 35.55 Favored 'General case' 0 N--CA 1.47 0.563 0 C-N-CA 124.225 1.01 . . . . 0.0 109.709 -173.471 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 22' ' ' GLU . . . . . 0.558 ' HG3' HD22 ' A' ' 19' ' ' LEU . 10.2 mm-40 -71.15 -24.62 62.29 Favored 'General case' 0 N--CA 1.47 0.572 0 C-N-CA 128.208 2.603 . . . . 0.0 111.407 178.96 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 21.8 t -73.9 -54.46 15.04 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.542 0 CA-C-N 110.48 -3.054 . . . . 0.0 114.655 167.543 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -69.56 -15.07 63.16 Favored 'General case' 0 N--CA 1.47 0.569 0 CA-C-O 123.065 1.412 . . . . 0.0 114.764 174.643 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 6.7 mtt180 -71.19 -44.52 65.27 Favored 'General case' 0 N--CA 1.47 0.561 0 O-C-N 117.297 -3.377 . . . . 0.0 114.065 164.743 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 26' ' ' LEU . . . . . . . . . . . . 0.32 4.5 mm? -71.32 -41.1 70.28 Favored 'General case' 0 N--CA 1.47 0.552 0 N-CA-C 119.299 3.074 . . . . 0.0 119.299 172.959 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 52.2 mmtt -87.05 45.79 1.31 Allowed 'General case' 0 N--CA 1.47 0.556 0 C-N-CA 126.678 1.991 . . . . 0.0 108.914 -172.113 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 36.5 mttm -158.33 -39.02 0.06 Allowed 'General case' 0 N--CA 1.47 0.526 1 C-N-CA 132.769 4.428 . . . . 0.0 113.731 176.596 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 9.6 tp -82.1 -50.24 9.28 Favored 'General case' 0 N--CA 1.471 0.608 0 O-C-N 120.983 -1.073 . . . . 0.0 108.64 173.242 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 3.2 m -154.81 92.82 0.08 OUTLIER 'Isoleucine or valine' 0 N--CA 1.47 0.569 0 CA-C-O 127.828 3.68 . . . . 0.0 112.735 -178.19 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . -170.18 106.47 0.24 Allowed Glycine 0 CA--C 1.529 0.945 1 CA-C-N 108.166 -4.106 . . . . 0.0 117.013 -176.664 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 32' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.331 -0.213 0 O-C-N 120.435 -1.626 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 003 nuclear build full ' A' A ' 15' ' ' ACE . . . . . 0.538 ' H1 ' ' O ' ' A' ' 16' ' ' ASN . . . . . . . . 0 C--O 1.23 0.043 . . . . . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 16' ' ' ASN . . . . . 0.538 ' O ' ' H1 ' ' A' ' 15' ' ' ACE . 0.2 OUTLIER 48.17 88.08 0.02 OUTLIER 'General case' 0 N--CA 1.469 0.519 1 C-N-CA 134.84 5.256 . . . . 0.0 113.444 . . . . . . . . . 4 4 . 1 . 003 nuclear build full ' A' A ' 17' ' ' TYR . . . . . 0.46 ' HB3' ' O ' ' A' ' 18' ' ' HIS . 10.4 m-30 -79.43 145.62 33.23 Favored 'General case' 0 N--CA 1.47 0.551 0 C-N-CA 129.774 3.23 . . . . 0.0 115.025 -13.345 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 18' ' ' HIS . . . . . 0.468 ' ND1' ' HB2' ' A' ' 19' ' ' LEU 0.355 0.0 OUTLIER 42.33 -167.77 0.01 OUTLIER 'General case' 0 N--CA 1.47 0.541 3 C-N-CA 133.878 4.871 . . . . 0.0 124.069 7.116 . . . . . . . . 5 4 . 1 . 003 nuclear build full ' A' A ' 19' ' ' LEU . . . . . 0.468 ' HB2' ' ND1' ' A' ' 18' ' ' HIS 0.34 0.2 OUTLIER 66.44 -48.69 0.44 Allowed 'General case' 0 N--CA 1.469 0.522 0 C-N-CA 130.169 3.388 . . . . 0.0 115.741 170.59 . . . . . . . . 4 4 . 1 . 003 nuclear build full ' A' A ' 20' ' ' GLU . . . . . . . . . . . . 0.279 19.7 mt-10 -83.64 -48.78 9.83 Favored 'General case' 0 N--CA 1.47 0.554 0 C-N-CA 131.105 3.762 . . . . 0.0 107.637 169.237 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 21' ' ' ASN . . . . . 0.52 ' O ' ' HG2' ' A' ' 22' ' ' GLU . 12.7 m120 -88.51 67.48 8.54 Favored 'General case' 0 N--CA 1.47 0.553 0 CA-C-N 113.275 -1.784 . . . . 0.0 107.362 172.301 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 22' ' ' GLU . . . . . 0.543 ' O ' ' HB2' ' A' ' 25' ' ' ARG . 6.3 mm-40 -175.3 -56.78 0.01 OUTLIER 'General case' 0 N--CA 1.469 0.498 2 C-N-CA 137.266 6.226 . . . . 0.0 109.632 -172.215 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 23' ' ' VAL . . . . . . . . . . . . 0.367 22.4 t -75.42 -37.69 38.5 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.575 0 O-C-N 127.609 3.068 . . . . 0.0 114.495 171.429 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -80.6 42.1 0.59 Allowed 'General case' 0 N--CA 1.47 0.55 0 CA-C-N 112.857 -1.974 . . . . 0.0 112.467 162.161 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 25' ' ' ARG . . . . . 0.543 ' HB2' ' O ' ' A' ' 22' ' ' GLU 0.348 17.3 mtt180 -154.99 18.01 0.43 Allowed 'General case' 0 N--CA 1.471 0.588 0 CA-C-N 114.821 -1.081 . . . . 0.0 111.233 168.355 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 4.3 tp -170.35 29.23 0.02 OUTLIER 'General case' 0 N--CA 1.471 0.581 0 CA-C-O 124.727 2.203 . . . . 0.0 111.146 -172.875 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 27.2 tptt -154.07 -20.43 0.13 Allowed 'General case' 0 N--CA 1.469 0.497 0 C-N-CA 129.011 2.925 . . . . 0.0 116.357 178.879 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 16.3 ptmt -153.28 58.84 0.77 Allowed 'General case' 0 N--CA 1.47 0.568 0 CA-C-N 124.168 3.167 . . . . 0.0 107.99 171.97 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 29' ' ' LEU . . . . . 0.462 ' HG ' HG23 ' A' ' 30' ' ' VAL 0.431 12.1 tp 36.62 -82.7 0.0 OUTLIER 'General case' 0 N--CA 1.471 0.612 3 C-N-CA 138.541 6.736 . . . . 0.0 127.759 29.293 . . . . . . . . 4 3 . 1 . 003 nuclear build full ' A' A ' 30' ' ' VAL . . . . . 0.462 HG23 ' HG ' ' A' ' 29' ' ' LEU . 45.2 t -161.2 128.41 0.59 Allowed 'Isoleucine or valine' 0 N--CA 1.47 0.563 0 O-C-N 125.875 1.984 . . . . 0.0 109.807 -174.403 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . -118.08 -153.61 9.61 Favored Glycine 0 CA--C 1.532 1.098 0 O-C-N 124.597 1.186 . . . . 0.0 115.392 -178.937 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 32' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.329 -0.31 0 CA-C-N 115.029 -0.585 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 004 nuclear build full ' A' A ' 15' ' ' ACE . . . . . . . . . . . . . . . . . . . . 0 C--O 1.23 0.047 . . . . . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 004 nuclear build full ' A' A ' 16' ' ' ASN . . . . . . . . . . . . 0.276 21.3 p-10 28.97 103.64 0.0 OUTLIER 'General case' 0 N--CA 1.47 0.562 2 N-CA-C 127.425 6.083 . . . . 0.0 127.425 . . . . . . . . . 3 2 . 1 . 004 nuclear build full ' A' A ' 17' ' ' TYR . . . . . 0.725 ' HB2' ' CD2' ' A' ' 18' ' ' HIS 0.751 0.0 OUTLIER 66.42 -131.71 0.18 Allowed 'General case' 0 N--CA 1.471 0.591 0 C-N-CA 130.915 3.686 . . . . 0.0 113.635 8.696 . . . . . . . . 4 4 . 1 . 004 nuclear build full ' A' A ' 18' ' ' HIS . . . . . 0.854 ' CD2' ' HB2' ' A' ' 19' ' ' LEU . 0.0 OUTLIER -155.9 128.67 7.91 Favored 'General case' 0 N--CA 1.47 0.574 2 C-N-CA 139.175 6.99 . . . . 0.0 116.39 0.902 . . . . . . . . 4 4 . 1 . 004 nuclear build full ' A' A ' 19' ' ' LEU . . . . . 0.854 ' HB2' ' CD2' ' A' ' 18' ' ' HIS 0.317 1.5 tp -160.06 111.47 1.96 Allowed 'General case' 0 N--CA 1.47 0.553 0 CA-C-O 128.06 3.79 . . . . 0.0 110.503 28.982 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 20' ' ' GLU . . . . . 0.725 ' OE2' ' HB2' ' A' ' 21' ' ' ASN . 0.0 OUTLIER -164.08 -48.31 0.03 OUTLIER 'General case' 0 N--CA 1.469 0.505 1 CA-C-N 104.112 -5.949 . . . . 0.0 115.953 -155.28 . . . . . . . . 4 4 . 1 . 004 nuclear build full ' A' A ' 21' ' ' ASN . . . . . 0.725 ' HB2' ' OE2' ' A' ' 20' ' ' GLU 0.297 21.9 t30 -86.52 49.08 1.73 Allowed 'General case' 0 N--CA 1.47 0.549 1 CA-C-O 130.841 5.115 . . . . 0.0 111.637 176.374 . . . . . . . . 4 3 . 1 . 004 nuclear build full ' A' A ' 22' ' ' GLU . . . . . 0.442 ' HA ' ' HB2' ' A' ' 25' ' ' ARG . 10.3 mt-10 -164.38 -39.76 0.03 OUTLIER 'General case' 0 N--CA 1.469 0.523 1 CA-C-N 106.201 -5.0 . . . . 0.0 117.198 -172.409 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 23' ' ' VAL . . . . . 0.454 ' C ' ' H ' ' A' ' 25' ' ' ARG . 41.3 t -61.84 -48.81 86.91 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.538 0 O-C-N 119.495 -2.003 . . . . 0.0 112.42 148.76 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -86.73 31.17 0.69 Allowed 'General case' 0 N--CA 1.469 0.496 0 CA-C-O 126.791 3.186 . . . . 0.0 112.174 176.331 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 25' ' ' ARG . . . . . 0.454 ' H ' ' C ' ' A' ' 23' ' ' VAL . 15.0 mtp180 -165.33 55.63 0.12 Allowed 'General case' 0 N--CA 1.47 0.538 0 CA-C-N 108.492 -3.958 . . . . 0.0 114.254 173.806 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 26' ' ' LEU . . . . . 0.441 HD12 ' HA ' ' A' ' 26' ' ' LEU . 5.5 tp -179.37 -53.54 0.01 OUTLIER 'General case' 0 N--CA 1.47 0.56 1 CA-C-N 105.333 -5.394 . . . . 0.0 116.017 174.833 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . 0.269 0.1 OUTLIER -86.46 -27.96 23.77 Favored 'General case' 0 N--CA 1.47 0.541 0 N-CA-C 115.567 1.691 . . . . 0.0 115.567 -168.126 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 73.0 mmtt -81.61 -29.56 33.25 Favored 'General case' 0 N--CA 1.47 0.543 0 O-C-N 118.681 -2.512 . . . . 0.0 108.45 178.246 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 38.2 tp -82.8 -43.63 16.48 Favored 'General case' 0 N--CA 1.471 0.589 0 CA-C-N 122.274 2.306 . . . . 0.0 116.193 161.944 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 30' ' ' VAL . . . . . . . . . . . . 0.332 1.1 t -94.34 95.28 5.04 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.561 0 O-C-N 119.268 -2.145 . . . . 0.0 107.934 175.424 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . 97.2 -55.01 1.3 Allowed Glycine 0 CA--C 1.53 0.981 0 N-CA-C 121.535 3.374 . . . . 0.0 121.535 176.39 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 32' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.331 -0.23 1 O-C-N 112.674 -6.192 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 15' ' ' ACE . . . . . . . . . . . . . . . . . . . . 0 C--O 1.23 0.056 . . . . . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 005 nuclear build full ' A' A ' 16' ' ' ASN . . . . . 0.505 ' HA ' ' HG2' ' A' ' 20' ' ' GLU 0.324 25.7 t-20 76.91 139.75 0.07 Allowed 'General case' 0 N--CA 1.469 0.496 1 C-N-CA 132.468 4.307 . . . . 0.0 109.498 . . . . . . . . . 4 3 . 1 . 005 nuclear build full ' A' A ' 17' ' ' TYR . . . . . . . . . . . . . 24.6 t80 54.41 95.46 0.02 OUTLIER 'General case' 0 N--CA 1.47 0.541 0 CA-C-N 109.691 -3.413 . . . . 0.0 116.361 -169.469 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 18' ' ' HIS . . . . . 0.453 ' C ' ' H ' ' A' ' 20' ' ' GLU . 0.0 OUTLIER 83.57 -48.04 0.13 Allowed 'General case' 0 N--CA 1.471 0.598 0 C-N-CA 129.81 3.244 . . . . 0.0 108.043 171.002 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 19' ' ' LEU . . . . . 0.437 ' HA ' HD12 ' A' ' 19' ' ' LEU . 4.9 tp -71.31 41.36 0.07 Allowed 'General case' 0 N--CA 1.47 0.549 1 C-N-CA 131.845 4.058 . . . . 0.0 116.819 178.34 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 20' ' ' GLU . . . . . 0.505 ' HG2' ' HA ' ' A' ' 16' ' ' ASN 0.253 1.1 pp20? -161.69 -47.02 0.04 OUTLIER 'General case' 0 N--CA 1.47 0.565 1 CA-C-N 102.886 -6.506 . . . . 0.0 117.062 -169.581 . . . . . . . . 4 3 . 1 . 005 nuclear build full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 5.4 t-20 -92.63 63.77 4.07 Favored 'General case' 0 N--CA 1.47 0.527 0 CA-C-O 128.383 3.944 . . . . 0.0 106.854 158.808 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 11.8 mm-40 -170.15 -55.27 0.02 OUTLIER 'General case' 0 N--CA 1.47 0.552 1 C-N-CA 133.898 4.879 . . . . 0.0 108.111 -177.95 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 3.2 t -73.9 -29.97 27.12 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.545 0 CA-C-N 113.991 -1.458 . . . . 0.0 111.291 178.27 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -81.69 -26.85 34.32 Favored 'General case' 0 N--CA 1.47 0.574 0 N-CA-C 119.682 3.216 . . . . 0.0 119.682 163.909 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 11.5 mtp180 -70.78 -46.78 62.27 Favored 'General case' 0 N--CA 1.472 0.632 0 CA-C-O 113.577 -3.106 . . . . 0.0 113.861 177.615 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 1.1 mt -85.61 -149.35 0.13 Allowed 'General case' 0 N--CA 1.47 0.556 0 CA-C-O 115.052 -2.404 . . . . 0.0 106.948 168.86 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 78.9 mttt 46.33 -58.06 0.0 OUTLIER 'General case' 0 N--CA 1.47 0.549 1 C-N-CA 131.804 4.042 . . . . 0.0 120.898 163.035 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 19.5 tptm -70.43 -40.17 73.95 Favored 'General case' 0 N--CA 1.47 0.57 0 C-N-CA 123.116 0.567 . . . . 0.0 109.551 168.359 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 29' ' ' LEU . . . . . 0.545 ' HG ' HG23 ' A' ' 30' ' ' VAL . 14.4 tp -87.54 -34.71 18.5 Favored 'General case' 0 N--CA 1.471 0.591 0 N-CA-C 117.058 2.244 . . . . 0.0 117.058 -179.518 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 30' ' ' VAL . . . . . 0.545 HG23 ' HG ' ' A' ' 29' ' ' LEU . 48.1 t -154.01 106.49 0.2 Allowed 'Isoleucine or valine' 0 N--CA 1.47 0.573 0 C-N-CA 130.733 3.613 . . . . 0.0 108.725 -179.859 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . -48.69 -87.13 0.01 OUTLIER Glycine 0 CA--C 1.53 0.994 1 O-C-N 130.232 4.707 . . . . 0.0 113.552 172.893 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 32' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.33 -0.25 1 O-C-N 110.707 -7.349 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 15' ' ' ACE . . . . . 0.436 ' H1 ' ' CG ' ' A' ' 16' ' ' ASN . . . . . . . . 0 C--O 1.23 0.064 . . . . . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 16' ' ' ASN . . . . . 0.441 ' O ' HD13 ' A' ' 19' ' ' LEU . 13.5 m-80 -148.72 45.39 1.02 Allowed 'General case' 0 N--CA 1.471 0.6 0 N-CA-C 117.998 2.592 . . . . 0.0 117.998 . . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 17' ' ' TYR . . . . . . . . . . . . 0.473 0.1 OUTLIER 54.39 109.36 0.01 OUTLIER 'General case' 0 N--CA 1.47 0.563 1 C-N-CA 136.916 6.086 . . . . 0.0 120.809 -3.712 . . . . . . . . 4 3 . 1 . 006 nuclear build full ' A' A ' 18' ' ' HIS . . . . . 0.538 ' CE1' ' H ' ' A' ' 21' ' ' ASN 0.871 86.9 m-70 76.12 72.61 0.08 Allowed 'General case' 0 N--CA 1.469 0.518 1 CA-C-N 100.364 -7.653 . . . . 0.0 120.886 -161.519 . . . . . . . . 4 3 . 1 . 006 nuclear build full ' A' A ' 19' ' ' LEU . . . . . 0.642 ' H ' ' HG3' ' A' ' 22' ' ' GLU 0.492 2.7 tt 65.64 99.0 0.04 OUTLIER 'General case' 0 N--CA 1.47 0.542 2 N-CA-C 130.135 7.087 . . . . 0.0 130.135 -35.814 . . . . . . . . 4 3 . 1 . 006 nuclear build full ' A' A ' 20' ' ' GLU . . . . . . . . . . . . 0.253 6.0 pt-20 75.28 6.9 4.13 Favored 'General case' 0 N--CA 1.469 0.486 3 N-CA-C 126.54 5.756 . . . . 0.0 126.54 173.009 . . . . . . . . 3 2 . 1 . 006 nuclear build full ' A' A ' 21' ' ' ASN . . . . . 0.538 ' H ' ' CE1' ' A' ' 18' ' ' HIS . 57.8 t-20 -85.21 -81.99 0.19 Allowed 'General case' 0 N--CA 1.47 0.57 1 N-CA-C 98.397 -4.668 . . . . 0.0 98.397 141.7 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 22' ' ' GLU . . . . . 0.642 ' HG3' ' H ' ' A' ' 19' ' ' LEU . 11.5 mm-40 42.42 -95.57 0.02 OUTLIER 'General case' 0 N--CA 1.469 0.49 0 N-CA-C 116.119 1.896 . . . . 0.0 116.119 162.39 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 23' ' ' VAL . . . . . . . . . . . . 0.541 0.6 OUTLIER 14.4 -76.97 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.47 0.561 1 N-CA-C 123.365 4.579 . . . . 0.0 123.365 140.969 . . . . . . . . 4 3 . 1 . 006 nuclear build full ' A' A ' 24' ' ' ALA . . . . . . . . . . . . 0.251 . . -76.03 36.95 0.15 Allowed 'General case' 0 N--CA 1.47 0.538 1 CA-C-N 106.582 -4.826 . . . . 0.0 116.762 167.852 . . . . . . . . 3 2 . 1 . 006 nuclear build full ' A' A ' 25' ' ' ARG . . . . . . . . . . . . 0.353 31.5 mtp180 -163.85 -48.19 0.03 OUTLIER 'General case' 0 N--CA 1.471 0.578 0 O-C-N 119.468 -2.02 . . . . 0.0 110.002 -179.413 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 16.2 mt -77.91 -128.35 0.01 OUTLIER 'General case' 0 N--CA 1.47 0.553 0 O-C-N 125.668 1.855 . . . . 0.0 107.475 165.361 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . 0.323 46.0 mttp 23.53 -72.69 0.0 OUTLIER 'General case' 0 N--CA 1.47 0.532 0 C-N-CA 129.665 3.186 . . . . 0.0 117.792 153.76 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 28' ' ' LYS . . . . . . . . . . . . 0.369 47.4 mtpt -91.24 13.71 16.42 Favored 'General case' 0 N--CA 1.471 0.589 0 O-C-N 118.436 -2.665 . . . . 0.0 117.147 -170.086 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 40.4 tp -149.7 -47.92 0.14 Allowed 'General case' 0 N--CA 1.47 0.553 0 CA-C-N 110.726 -2.943 . . . . 0.0 108.329 -174.464 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 62.1 t -86.23 -54.56 8.07 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.582 0 C-N-CA 124.459 1.103 . . . . 0.0 113.179 -179.291 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . 160.12 -86.89 0.11 Allowed Glycine 0 CA--C 1.53 0.992 0 CA-C-O 125.888 2.938 . . . . 0.0 115.484 -173.077 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 32' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.329 -0.299 0 O-C-N 120.363 -1.669 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 007 nuclear build full ' A' A ' 15' ' ' ACE . . . . . . . . . . . . . . . . . . . . 0 C--O 1.23 0.059 . . . . . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 007 nuclear build full ' A' A ' 16' ' ' ASN . . . . . . . . . . . . 0.461 14.4 m-80 74.1 -117.46 0.04 OUTLIER 'General case' 0 N--CA 1.469 0.492 1 C-N-CA 134.085 4.954 . . . . 0.0 114.128 . . . . . . . . . 3 2 . 1 . 007 nuclear build full ' A' A ' 17' ' ' TYR . . . . . . . . . . . . 0.582 0.1 OUTLIER 49.82 -68.06 0.0 OUTLIER 'General case' 0 N--CA 1.471 0.586 1 N-CA-C 132.138 7.829 . . . . 0.0 132.138 171.383 . . . . . . . . 4 3 . 1 . 007 nuclear build full ' A' A ' 18' ' ' HIS . . . . . 0.435 ' H ' ' H ' ' A' ' 19' ' ' LEU . 0.5 OUTLIER -149.13 -11.45 0.32 Allowed 'General case' 0 N--CA 1.47 0.529 1 O-C-N 130.487 4.867 . . . . 0.0 107.232 176.196 . . . . . . . . 4 4 . 1 . 007 nuclear build full ' A' A ' 19' ' ' LEU . . . . . 0.502 ' HA ' HD12 ' A' ' 19' ' ' LEU . 1.6 tp -78.25 -20.33 51.9 Favored 'General case' 0 N--CA 1.47 0.562 0 CA-C-O 125.616 2.626 . . . . 0.0 116.522 -171.487 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 20' ' ' GLU . . . . . 0.414 ' HG2' ' H ' ' A' ' 20' ' ' GLU . 6.4 pt-20 -74.18 -47.76 33.53 Favored 'General case' 0 N--CA 1.47 0.563 2 CA-C-N 106.613 -4.812 . . . . 0.0 122.829 161.179 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 57.3 m-80 -97.77 61.18 1.56 Allowed 'General case' 0 N--CA 1.47 0.544 0 CA-C-O 127.315 3.436 . . . . 0.0 108.552 167.471 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -163.25 -39.49 0.03 OUTLIER 'General case' 0 N--CA 1.471 0.588 0 CA-C-N 109.415 -3.538 . . . . 0.0 112.08 -179.602 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 98.2 t -68.86 -45.28 80.96 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.604 1 CA-C-O 111.268 -4.206 . . . . 0.0 107.686 155.292 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -82.03 69.91 8.84 Favored 'General case' 0 N--CA 1.47 0.557 0 N-CA-C 116.772 2.138 . . . . 0.0 116.772 159.179 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 30.4 mtt-85 -171.89 -52.42 0.02 OUTLIER 'General case' 0 N--CA 1.471 0.592 1 CA-C-N 107.822 -4.263 . . . . 0.0 109.739 175.897 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 86.9 mt -83.05 -26.79 30.8 Favored 'General case' 0 N--CA 1.47 0.527 1 O-C-N 116.068 -4.145 . . . . 0.0 110.637 -167.196 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 24.9 tptp -82.86 -27.77 30.54 Favored 'General case' 0 N--CA 1.469 0.498 0 C-N-CA 115.128 -2.629 . . . . 0.0 109.506 -169.993 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 74.0 mttt -84.5 26.83 0.76 Allowed 'General case' 0 N--CA 1.47 0.539 0 C-N-CA 128.111 2.565 . . . . 0.0 116.388 166.431 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 29' ' ' LEU . . . . . 0.417 HD12 HG22 ' A' ' 30' ' ' VAL 0.342 3.4 pp -147.15 -21.37 0.4 Allowed 'General case' 0 N--CA 1.47 0.542 0 CA-C-O 115.731 -2.08 . . . . 0.0 114.257 158.991 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 30' ' ' VAL . . . . . 0.417 HG22 HD12 ' A' ' 29' ' ' LEU . 0.9 OUTLIER -151.44 145.27 16.32 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.579 0 CA-C-N 119.749 1.158 . . . . 0.0 111.924 170.21 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . -101.33 -43.27 2.21 Favored Glycine 0 CA--C 1.529 0.929 0 C-N-CA 128.272 2.844 . . . . 0.0 111.967 177.718 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 32' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.331 -0.232 1 O-C-N 113.688 -5.595 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 15' ' ' ACE . . . . . . . . . . . . . . . . . . . . 0 C--O 1.23 0.046 . . . . . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 008 nuclear build full ' A' A ' 16' ' ' ASN . . . . . . . . . . . . 0.338 25.0 t-20 44.02 90.17 0.01 OUTLIER 'General case' 0 N--CA 1.471 0.576 1 C-N-CA 135.038 5.335 . . . . 0.0 120.399 . . . . . . . . . 3 2 . 1 . 008 nuclear build full ' A' A ' 17' ' ' TYR . . . . . 0.499 ' CE2' ' HB3' ' A' ' 18' ' ' HIS . 34.0 t80 -161.9 140.16 9.13 Favored 'General case' 0 N--CA 1.471 0.592 0 CA-C-N 124.415 3.28 . . . . 0.0 109.883 12.38 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 18' ' ' HIS . . . . . 0.499 ' HB3' ' CE2' ' A' ' 17' ' ' TYR 0.263 0.0 OUTLIER 77.14 29.18 0.59 Allowed 'General case' 0 N--CA 1.471 0.607 2 N-CA-C 128.05 6.315 . . . . 0.0 128.05 -176.324 . . . . . . . . 5 4 . 1 . 008 nuclear build full ' A' A ' 19' ' ' LEU . . . . . 0.497 ' HB2' ' C ' ' A' ' 17' ' ' TYR . 0.4 OUTLIER 74.51 0.86 3.69 Favored 'General case' 0 N--CA 1.47 0.572 2 C-N-CA 144.464 9.105 . . . . 0.0 113.977 -18.658 . . . . . . . . 4 4 . 1 . 008 nuclear build full ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 11.2 mt-10 -164.53 -77.06 0.03 OUTLIER 'General case' 0 N--CA 1.47 0.53 0 CA-C-N 112.594 -2.093 . . . . 0.0 115.56 -173.718 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 10.3 t-20 -85.98 78.07 9.53 Favored 'General case' 0 N--CA 1.47 0.569 0 N-CA-C 109.135 -0.691 . . . . 0.0 109.135 164.667 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 23.6 mt-10 -164.72 -54.4 0.03 OUTLIER 'General case' 0 N--CA 1.47 0.532 2 C-N-CA 138.718 6.807 . . . . 0.0 105.578 168.994 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 23' ' ' VAL . . . . . 0.599 HG13 ' HB3' ' A' ' 27' ' ' LYS 0.344 3.2 t -72.93 -35.52 49.21 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.478 0 CA-C-O 112.131 -3.795 . . . . 0.0 114.657 170.567 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -80.76 51.42 1.51 Allowed 'General case' 0 N--CA 1.47 0.56 0 CA-C-O 123.937 1.827 . . . . 0.0 111.448 167.918 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 46.7 mtp85 -163.8 -10.82 0.03 OUTLIER 'General case' 0 N--CA 1.47 0.565 0 N-CA-C 119.862 3.282 . . . . 0.0 119.862 178.704 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 1.7 pp -163.18 20.16 0.08 Allowed 'General case' 0 N--CA 1.469 0.497 0 N-CA-C 117.22 2.304 . . . . 0.0 117.22 177.638 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 27' ' ' LYS . . . . . 0.599 ' HB3' HG13 ' A' ' 23' ' ' VAL . 0.3 OUTLIER -156.49 45.46 0.42 Allowed 'General case' 0 N--CA 1.469 0.499 0 CA-C-N 112.446 -2.161 . . . . 0.0 105.433 -176.605 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 47.2 tptt 121.35 79.31 0.0 OUTLIER 'General case' 0 N--CA 1.47 0.562 1 C-N-CA 132.819 4.447 . . . . 0.0 108.008 -152.958 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 29' ' ' LEU . . . . . 0.406 ' HG ' ' H ' ' A' ' 30' ' ' VAL 0.553 32.9 tp 40.29 -118.99 0.34 Allowed 'General case' 0 N--CA 1.47 0.552 1 C-N-CA 144.141 8.976 . . . . 0.0 118.569 2.691 . . . . . . . . 4 3 . 1 . 008 nuclear build full ' A' A ' 30' ' ' VAL . . . . . 0.406 ' H ' ' HG ' ' A' ' 29' ' ' LEU . 60.2 t -85.37 127.93 39.57 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.563 0 C-N-CA 129.797 3.239 . . . . 0.0 113.798 170.954 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . 146.47 88.96 0.08 OUTLIER Glycine 0 CA--C 1.53 1.002 0 CA-C-O 127.607 3.893 . . . . 0.0 114.813 179.877 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 32' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.33 -0.26 1 O-C-N 116.395 -4.003 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 15' ' ' ACE . . . . . . . . . . . . . . . . . . . . 0 C--O 1.23 0.045 . . . . . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 009 nuclear build full ' A' A ' 16' ' ' ASN . . . . . 0.435 ' H ' ' CG ' ' A' ' 18' ' ' HIS 0.514 32.1 p30 41.47 84.81 0.02 OUTLIER 'General case' 0 N--CA 1.47 0.551 1 N-CA-C 128.069 6.322 . . . . 0.0 128.069 . . . . . . . . . 4 3 . 1 . 009 nuclear build full ' A' A ' 17' ' ' TYR . . . . . 0.671 ' HB2' ' HA ' ' A' ' 18' ' ' HIS 0.961 0.0 OUTLIER 61.53 -120.9 0.76 Allowed 'General case' 0 N--CA 1.469 0.518 2 C-N-CA 136.736 6.014 . . . . 0.0 119.613 15.891 . . . . . . . . 5 4 . 1 . 009 nuclear build full ' A' A ' 18' ' ' HIS . . . . . 0.671 ' HA ' ' HB2' ' A' ' 17' ' ' TYR . 0.1 OUTLIER -150.62 112.55 4.54 Favored 'General case' 0 N--CA 1.47 0.531 2 C-N-CA 135.058 5.343 . . . . 0.0 113.759 1.358 . . . . . . . . 4 4 . 1 . 009 nuclear build full ' A' A ' 19' ' ' LEU . . . . . 0.65 ' HB2' ' HB2' ' A' ' 22' ' ' GLU . 1.3 pp -152.83 84.72 1.22 Allowed 'General case' 0 N--CA 1.47 0.536 0 O-C-N 118.206 -2.809 . . . . 0.0 117.319 12.093 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 20' ' ' GLU . . . . . 0.607 ' HG3' ' H ' ' A' ' 21' ' ' ASN . 6.3 pt-20 -76.18 -51.48 12.04 Favored 'General case' 0 N--CA 1.47 0.542 1 CA-C-N 103.367 -6.288 . . . . 0.0 112.589 162.483 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 21' ' ' ASN . . . . . 0.607 ' H ' ' HG3' ' A' ' 20' ' ' GLU . 2.4 t-20 -85.02 65.07 9.05 Favored 'General case' 0 N--CA 1.469 0.518 0 CA-C-N 114.84 -1.073 . . . . 0.0 112.257 168.039 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 22' ' ' GLU . . . . . 0.65 ' HB2' ' HB2' ' A' ' 19' ' ' LEU . 12.1 mm-40 -164.24 -36.81 0.03 OUTLIER 'General case' 0 N--CA 1.47 0.56 1 O-C-N 131.439 5.462 . . . . 0.0 111.384 167.13 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 95.7 t -75.31 -27.23 19.25 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.555 0 CA-C-O 113.395 -3.193 . . . . 0.0 118.952 160.467 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 24' ' ' ALA . . . . . . . . . . . . 0.287 . . -165.7 94.27 0.59 Allowed 'General case' 0 N--CA 1.47 0.534 1 O-C-N 131.329 5.393 . . . . 0.0 103.393 168.781 . . . . . . . . 3 2 . 1 . 009 nuclear build full ' A' A ' 25' ' ' ARG . . . . . 0.498 ' HG3' ' OD1' ' A' ' 21' ' ' ASN 0.797 51.2 mtt85 43.38 -76.02 0.0 OUTLIER 'General case' 0 N--CA 1.47 0.545 2 N-CA-C 130.16 7.096 . . . . 0.0 130.16 -6.319 . . . . . . . . 4 3 . 1 . 009 nuclear build full ' A' A ' 26' ' ' LEU . . . . . . . . . . . . 0.429 68.8 tp -79.94 10.12 4.6 Favored 'General case' 0 N--CA 1.47 0.559 0 O-C-N 118.789 -2.444 . . . . 0.0 110.927 -167.607 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 34.6 tptt -154.22 31.95 0.43 Allowed 'General case' 0 N--CA 1.47 0.56 0 C-N-CA 129.298 3.039 . . . . 0.0 110.866 175.209 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 13.6 mmtt -147.18 33.79 0.89 Allowed 'General case' 0 N--CA 1.47 0.541 0 CA-C-N 110.792 -2.913 . . . . 0.0 116.562 -178.038 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 25.9 tp -155.29 -47.86 0.08 Allowed 'General case' 0 N--CA 1.47 0.547 0 CA-C-N 113.521 -1.672 . . . . 0.0 111.306 -168.019 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 22.2 t -82.97 103.11 9.81 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.538 0 O-C-N 120.236 -1.54 . . . . 0.0 113.916 171.753 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . -83.54 106.39 2.82 Favored Glycine 0 CA--C 1.531 1.041 1 CA-C-O 128.499 4.388 . . . . 0.0 115.106 -158.144 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 32' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.329 -0.288 1 O-C-N 115.808 -4.348 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 15' ' ' ACE . . . . . 0.465 ' H1 ' ' HA ' ' A' ' 16' ' ' ASN . . . . . . . . 0 C--O 1.23 0.042 . . . . . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 16' ' ' ASN . . . . . 0.465 ' HA ' ' H1 ' ' A' ' 15' ' ' ACE 0.455 19.2 t-20 -98.81 -71.07 0.7 Allowed 'General case' 0 N--CA 1.471 0.596 0 N-CA-C 120.976 3.695 . . . . 0.0 120.976 . . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 17' ' ' TYR . . . . . 0.492 ' CE1' ' HB3' ' A' ' 18' ' ' HIS . 0.2 OUTLIER 58.36 135.62 0.01 OUTLIER 'General case' 0 N--CA 1.471 0.579 2 C-N-CA 140.068 7.347 . . . . 0.0 122.267 8.283 . . . . . . . . 4 4 . 1 . 010 nuclear build full ' A' A ' 18' ' ' HIS . . . . . 0.492 ' HB3' ' CE1' ' A' ' 17' ' ' TYR 0.466 0.1 OUTLIER 33.85 -115.36 0.07 Allowed 'General case' 0 N--CA 1.471 0.597 0 O-C-N 128.362 3.539 . . . . 0.0 114.385 169.814 . . . . . . . . 4 4 . 1 . 010 nuclear build full ' A' A ' 19' ' ' LEU . . . . . 0.535 ' HA ' HD12 ' A' ' 19' ' ' LEU . 2.5 tp 50.87 -70.93 0.0 OUTLIER 'General case' 0 N--CA 1.47 0.528 1 CA-C-O 128.603 4.049 . . . . 0.0 111.113 140.009 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 2.6 pp20? -71.4 -47.15 57.86 Favored 'General case' 0 N--CA 1.47 0.531 0 C-N-CA 131.181 3.792 . . . . 0.0 117.779 -176.47 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 21' ' ' ASN . . . . . 0.444 ' O ' ' HG3' ' A' ' 25' ' ' ARG . 1.3 m120 -93.71 -12.41 29.31 Favored 'General case' 0 N--CA 1.471 0.585 0 CA-C-O 113.739 -3.029 . . . . 0.0 114.072 171.918 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 22' ' ' GLU . . . . . 0.448 ' O ' ' HB2' ' A' ' 26' ' ' LEU . 29.8 mm-40 -63.86 -41.51 97.76 Favored 'General case' 0 N--CA 1.47 0.566 0 O-C-N 124.916 1.385 . . . . 0.0 108.165 165.407 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 53.8 t -79.27 59.24 0.14 Allowed 'Isoleucine or valine' 0 N--CA 1.471 0.585 0 O-C-N 119.035 -2.291 . . . . 0.0 115.544 166.183 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . 179.19 -33.48 0.01 OUTLIER 'General case' 0 N--CA 1.47 0.559 1 C-N-CA 134.514 5.125 . . . . 0.0 109.318 179.668 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 25' ' ' ARG . . . . . 0.444 ' HG3' ' O ' ' A' ' 21' ' ' ASN . 27.1 mtp85 -71.03 -75.08 0.13 Allowed 'General case' 0 N--CA 1.469 0.521 0 CA-C-O 117.418 -1.277 . . . . 0.0 113.539 167.178 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 26' ' ' LEU . . . . . 0.48 ' HA ' HD12 ' A' ' 26' ' ' LEU 0.405 1.0 OUTLIER 39.57 -75.28 0.0 OUTLIER 'General case' 0 N--CA 1.471 0.583 1 N-CA-C 126.058 5.577 . . . . 0.0 126.058 153.18 . . . . . . . . 5 4 . 1 . 010 nuclear build full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . 0.265 35.4 tttt -85.47 -15.24 43.54 Favored 'General case' 0 N--CA 1.47 0.548 1 CA-C-N 106.157 -5.02 . . . . 0.0 112.449 -178.059 . . . . . . . . 3 2 . 1 . 010 nuclear build full ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 58.3 mttp -92.11 18.4 8.13 Favored 'General case' 0 N--CA 1.471 0.585 0 O-C-N 119.13 -2.232 . . . . 0.0 114.724 170.259 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 13.0 tp -150.08 -46.88 0.13 Allowed 'General case' 0 N--CA 1.47 0.534 0 CA-C-O 114.467 -2.682 . . . . 0.0 109.576 -173.171 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 30' ' ' VAL . . . . . . . . . . . . 0.438 2.0 t -96.76 -88.27 0.12 Allowed 'Isoleucine or valine' 0 N--CA 1.47 0.533 0 N-CA-C 118.096 2.628 . . . . 0.0 118.096 -172.183 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . -123.54 69.51 0.46 Allowed Glycine 0 CA--C 1.53 1.011 0 O-C-N 127.11 2.756 . . . . 0.0 106.295 179.95 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 32' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.33 -0.268 0 CA-C-N 119.36 1.58 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild core ' A' A ' 18' ' ' HIS . . . . . 0.433 ' CD2' HD22 ' A' ' 19' ' ' LEU 0.675 0.9 OUTLIER . . . . . 0 N--CA 1.469 0.51 0 CA-C-O 116.301 -1.809 . . . . 0.0 109.919 . . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 19' ' ' LEU . . . . . 0.433 HD22 ' CD2' ' A' ' 18' ' ' HIS . 0.1 OUTLIER 51.49 -71.33 0.01 OUTLIER 'General case' 0 N--CA 1.47 0.567 0 C-N-CA 127.137 2.175 . . . . 0.0 114.913 146.263 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 20' ' ' GLU . . . . . 0.49 ' CD ' ' H ' ' A' ' 21' ' ' ASN . 2.7 pp20? -81.42 -61.88 1.81 Allowed 'General case' 0 N--CA 1.47 0.529 0 CA-C-N 110.897 -2.865 . . . . 0.0 116.108 174.994 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 21' ' ' ASN . . . . . 0.49 ' H ' ' CD ' ' A' ' 20' ' ' GLU 0.293 5.5 m-80 -83.7 68.39 9.85 Favored 'General case' 0 N--CA 1.47 0.526 0 CA-C-O 121.747 0.784 . . . . 0.0 109.633 163.635 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 1.5 tm-20 -166.56 -37.01 0.03 OUTLIER 'General case' 0 N--CA 1.471 0.58 0 CA-C-N 109.56 -3.473 . . . . 0.0 110.311 175.066 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 60.6 t -74.32 -44.03 49.18 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.553 0 CA-C-N 119.192 0.906 . . . . 0.0 111.807 163.408 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -68.77 -12.57 61.63 Favored 'General case' 0 N--CA 1.47 0.568 0 O-C-N 125.98 2.05 . . . . 0.0 113.399 176.182 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 25' ' ' ARG . . . . . . . . . . . . 0.37 15.8 mtp180 -76.09 -131.57 0.01 OUTLIER 'General case' 0 N--CA 1.471 0.576 0 N-CA-C 106.031 -1.841 . . . . 0.0 106.031 150.777 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 26' ' ' LEU . . . . . . . . . . . . 0.473 0.2 OUTLIER 42.22 -77.35 0.0 OUTLIER 'General case' 0 N--CA 1.47 0.572 1 N-CA-C 122.423 4.231 . . . . 0.0 122.423 157.358 . . . . . . . . 4 3 . 1 . 001 nuclear nobuild core ' A' A ' 27' ' ' LYS . . . . . 0.414 ' HE3' ' HB2' ' A' ' 27' ' ' LYS . 5.7 ttmt -79.44 -24.32 42.55 Favored 'General case' 0 N--CA 1.469 0.517 0 CA-C-N 113.009 -1.905 . . . . 0.0 108.925 -168.692 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 48.0 mttt -76.98 -36.67 56.27 Favored 'General case' 0 N--CA 1.47 0.55 0 C-N-CA 126.384 1.874 . . . . 0.0 115.695 -179.044 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 22.9 mt -80.42 -36.72 33.33 Favored 'General case' 0 N--CA 1.47 0.547 0 CA-C-N 110.329 -3.123 . . . . 0.0 111.87 171.789 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 22.1 t . . . . . 0 N--CA 1.47 0.572 0 CA-C-O 115.873 -2.013 . . . . 0.0 112.349 178.367 . . . . . . . . 0 0 . 1 . 002 nuclear nobuild core ' A' A ' 18' ' ' HIS . . . . . . . . . . . . 0.522 0.0 OUTLIER . . . . . 0 N--CA 1.471 0.583 1 N-CA-C 123.534 4.642 . . . . 0.0 123.534 . . . . . . . . . 3 2 . 1 . 002 nuclear nobuild core ' A' A ' 19' ' ' LEU . . . . . 0.558 HD22 ' HG3' ' A' ' 22' ' ' GLU 0.321 1.5 tm? -76.86 -10.85 59.66 Favored 'General case' 0 N--CA 1.469 0.496 0 CA-C-O 124.373 2.035 . . . . 0.0 113.183 -149.429 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 9.7 pt-20 -58.89 -23.17 60.74 Favored 'General case' 0 N--CA 1.47 0.566 0 O-C-N 118.001 -2.937 . . . . 0.0 114.056 169.099 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 12.9 t-20 -81.77 -25.14 35.55 Favored 'General case' 0 N--CA 1.47 0.563 0 C-N-CA 124.225 1.01 . . . . 0.0 109.709 -173.471 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 22' ' ' GLU . . . . . 0.558 ' HG3' HD22 ' A' ' 19' ' ' LEU . 10.2 mm-40 -71.15 -24.62 62.29 Favored 'General case' 0 N--CA 1.47 0.572 0 C-N-CA 128.208 2.603 . . . . 0.0 111.407 178.96 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 21.8 t -73.9 -54.46 15.04 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.542 0 CA-C-N 110.48 -3.054 . . . . 0.0 114.655 167.543 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -69.56 -15.07 63.16 Favored 'General case' 0 N--CA 1.47 0.569 0 CA-C-O 123.065 1.412 . . . . 0.0 114.764 174.643 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 6.7 mtt180 -71.19 -44.52 65.27 Favored 'General case' 0 N--CA 1.47 0.561 0 O-C-N 117.297 -3.377 . . . . 0.0 114.065 164.743 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 26' ' ' LEU . . . . . . . . . . . . 0.32 4.5 mm? -71.32 -41.1 70.28 Favored 'General case' 0 N--CA 1.47 0.552 0 N-CA-C 119.299 3.074 . . . . 0.0 119.299 172.959 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 52.2 mmtt -87.05 45.79 1.31 Allowed 'General case' 0 N--CA 1.47 0.556 0 C-N-CA 126.678 1.991 . . . . 0.0 108.914 -172.113 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 36.5 mttm -158.33 -39.02 0.06 Allowed 'General case' 0 N--CA 1.47 0.526 1 C-N-CA 132.769 4.428 . . . . 0.0 113.731 176.596 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 9.6 tp -82.1 -50.24 9.28 Favored 'General case' 0 N--CA 1.471 0.608 0 O-C-N 120.983 -1.073 . . . . 0.0 108.64 173.242 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 3.2 m . . . . . 0 N--CA 1.47 0.569 0 CA-C-O 127.828 3.68 . . . . 0.0 112.735 -178.19 . . . . . . . . 0 0 . 1 . 003 nuclear nobuild core ' A' A ' 18' ' ' HIS . . . . . 0.668 ' CD2' ' HB2' ' A' ' 19' ' ' LEU 0.355 0.0 OUTLIER . . . . . 0 N--CA 1.47 0.541 1 N-CA-C 124.069 4.84 . . . . 0.0 124.069 . . . . . . . . . 4 3 . 1 . 003 nuclear nobuild core ' A' A ' 19' ' ' LEU . . . . . 0.668 ' HB2' ' CD2' ' A' ' 18' ' ' HIS 0.34 0.2 OUTLIER 66.44 -48.69 0.44 Allowed 'General case' 0 N--CA 1.469 0.522 0 C-N-CA 130.169 3.388 . . . . 0.0 115.741 170.59 . . . . . . . . 4 4 . 1 . 003 nuclear nobuild core ' A' A ' 20' ' ' GLU . . . . . . . . . . . . 0.279 19.7 mt-10 -83.64 -48.78 9.83 Favored 'General case' 0 N--CA 1.47 0.554 0 C-N-CA 131.105 3.762 . . . . 0.0 107.637 169.237 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 21' ' ' ASN . . . . . 0.52 ' O ' ' HG2' ' A' ' 22' ' ' GLU . 12.7 m120 -88.51 67.48 8.54 Favored 'General case' 0 N--CA 1.47 0.553 0 CA-C-N 113.275 -1.784 . . . . 0.0 107.362 172.301 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 22' ' ' GLU . . . . . 0.543 ' O ' ' HB2' ' A' ' 25' ' ' ARG . 6.3 mm-40 -175.3 -56.78 0.01 OUTLIER 'General case' 0 N--CA 1.469 0.498 2 C-N-CA 137.266 6.226 . . . . 0.0 109.632 -172.215 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 23' ' ' VAL . . . . . . . . . . . . 0.367 22.4 t -75.42 -37.69 38.5 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.575 0 O-C-N 127.609 3.068 . . . . 0.0 114.495 171.429 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -80.6 42.1 0.59 Allowed 'General case' 0 N--CA 1.47 0.55 0 CA-C-N 112.857 -1.974 . . . . 0.0 112.467 162.161 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 25' ' ' ARG . . . . . 0.543 ' HB2' ' O ' ' A' ' 22' ' ' GLU 0.348 17.3 mtt180 -154.99 18.01 0.43 Allowed 'General case' 0 N--CA 1.471 0.588 0 CA-C-N 114.821 -1.081 . . . . 0.0 111.233 168.355 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 4.3 tp -170.35 29.23 0.02 OUTLIER 'General case' 0 N--CA 1.471 0.581 0 CA-C-O 124.727 2.203 . . . . 0.0 111.146 -172.875 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 27.2 tptt -154.07 -20.43 0.13 Allowed 'General case' 0 N--CA 1.469 0.497 0 C-N-CA 129.011 2.925 . . . . 0.0 116.357 178.879 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 16.3 ptmt -153.28 58.84 0.77 Allowed 'General case' 0 N--CA 1.47 0.568 0 CA-C-N 124.168 3.167 . . . . 0.0 107.99 171.97 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 29' ' ' LEU . . . . . 0.462 ' HG ' HG23 ' A' ' 30' ' ' VAL 0.431 12.1 tp 36.62 -82.7 0.0 OUTLIER 'General case' 0 N--CA 1.471 0.612 3 C-N-CA 138.541 6.736 . . . . 0.0 127.759 29.293 . . . . . . . . 4 3 . 1 . 003 nuclear nobuild core ' A' A ' 30' ' ' VAL . . . . . 0.462 HG23 ' HG ' ' A' ' 29' ' ' LEU . 45.2 t . . . . . 0 N--CA 1.47 0.563 0 O-C-N 125.875 1.984 . . . . 0.0 109.807 -174.403 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 18' ' ' HIS . . . . . 0.854 ' CD2' ' HB2' ' A' ' 19' ' ' LEU . 0.0 OUTLIER . . . . . 0 N--CA 1.47 0.574 0 N-CA-C 116.39 1.996 . . . . 0.0 116.39 . . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 19' ' ' LEU . . . . . 0.854 ' HB2' ' CD2' ' A' ' 18' ' ' HIS 0.317 1.5 tp -160.06 111.47 1.96 Allowed 'General case' 0 N--CA 1.47 0.553 0 CA-C-O 128.06 3.79 . . . . 0.0 110.503 28.982 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 20' ' ' GLU . . . . . 0.725 ' OE2' ' HB2' ' A' ' 21' ' ' ASN . 0.0 OUTLIER -164.08 -48.31 0.03 OUTLIER 'General case' 0 N--CA 1.469 0.505 1 CA-C-N 104.112 -5.949 . . . . 0.0 115.953 -155.28 . . . . . . . . 4 4 . 1 . 004 nuclear nobuild core ' A' A ' 21' ' ' ASN . . . . . 0.725 ' HB2' ' OE2' ' A' ' 20' ' ' GLU 0.297 21.9 t30 -86.52 49.08 1.73 Allowed 'General case' 0 N--CA 1.47 0.549 1 CA-C-O 130.841 5.115 . . . . 0.0 111.637 176.374 . . . . . . . . 4 3 . 1 . 004 nuclear nobuild core ' A' A ' 22' ' ' GLU . . . . . 0.442 ' HA ' ' HB2' ' A' ' 25' ' ' ARG . 10.3 mt-10 -164.38 -39.76 0.03 OUTLIER 'General case' 0 N--CA 1.469 0.523 1 CA-C-N 106.201 -5.0 . . . . 0.0 117.198 -172.409 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 23' ' ' VAL . . . . . 0.454 ' C ' ' H ' ' A' ' 25' ' ' ARG . 41.3 t -61.84 -48.81 86.91 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.538 0 O-C-N 119.495 -2.003 . . . . 0.0 112.42 148.76 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -86.73 31.17 0.69 Allowed 'General case' 0 N--CA 1.469 0.496 0 CA-C-O 126.791 3.186 . . . . 0.0 112.174 176.331 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 25' ' ' ARG . . . . . 0.454 ' H ' ' C ' ' A' ' 23' ' ' VAL . 15.0 mtp180 -165.33 55.63 0.12 Allowed 'General case' 0 N--CA 1.47 0.538 0 CA-C-N 108.492 -3.958 . . . . 0.0 114.254 173.806 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 26' ' ' LEU . . . . . 0.441 HD12 ' HA ' ' A' ' 26' ' ' LEU . 5.5 tp -179.37 -53.54 0.01 OUTLIER 'General case' 0 N--CA 1.47 0.56 1 CA-C-N 105.333 -5.394 . . . . 0.0 116.017 174.833 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . 0.269 0.1 OUTLIER -86.46 -27.96 23.77 Favored 'General case' 0 N--CA 1.47 0.541 0 N-CA-C 115.567 1.691 . . . . 0.0 115.567 -168.126 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 73.0 mmtt -81.61 -29.56 33.25 Favored 'General case' 0 N--CA 1.47 0.543 0 O-C-N 118.681 -2.512 . . . . 0.0 108.45 178.246 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 38.2 tp -82.8 -43.63 16.48 Favored 'General case' 0 N--CA 1.471 0.589 0 CA-C-N 122.274 2.306 . . . . 0.0 116.193 161.944 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 30' ' ' VAL . . . . . . . . . . . . 0.332 1.1 t . . . . . 0 N--CA 1.47 0.561 0 O-C-N 119.268 -2.145 . . . . 0.0 107.934 175.424 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 18' ' ' HIS . . . . . 0.453 ' C ' ' H ' ' A' ' 20' ' ' GLU . 0.0 OUTLIER . . . . . 0 N--CA 1.471 0.598 0 CA-C-O 122.872 1.32 . . . . 0.0 108.043 . . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 19' ' ' LEU . . . . . 0.437 ' HA ' HD12 ' A' ' 19' ' ' LEU . 4.9 tp -71.31 41.36 0.07 Allowed 'General case' 0 N--CA 1.47 0.549 1 C-N-CA 131.845 4.058 . . . . 0.0 116.819 178.34 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 20' ' ' GLU . . . . . 0.453 ' H ' ' C ' ' A' ' 18' ' ' HIS 0.253 1.1 pp20? -161.69 -47.02 0.04 OUTLIER 'General case' 0 N--CA 1.47 0.565 1 CA-C-N 102.886 -6.506 . . . . 0.0 117.062 -169.581 . . . . . . . . 4 3 . 1 . 005 nuclear nobuild core ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 5.4 t-20 -92.63 63.77 4.07 Favored 'General case' 0 N--CA 1.47 0.527 0 CA-C-O 128.383 3.944 . . . . 0.0 106.854 158.808 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 11.8 mm-40 -170.15 -55.27 0.02 OUTLIER 'General case' 0 N--CA 1.47 0.552 1 C-N-CA 133.898 4.879 . . . . 0.0 108.111 -177.95 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 3.2 t -73.9 -29.97 27.12 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.545 0 CA-C-N 113.991 -1.458 . . . . 0.0 111.291 178.27 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -81.69 -26.85 34.32 Favored 'General case' 0 N--CA 1.47 0.574 0 N-CA-C 119.682 3.216 . . . . 0.0 119.682 163.909 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 11.5 mtp180 -70.78 -46.78 62.27 Favored 'General case' 0 N--CA 1.472 0.632 0 CA-C-O 113.577 -3.106 . . . . 0.0 113.861 177.615 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 1.1 mt -85.61 -149.35 0.13 Allowed 'General case' 0 N--CA 1.47 0.556 0 CA-C-O 115.052 -2.404 . . . . 0.0 106.948 168.86 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 78.9 mttt 46.33 -58.06 0.0 OUTLIER 'General case' 0 N--CA 1.47 0.549 1 C-N-CA 131.804 4.042 . . . . 0.0 120.898 163.035 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 19.5 tptm -70.43 -40.17 73.95 Favored 'General case' 0 N--CA 1.47 0.57 0 C-N-CA 123.116 0.567 . . . . 0.0 109.551 168.359 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 29' ' ' LEU . . . . . 0.545 ' HG ' HG23 ' A' ' 30' ' ' VAL . 14.4 tp -87.54 -34.71 18.5 Favored 'General case' 0 N--CA 1.471 0.591 0 N-CA-C 117.058 2.244 . . . . 0.0 117.058 -179.518 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 30' ' ' VAL . . . . . 0.545 HG23 ' HG ' ' A' ' 29' ' ' LEU . 48.1 t . . . . . 0 N--CA 1.47 0.573 0 C-N-CA 130.733 3.613 . . . . 0.0 108.725 -179.859 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 18' ' ' HIS . . . . . 0.538 ' CE1' ' H ' ' A' ' 21' ' ' ASN 0.871 86.9 m-70 . . . . . 0 N--CA 1.469 0.518 0 N-CA-C 120.886 3.661 . . . . 0.0 120.886 . . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 19' ' ' LEU . . . . . 0.642 ' H ' ' HG3' ' A' ' 22' ' ' GLU 0.492 2.7 tt 65.64 99.0 0.04 OUTLIER 'General case' 0 N--CA 1.47 0.542 2 N-CA-C 130.135 7.087 . . . . 0.0 130.135 -35.814 . . . . . . . . 4 3 . 1 . 006 nuclear nobuild core ' A' A ' 20' ' ' GLU . . . . . . . . . . . . 0.253 6.0 pt-20 75.28 6.9 4.13 Favored 'General case' 0 N--CA 1.469 0.486 3 N-CA-C 126.54 5.756 . . . . 0.0 126.54 173.009 . . . . . . . . 3 2 . 1 . 006 nuclear nobuild core ' A' A ' 21' ' ' ASN . . . . . 0.538 ' H ' ' CE1' ' A' ' 18' ' ' HIS . 57.8 t-20 -85.21 -81.99 0.19 Allowed 'General case' 0 N--CA 1.47 0.57 1 N-CA-C 98.397 -4.668 . . . . 0.0 98.397 141.7 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 22' ' ' GLU . . . . . 0.642 ' HG3' ' H ' ' A' ' 19' ' ' LEU . 11.5 mm-40 42.42 -95.57 0.02 OUTLIER 'General case' 0 N--CA 1.469 0.49 0 N-CA-C 116.119 1.896 . . . . 0.0 116.119 162.39 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 23' ' ' VAL . . . . . . . . . . . . 0.541 0.6 OUTLIER 14.4 -76.97 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.47 0.561 1 N-CA-C 123.365 4.579 . . . . 0.0 123.365 140.969 . . . . . . . . 4 3 . 1 . 006 nuclear nobuild core ' A' A ' 24' ' ' ALA . . . . . . . . . . . . 0.251 . . -76.03 36.95 0.15 Allowed 'General case' 0 N--CA 1.47 0.538 1 CA-C-N 106.582 -4.826 . . . . 0.0 116.762 167.852 . . . . . . . . 3 2 . 1 . 006 nuclear nobuild core ' A' A ' 25' ' ' ARG . . . . . . . . . . . . 0.353 31.5 mtp180 -163.85 -48.19 0.03 OUTLIER 'General case' 0 N--CA 1.471 0.578 0 O-C-N 119.468 -2.02 . . . . 0.0 110.002 -179.413 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 16.2 mt -77.91 -128.35 0.01 OUTLIER 'General case' 0 N--CA 1.47 0.553 0 O-C-N 125.668 1.855 . . . . 0.0 107.475 165.361 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . 0.323 46.0 mttp 23.53 -72.69 0.0 OUTLIER 'General case' 0 N--CA 1.47 0.532 0 C-N-CA 129.665 3.186 . . . . 0.0 117.792 153.76 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 28' ' ' LYS . . . . . . . . . . . . 0.369 47.4 mtpt -91.24 13.71 16.42 Favored 'General case' 0 N--CA 1.471 0.589 0 O-C-N 118.436 -2.665 . . . . 0.0 117.147 -170.086 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 40.4 tp -149.7 -47.92 0.14 Allowed 'General case' 0 N--CA 1.47 0.553 0 CA-C-N 110.726 -2.943 . . . . 0.0 108.329 -174.464 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 62.1 t . . . . . 0 N--CA 1.471 0.582 0 C-N-CA 124.459 1.103 . . . . 0.0 113.179 -179.291 . . . . . . . . 0 0 . 1 . 007 nuclear nobuild core ' A' A ' 18' ' ' HIS . . . . . 0.406 ' CD2' HD13 ' A' ' 19' ' ' LEU . 0.5 OUTLIER . . . . . 0 N--CA 1.47 0.529 0 CA-C-O 114.24 -2.791 . . . . 0.0 107.232 . . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 19' ' ' LEU . . . . . 0.502 ' HA ' HD12 ' A' ' 19' ' ' LEU . 1.6 tp -78.25 -20.33 51.9 Favored 'General case' 0 N--CA 1.47 0.562 0 CA-C-O 125.616 2.626 . . . . 0.0 116.522 -171.487 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 20' ' ' GLU . . . . . 0.414 ' HG2' ' H ' ' A' ' 20' ' ' GLU . 6.4 pt-20 -74.18 -47.76 33.53 Favored 'General case' 0 N--CA 1.47 0.563 2 CA-C-N 106.613 -4.812 . . . . 0.0 122.829 161.179 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 57.3 m-80 -97.77 61.18 1.56 Allowed 'General case' 0 N--CA 1.47 0.544 0 CA-C-O 127.315 3.436 . . . . 0.0 108.552 167.471 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -163.25 -39.49 0.03 OUTLIER 'General case' 0 N--CA 1.471 0.588 0 CA-C-N 109.415 -3.538 . . . . 0.0 112.08 -179.602 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 98.2 t -68.86 -45.28 80.96 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.604 1 CA-C-O 111.268 -4.206 . . . . 0.0 107.686 155.292 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -82.03 69.91 8.84 Favored 'General case' 0 N--CA 1.47 0.557 0 N-CA-C 116.772 2.138 . . . . 0.0 116.772 159.179 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 30.4 mtt-85 -171.89 -52.42 0.02 OUTLIER 'General case' 0 N--CA 1.471 0.592 1 CA-C-N 107.822 -4.263 . . . . 0.0 109.739 175.897 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 86.9 mt -83.05 -26.79 30.8 Favored 'General case' 0 N--CA 1.47 0.527 1 O-C-N 116.068 -4.145 . . . . 0.0 110.637 -167.196 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 24.9 tptp -82.86 -27.77 30.54 Favored 'General case' 0 N--CA 1.469 0.498 0 C-N-CA 115.128 -2.629 . . . . 0.0 109.506 -169.993 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 74.0 mttt -84.5 26.83 0.76 Allowed 'General case' 0 N--CA 1.47 0.539 0 C-N-CA 128.111 2.565 . . . . 0.0 116.388 166.431 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 29' ' ' LEU . . . . . 0.417 HD12 HG22 ' A' ' 30' ' ' VAL 0.342 3.4 pp -147.15 -21.37 0.4 Allowed 'General case' 0 N--CA 1.47 0.542 0 CA-C-O 115.731 -2.08 . . . . 0.0 114.257 158.991 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 30' ' ' VAL . . . . . 0.417 HG22 HD12 ' A' ' 29' ' ' LEU . 0.9 OUTLIER . . . . . 0 N--CA 1.471 0.579 0 CA-C-N 119.749 1.158 . . . . 0.0 111.924 170.21 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 18' ' ' HIS . . . . . . . . . . . . 0.263 0.7 OUTLIER . . . . . 0 N--CA 1.471 0.607 1 N-CA-C 128.05 6.315 . . . . 0.0 128.05 . . . . . . . . . 3 2 . 1 . 008 nuclear nobuild core ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER 74.51 0.86 3.69 Favored 'General case' 0 N--CA 1.47 0.572 2 C-N-CA 144.464 9.105 . . . . 0.0 113.977 -18.658 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 11.2 mt-10 -164.53 -77.06 0.03 OUTLIER 'General case' 0 N--CA 1.47 0.53 0 CA-C-N 112.594 -2.093 . . . . 0.0 115.56 -173.718 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 10.3 t-20 -85.98 78.07 9.53 Favored 'General case' 0 N--CA 1.47 0.569 0 N-CA-C 109.135 -0.691 . . . . 0.0 109.135 164.667 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 23.6 mt-10 -164.72 -54.4 0.03 OUTLIER 'General case' 0 N--CA 1.47 0.532 2 C-N-CA 138.718 6.807 . . . . 0.0 105.578 168.994 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 23' ' ' VAL . . . . . 0.599 HG13 ' HB3' ' A' ' 27' ' ' LYS 0.344 3.2 t -72.93 -35.52 49.21 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.478 0 CA-C-O 112.131 -3.795 . . . . 0.0 114.657 170.567 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -80.76 51.42 1.51 Allowed 'General case' 0 N--CA 1.47 0.56 0 CA-C-O 123.937 1.827 . . . . 0.0 111.448 167.918 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 46.7 mtp85 -163.8 -10.82 0.03 OUTLIER 'General case' 0 N--CA 1.47 0.565 0 N-CA-C 119.862 3.282 . . . . 0.0 119.862 178.704 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 1.7 pp -163.18 20.16 0.08 Allowed 'General case' 0 N--CA 1.469 0.497 0 N-CA-C 117.22 2.304 . . . . 0.0 117.22 177.638 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 27' ' ' LYS . . . . . 0.599 ' HB3' HG13 ' A' ' 23' ' ' VAL . 0.3 OUTLIER -156.49 45.46 0.42 Allowed 'General case' 0 N--CA 1.469 0.499 0 CA-C-N 112.446 -2.161 . . . . 0.0 105.433 -176.605 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 47.2 tptt 121.35 79.31 0.0 OUTLIER 'General case' 0 N--CA 1.47 0.562 1 C-N-CA 132.819 4.447 . . . . 0.0 108.008 -152.958 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 29' ' ' LEU . . . . . 0.406 ' HG ' ' H ' ' A' ' 30' ' ' VAL 0.553 32.9 tp 40.29 -118.99 0.34 Allowed 'General case' 0 N--CA 1.47 0.552 1 C-N-CA 144.141 8.976 . . . . 0.0 118.569 2.691 . . . . . . . . 4 3 . 1 . 008 nuclear nobuild core ' A' A ' 30' ' ' VAL . . . . . 0.406 ' H ' ' HG ' ' A' ' 29' ' ' LEU . 60.2 t . . . . . 0 N--CA 1.47 0.563 0 C-N-CA 129.797 3.239 . . . . 0.0 113.798 170.954 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 18' ' ' HIS . . . . . 0.722 ' CD2' ' HB3' ' A' ' 19' ' ' LEU . 0.0 OUTLIER . . . . . 0 N--CA 1.47 0.531 0 CA-C-O 124.209 1.957 . . . . 0.0 113.759 . . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 19' ' ' LEU . . . . . 0.722 ' HB3' ' CD2' ' A' ' 18' ' ' HIS . 1.3 pp -152.83 84.72 1.22 Allowed 'General case' 0 N--CA 1.47 0.536 0 O-C-N 118.206 -2.809 . . . . 0.0 117.319 12.093 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 20' ' ' GLU . . . . . 0.607 ' HG3' ' H ' ' A' ' 21' ' ' ASN . 6.3 pt-20 -76.18 -51.48 12.04 Favored 'General case' 0 N--CA 1.47 0.542 1 CA-C-N 103.367 -6.288 . . . . 0.0 112.589 162.483 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 21' ' ' ASN . . . . . 0.607 ' H ' ' HG3' ' A' ' 20' ' ' GLU . 2.4 t-20 -85.02 65.07 9.05 Favored 'General case' 0 N--CA 1.469 0.518 0 CA-C-N 114.84 -1.073 . . . . 0.0 112.257 168.039 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 22' ' ' GLU . . . . . 0.65 ' HB2' ' HB2' ' A' ' 19' ' ' LEU . 12.1 mm-40 -164.24 -36.81 0.03 OUTLIER 'General case' 0 N--CA 1.47 0.56 1 O-C-N 131.439 5.462 . . . . 0.0 111.384 167.13 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 95.7 t -75.31 -27.23 19.25 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.555 0 CA-C-O 113.395 -3.193 . . . . 0.0 118.952 160.467 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 24' ' ' ALA . . . . . . . . . . . . 0.287 . . -165.7 94.27 0.59 Allowed 'General case' 0 N--CA 1.47 0.534 1 O-C-N 131.329 5.393 . . . . 0.0 103.393 168.781 . . . . . . . . 3 2 . 1 . 009 nuclear nobuild core ' A' A ' 25' ' ' ARG . . . . . 0.498 ' HG3' ' OD1' ' A' ' 21' ' ' ASN 0.797 51.2 mtt85 43.38 -76.02 0.0 OUTLIER 'General case' 0 N--CA 1.47 0.545 2 N-CA-C 130.16 7.096 . . . . 0.0 130.16 -6.319 . . . . . . . . 4 3 . 1 . 009 nuclear nobuild core ' A' A ' 26' ' ' LEU . . . . . . . . . . . . 0.429 68.8 tp -79.94 10.12 4.6 Favored 'General case' 0 N--CA 1.47 0.559 0 O-C-N 118.789 -2.444 . . . . 0.0 110.927 -167.607 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 34.6 tptt -154.22 31.95 0.43 Allowed 'General case' 0 N--CA 1.47 0.56 0 C-N-CA 129.298 3.039 . . . . 0.0 110.866 175.209 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 13.6 mmtt -147.18 33.79 0.89 Allowed 'General case' 0 N--CA 1.47 0.541 0 CA-C-N 110.792 -2.913 . . . . 0.0 116.562 -178.038 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 25.9 tp -155.29 -47.86 0.08 Allowed 'General case' 0 N--CA 1.47 0.547 0 CA-C-N 113.521 -1.672 . . . . 0.0 111.306 -168.019 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 22.2 t . . . . . 0 N--CA 1.47 0.538 0 O-C-N 120.236 -1.54 . . . . 0.0 113.916 171.753 . . . . . . . . 0 0 . 1 . 010 nuclear nobuild core ' A' A ' 18' ' ' HIS . . . . . 0.411 ' CG ' ' N ' ' A' ' 19' ' ' LEU 0.466 0.1 OUTLIER . . . . . 0 N--CA 1.471 0.597 0 CA-C-O 114.668 -2.587 . . . . 0.0 114.385 . . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 19' ' ' LEU . . . . . 0.535 ' HA ' HD12 ' A' ' 19' ' ' LEU . 2.5 tp 50.87 -70.93 0.0 OUTLIER 'General case' 0 N--CA 1.47 0.528 1 CA-C-O 128.603 4.049 . . . . 0.0 111.113 140.009 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 2.6 pp20? -71.4 -47.15 57.86 Favored 'General case' 0 N--CA 1.47 0.531 0 C-N-CA 131.181 3.792 . . . . 0.0 117.779 -176.47 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 21' ' ' ASN . . . . . 0.444 ' O ' ' HG3' ' A' ' 25' ' ' ARG . 0.9 OUTLIER -93.71 -12.41 29.31 Favored 'General case' 0 N--CA 1.471 0.585 0 CA-C-O 113.739 -3.029 . . . . 0.0 114.072 171.918 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 22' ' ' GLU . . . . . 0.448 ' O ' ' HB2' ' A' ' 26' ' ' LEU . 29.8 mm-40 -63.86 -41.51 97.76 Favored 'General case' 0 N--CA 1.47 0.566 0 O-C-N 124.916 1.385 . . . . 0.0 108.165 165.407 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 53.8 t -79.27 59.24 0.14 Allowed 'Isoleucine or valine' 0 N--CA 1.471 0.585 0 O-C-N 119.035 -2.291 . . . . 0.0 115.544 166.183 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . 179.19 -33.48 0.01 OUTLIER 'General case' 0 N--CA 1.47 0.559 1 C-N-CA 134.514 5.125 . . . . 0.0 109.318 179.668 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 25' ' ' ARG . . . . . 0.444 ' HG3' ' O ' ' A' ' 21' ' ' ASN . 27.1 mtp85 -71.03 -75.08 0.13 Allowed 'General case' 0 N--CA 1.469 0.521 0 CA-C-O 117.418 -1.277 . . . . 0.0 113.539 167.178 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 26' ' ' LEU . . . . . 0.48 ' HA ' HD12 ' A' ' 26' ' ' LEU 0.405 1.0 OUTLIER 39.57 -75.28 0.0 OUTLIER 'General case' 0 N--CA 1.471 0.583 1 N-CA-C 126.058 5.577 . . . . 0.0 126.058 153.18 . . . . . . . . 5 4 . 1 . 010 nuclear nobuild core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . 0.265 35.4 tttt -85.47 -15.24 43.54 Favored 'General case' 0 N--CA 1.47 0.548 1 CA-C-N 106.157 -5.02 . . . . 0.0 112.449 -178.059 . . . . . . . . 3 2 . 1 . 010 nuclear nobuild core ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 58.3 mttp -92.11 18.4 8.13 Favored 'General case' 0 N--CA 1.471 0.585 0 O-C-N 119.13 -2.232 . . . . 0.0 114.724 170.259 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 13.0 tp -150.08 -46.88 0.13 Allowed 'General case' 0 N--CA 1.47 0.534 0 CA-C-O 114.467 -2.682 . . . . 0.0 109.576 -173.171 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 30' ' ' VAL . . . . . . . . . . . . 0.438 2.0 t . . . . . 0 N--CA 1.47 0.533 0 N-CA-C 118.096 2.628 . . . . 0.0 118.096 -172.183 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 15' ' ' ACE . . . . . . . . . . . . . . . . . . . . 0 C--O 1.231 0.084 . . . . . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' A' A ' 16' ' ' ASN . . . . . 0.585 ' HB3' ' HB3' ' A' ' 17' ' ' TYR 0.365 61.4 t30 -98.47 -72.74 0.64 Allowed 'General case' 0 N--CA 1.471 0.589 0 C-N-CA 127.299 2.24 . . . . 0.0 114.887 . . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 17' ' ' TYR . . . . . 0.664 ' O ' ' HB2' ' A' ' 19' ' ' LEU . 4.1 t80 62.04 153.56 0.03 OUTLIER 'General case' 0 N--CA 1.47 0.541 2 C-N-CA 142.825 8.45 . . . . 0.0 118.94 -12.185 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 18' ' ' HIS . . . . . 0.433 ' CD2' HD22 ' A' ' 19' ' ' LEU 0.675 0.9 OUTLIER 34.59 -127.61 0.09 Allowed 'General case' 0 N--CA 1.469 0.51 0 CA-C-O 116.301 -1.809 . . . . 0.0 109.919 -178.005 . . . . . . . . 4 4 . 1 . 001 nuclear nobuild full ' A' A ' 19' ' ' LEU . . . . . 0.664 ' HB2' ' O ' ' A' ' 17' ' ' TYR . 0.1 OUTLIER 51.49 -71.33 0.01 OUTLIER 'General case' 0 N--CA 1.47 0.567 0 C-N-CA 127.137 2.175 . . . . 0.0 114.913 146.263 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 20' ' ' GLU . . . . . 0.49 ' CD ' ' H ' ' A' ' 21' ' ' ASN . 2.7 pp20? -81.42 -61.88 1.81 Allowed 'General case' 0 N--CA 1.47 0.529 0 CA-C-N 110.897 -2.865 . . . . 0.0 116.108 174.994 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 21' ' ' ASN . . . . . 0.49 ' H ' ' CD ' ' A' ' 20' ' ' GLU 0.293 5.5 m-80 -83.7 68.39 9.85 Favored 'General case' 0 N--CA 1.47 0.526 0 CA-C-O 121.747 0.784 . . . . 0.0 109.633 163.635 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 1.5 tm-20 -166.56 -37.01 0.03 OUTLIER 'General case' 0 N--CA 1.471 0.58 0 CA-C-N 109.56 -3.473 . . . . 0.0 110.311 175.066 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 60.6 t -74.32 -44.03 49.18 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.553 0 CA-C-N 119.192 0.906 . . . . 0.0 111.807 163.408 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -68.77 -12.57 61.63 Favored 'General case' 0 N--CA 1.47 0.568 0 O-C-N 125.98 2.05 . . . . 0.0 113.399 176.182 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 25' ' ' ARG . . . . . . . . . . . . 0.37 15.8 mtp180 -76.09 -131.57 0.01 OUTLIER 'General case' 0 N--CA 1.471 0.576 0 N-CA-C 106.031 -1.841 . . . . 0.0 106.031 150.777 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 26' ' ' LEU . . . . . . . . . . . . 0.473 0.2 OUTLIER 42.22 -77.35 0.0 OUTLIER 'General case' 0 N--CA 1.47 0.572 1 N-CA-C 122.423 4.231 . . . . 0.0 122.423 157.358 . . . . . . . . 4 3 . 1 . 001 nuclear nobuild full ' A' A ' 27' ' ' LYS . . . . . 0.414 ' HE3' ' HB2' ' A' ' 27' ' ' LYS . 5.7 ttmt -79.44 -24.32 42.55 Favored 'General case' 0 N--CA 1.469 0.517 0 CA-C-N 113.009 -1.905 . . . . 0.0 108.925 -168.692 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 48.0 mttt -76.98 -36.67 56.27 Favored 'General case' 0 N--CA 1.47 0.55 0 C-N-CA 126.384 1.874 . . . . 0.0 115.695 -179.044 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 22.9 mt -80.42 -36.72 33.33 Favored 'General case' 0 N--CA 1.47 0.547 0 CA-C-N 110.329 -3.123 . . . . 0.0 111.87 171.789 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 22.1 t -96.98 -89.84 0.11 Allowed 'Isoleucine or valine' 0 N--CA 1.47 0.572 0 CA-C-O 115.873 -2.013 . . . . 0.0 112.349 178.367 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . -179.16 -140.82 4.18 Favored Glycine 0 CA--C 1.53 1.0 1 O-C-N 132.029 5.831 . . . . 0.0 114.796 174.597 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 32' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.33 -0.241 0 O-C-N 117.218 -3.519 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' A' A ' 15' ' ' ACE . . . . . . . . . . . . . . . . . . . . 0 C--O 1.23 0.055 . . . . . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' A' A ' 16' ' ' ASN . . . . . . . . . . . . 0.359 26.8 t30 83.61 107.68 0.06 Allowed 'General case' 0 N--CA 1.47 0.559 1 C-N-CA 135.089 5.355 . . . . 0.0 110.028 . . . . . . . . . 3 2 . 1 . 002 nuclear nobuild full ' A' A ' 17' ' ' TYR . . . . . 0.776 ' HA ' ' H ' ' A' ' 19' ' ' LEU . 24.8 m-85 58.32 74.2 0.44 Allowed 'General case' 0 N--CA 1.471 0.601 0 O-C-N 128.636 3.71 . . . . 0.0 112.1 -173.822 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 18' ' ' HIS . . . . . . . . . . . . 0.522 0.0 OUTLIER 67.58 -54.0 0.49 Allowed 'General case' 0 N--CA 1.471 0.583 2 C-N-CA 134.534 5.134 . . . . 0.0 123.534 -0.75 . . . . . . . . 4 3 . 1 . 002 nuclear nobuild full ' A' A ' 19' ' ' LEU . . . . . 0.776 ' H ' ' HA ' ' A' ' 17' ' ' TYR 0.321 1.5 tm? -76.86 -10.85 59.66 Favored 'General case' 0 N--CA 1.469 0.496 0 CA-C-O 124.373 2.035 . . . . 0.0 113.183 -149.429 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 9.7 pt-20 -58.89 -23.17 60.74 Favored 'General case' 0 N--CA 1.47 0.566 0 O-C-N 118.001 -2.937 . . . . 0.0 114.056 169.099 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 12.9 t-20 -81.77 -25.14 35.55 Favored 'General case' 0 N--CA 1.47 0.563 0 C-N-CA 124.225 1.01 . . . . 0.0 109.709 -173.471 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 22' ' ' GLU . . . . . 0.558 ' HG3' HD22 ' A' ' 19' ' ' LEU . 10.2 mm-40 -71.15 -24.62 62.29 Favored 'General case' 0 N--CA 1.47 0.572 0 C-N-CA 128.208 2.603 . . . . 0.0 111.407 178.96 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 21.8 t -73.9 -54.46 15.04 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.542 0 CA-C-N 110.48 -3.054 . . . . 0.0 114.655 167.543 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -69.56 -15.07 63.16 Favored 'General case' 0 N--CA 1.47 0.569 0 CA-C-O 123.065 1.412 . . . . 0.0 114.764 174.643 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 6.7 mtt180 -71.19 -44.52 65.27 Favored 'General case' 0 N--CA 1.47 0.561 0 O-C-N 117.297 -3.377 . . . . 0.0 114.065 164.743 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 26' ' ' LEU . . . . . . . . . . . . 0.32 4.5 mm? -71.32 -41.1 70.28 Favored 'General case' 0 N--CA 1.47 0.552 0 N-CA-C 119.299 3.074 . . . . 0.0 119.299 172.959 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 52.2 mmtt -87.05 45.79 1.31 Allowed 'General case' 0 N--CA 1.47 0.556 0 C-N-CA 126.678 1.991 . . . . 0.0 108.914 -172.113 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 36.5 mttm -158.33 -39.02 0.06 Allowed 'General case' 0 N--CA 1.47 0.526 1 C-N-CA 132.769 4.428 . . . . 0.0 113.731 176.596 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 9.6 tp -82.1 -50.24 9.28 Favored 'General case' 0 N--CA 1.471 0.608 0 O-C-N 120.983 -1.073 . . . . 0.0 108.64 173.242 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 3.2 m -154.81 92.82 0.08 OUTLIER 'Isoleucine or valine' 0 N--CA 1.47 0.569 0 CA-C-O 127.828 3.68 . . . . 0.0 112.735 -178.19 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . -170.18 106.47 0.24 Allowed Glycine 0 CA--C 1.529 0.945 1 CA-C-N 108.166 -4.106 . . . . 0.0 117.013 -176.664 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 32' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.331 -0.213 0 O-C-N 120.435 -1.626 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' A' A ' 15' ' ' ACE . . . . . 0.538 ' H1 ' ' O ' ' A' ' 16' ' ' ASN . . . . . . . . 0 C--O 1.23 0.043 . . . . . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 16' ' ' ASN . . . . . 0.538 ' O ' ' H1 ' ' A' ' 15' ' ' ACE . 0.2 OUTLIER 48.17 88.08 0.02 OUTLIER 'General case' 0 N--CA 1.469 0.519 1 C-N-CA 134.84 5.256 . . . . 0.0 113.444 . . . . . . . . . 4 4 . 1 . 003 nuclear nobuild full ' A' A ' 17' ' ' TYR . . . . . 0.561 ' HA ' ' HD2' ' A' ' 18' ' ' HIS . 10.4 m-30 -79.43 145.62 33.23 Favored 'General case' 0 N--CA 1.47 0.551 0 C-N-CA 129.774 3.23 . . . . 0.0 115.025 -13.345 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 18' ' ' HIS . . . . . 0.668 ' CD2' ' HB2' ' A' ' 19' ' ' LEU 0.355 0.0 OUTLIER 42.33 -167.77 0.01 OUTLIER 'General case' 0 N--CA 1.47 0.541 3 C-N-CA 133.878 4.871 . . . . 0.0 124.069 7.116 . . . . . . . . 5 4 . 1 . 003 nuclear nobuild full ' A' A ' 19' ' ' LEU . . . . . 0.668 ' HB2' ' CD2' ' A' ' 18' ' ' HIS 0.34 0.2 OUTLIER 66.44 -48.69 0.44 Allowed 'General case' 0 N--CA 1.469 0.522 0 C-N-CA 130.169 3.388 . . . . 0.0 115.741 170.59 . . . . . . . . 4 4 . 1 . 003 nuclear nobuild full ' A' A ' 20' ' ' GLU . . . . . . . . . . . . 0.279 19.7 mt-10 -83.64 -48.78 9.83 Favored 'General case' 0 N--CA 1.47 0.554 0 C-N-CA 131.105 3.762 . . . . 0.0 107.637 169.237 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 21' ' ' ASN . . . . . 0.52 ' O ' ' HG2' ' A' ' 22' ' ' GLU . 12.7 m120 -88.51 67.48 8.54 Favored 'General case' 0 N--CA 1.47 0.553 0 CA-C-N 113.275 -1.784 . . . . 0.0 107.362 172.301 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 22' ' ' GLU . . . . . 0.543 ' O ' ' HB2' ' A' ' 25' ' ' ARG . 6.3 mm-40 -175.3 -56.78 0.01 OUTLIER 'General case' 0 N--CA 1.469 0.498 2 C-N-CA 137.266 6.226 . . . . 0.0 109.632 -172.215 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 23' ' ' VAL . . . . . . . . . . . . 0.367 22.4 t -75.42 -37.69 38.5 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.575 0 O-C-N 127.609 3.068 . . . . 0.0 114.495 171.429 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -80.6 42.1 0.59 Allowed 'General case' 0 N--CA 1.47 0.55 0 CA-C-N 112.857 -1.974 . . . . 0.0 112.467 162.161 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 25' ' ' ARG . . . . . 0.543 ' HB2' ' O ' ' A' ' 22' ' ' GLU 0.348 17.3 mtt180 -154.99 18.01 0.43 Allowed 'General case' 0 N--CA 1.471 0.588 0 CA-C-N 114.821 -1.081 . . . . 0.0 111.233 168.355 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 4.3 tp -170.35 29.23 0.02 OUTLIER 'General case' 0 N--CA 1.471 0.581 0 CA-C-O 124.727 2.203 . . . . 0.0 111.146 -172.875 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 27.2 tptt -154.07 -20.43 0.13 Allowed 'General case' 0 N--CA 1.469 0.497 0 C-N-CA 129.011 2.925 . . . . 0.0 116.357 178.879 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 16.3 ptmt -153.28 58.84 0.77 Allowed 'General case' 0 N--CA 1.47 0.568 0 CA-C-N 124.168 3.167 . . . . 0.0 107.99 171.97 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 29' ' ' LEU . . . . . 0.462 ' HG ' HG23 ' A' ' 30' ' ' VAL 0.431 12.1 tp 36.62 -82.7 0.0 OUTLIER 'General case' 0 N--CA 1.471 0.612 3 C-N-CA 138.541 6.736 . . . . 0.0 127.759 29.293 . . . . . . . . 4 3 . 1 . 003 nuclear nobuild full ' A' A ' 30' ' ' VAL . . . . . 0.462 HG23 ' HG ' ' A' ' 29' ' ' LEU . 45.2 t -161.2 128.41 0.59 Allowed 'Isoleucine or valine' 0 N--CA 1.47 0.563 0 O-C-N 125.875 1.984 . . . . 0.0 109.807 -174.403 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . -118.08 -153.61 9.61 Favored Glycine 0 CA--C 1.532 1.098 0 O-C-N 124.597 1.186 . . . . 0.0 115.392 -178.937 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 32' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.329 -0.31 0 CA-C-N 115.029 -0.585 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' A' A ' 15' ' ' ACE . . . . . . . . . . . . . . . . . . . . 0 C--O 1.23 0.047 . . . . . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' A' A ' 16' ' ' ASN . . . . . . . . . . . . 0.276 21.3 p-10 28.97 103.64 0.0 OUTLIER 'General case' 0 N--CA 1.47 0.562 2 N-CA-C 127.425 6.083 . . . . 0.0 127.425 . . . . . . . . . 3 2 . 1 . 004 nuclear nobuild full ' A' A ' 17' ' ' TYR . . . . . 0.725 ' HB2' ' CD2' ' A' ' 18' ' ' HIS 0.751 0.0 OUTLIER 66.42 -131.71 0.18 Allowed 'General case' 0 N--CA 1.471 0.591 0 C-N-CA 130.915 3.686 . . . . 0.0 113.635 8.696 . . . . . . . . 4 4 . 1 . 004 nuclear nobuild full ' A' A ' 18' ' ' HIS . . . . . 0.854 ' CD2' ' HB2' ' A' ' 19' ' ' LEU . 0.0 OUTLIER -155.9 128.67 7.91 Favored 'General case' 0 N--CA 1.47 0.574 2 C-N-CA 139.175 6.99 . . . . 0.0 116.39 0.902 . . . . . . . . 4 4 . 1 . 004 nuclear nobuild full ' A' A ' 19' ' ' LEU . . . . . 0.854 ' HB2' ' CD2' ' A' ' 18' ' ' HIS 0.317 1.5 tp -160.06 111.47 1.96 Allowed 'General case' 0 N--CA 1.47 0.553 0 CA-C-O 128.06 3.79 . . . . 0.0 110.503 28.982 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 20' ' ' GLU . . . . . 0.725 ' OE2' ' HB2' ' A' ' 21' ' ' ASN . 0.0 OUTLIER -164.08 -48.31 0.03 OUTLIER 'General case' 0 N--CA 1.469 0.505 1 CA-C-N 104.112 -5.949 . . . . 0.0 115.953 -155.28 . . . . . . . . 4 4 . 1 . 004 nuclear nobuild full ' A' A ' 21' ' ' ASN . . . . . 0.725 ' HB2' ' OE2' ' A' ' 20' ' ' GLU 0.297 21.9 t30 -86.52 49.08 1.73 Allowed 'General case' 0 N--CA 1.47 0.549 1 CA-C-O 130.841 5.115 . . . . 0.0 111.637 176.374 . . . . . . . . 4 3 . 1 . 004 nuclear nobuild full ' A' A ' 22' ' ' GLU . . . . . 0.442 ' HA ' ' HB2' ' A' ' 25' ' ' ARG . 10.3 mt-10 -164.38 -39.76 0.03 OUTLIER 'General case' 0 N--CA 1.469 0.523 1 CA-C-N 106.201 -5.0 . . . . 0.0 117.198 -172.409 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 23' ' ' VAL . . . . . 0.454 ' C ' ' H ' ' A' ' 25' ' ' ARG . 41.3 t -61.84 -48.81 86.91 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.538 0 O-C-N 119.495 -2.003 . . . . 0.0 112.42 148.76 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -86.73 31.17 0.69 Allowed 'General case' 0 N--CA 1.469 0.496 0 CA-C-O 126.791 3.186 . . . . 0.0 112.174 176.331 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 25' ' ' ARG . . . . . 0.454 ' H ' ' C ' ' A' ' 23' ' ' VAL . 15.0 mtp180 -165.33 55.63 0.12 Allowed 'General case' 0 N--CA 1.47 0.538 0 CA-C-N 108.492 -3.958 . . . . 0.0 114.254 173.806 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 26' ' ' LEU . . . . . 0.441 HD12 ' HA ' ' A' ' 26' ' ' LEU . 5.5 tp -179.37 -53.54 0.01 OUTLIER 'General case' 0 N--CA 1.47 0.56 1 CA-C-N 105.333 -5.394 . . . . 0.0 116.017 174.833 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . 0.269 0.1 OUTLIER -86.46 -27.96 23.77 Favored 'General case' 0 N--CA 1.47 0.541 0 N-CA-C 115.567 1.691 . . . . 0.0 115.567 -168.126 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 73.0 mmtt -81.61 -29.56 33.25 Favored 'General case' 0 N--CA 1.47 0.543 0 O-C-N 118.681 -2.512 . . . . 0.0 108.45 178.246 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 38.2 tp -82.8 -43.63 16.48 Favored 'General case' 0 N--CA 1.471 0.589 0 CA-C-N 122.274 2.306 . . . . 0.0 116.193 161.944 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 30' ' ' VAL . . . . . . . . . . . . 0.332 1.1 t -94.34 95.28 5.04 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.561 0 O-C-N 119.268 -2.145 . . . . 0.0 107.934 175.424 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . 97.2 -55.01 1.3 Allowed Glycine 0 CA--C 1.53 0.981 0 N-CA-C 121.535 3.374 . . . . 0.0 121.535 176.39 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 32' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.331 -0.23 1 O-C-N 112.674 -6.192 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 15' ' ' ACE . . . . . . . . . . . . . . . . . . . . 0 C--O 1.23 0.056 . . . . . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' A' A ' 16' ' ' ASN . . . . . 0.505 ' HA ' ' HG2' ' A' ' 20' ' ' GLU 0.324 25.7 t-20 76.91 139.75 0.07 Allowed 'General case' 0 N--CA 1.469 0.496 1 C-N-CA 132.468 4.307 . . . . 0.0 109.498 . . . . . . . . . 4 3 . 1 . 005 nuclear nobuild full ' A' A ' 17' ' ' TYR . . . . . . . . . . . . . 24.6 t80 54.41 95.46 0.02 OUTLIER 'General case' 0 N--CA 1.47 0.541 0 CA-C-N 109.691 -3.413 . . . . 0.0 116.361 -169.469 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 18' ' ' HIS . . . . . 0.453 ' C ' ' H ' ' A' ' 20' ' ' GLU . 0.0 OUTLIER 83.57 -48.04 0.13 Allowed 'General case' 0 N--CA 1.471 0.598 0 C-N-CA 129.81 3.244 . . . . 0.0 108.043 171.002 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 19' ' ' LEU . . . . . 0.437 ' HA ' HD12 ' A' ' 19' ' ' LEU . 4.9 tp -71.31 41.36 0.07 Allowed 'General case' 0 N--CA 1.47 0.549 1 C-N-CA 131.845 4.058 . . . . 0.0 116.819 178.34 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 20' ' ' GLU . . . . . 0.505 ' HG2' ' HA ' ' A' ' 16' ' ' ASN 0.253 1.1 pp20? -161.69 -47.02 0.04 OUTLIER 'General case' 0 N--CA 1.47 0.565 1 CA-C-N 102.886 -6.506 . . . . 0.0 117.062 -169.581 . . . . . . . . 4 3 . 1 . 005 nuclear nobuild full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 5.4 t-20 -92.63 63.77 4.07 Favored 'General case' 0 N--CA 1.47 0.527 0 CA-C-O 128.383 3.944 . . . . 0.0 106.854 158.808 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 11.8 mm-40 -170.15 -55.27 0.02 OUTLIER 'General case' 0 N--CA 1.47 0.552 1 C-N-CA 133.898 4.879 . . . . 0.0 108.111 -177.95 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 3.2 t -73.9 -29.97 27.12 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.545 0 CA-C-N 113.991 -1.458 . . . . 0.0 111.291 178.27 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -81.69 -26.85 34.32 Favored 'General case' 0 N--CA 1.47 0.574 0 N-CA-C 119.682 3.216 . . . . 0.0 119.682 163.909 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 11.5 mtp180 -70.78 -46.78 62.27 Favored 'General case' 0 N--CA 1.472 0.632 0 CA-C-O 113.577 -3.106 . . . . 0.0 113.861 177.615 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 1.1 mt -85.61 -149.35 0.13 Allowed 'General case' 0 N--CA 1.47 0.556 0 CA-C-O 115.052 -2.404 . . . . 0.0 106.948 168.86 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 78.9 mttt 46.33 -58.06 0.0 OUTLIER 'General case' 0 N--CA 1.47 0.549 1 C-N-CA 131.804 4.042 . . . . 0.0 120.898 163.035 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 19.5 tptm -70.43 -40.17 73.95 Favored 'General case' 0 N--CA 1.47 0.57 0 C-N-CA 123.116 0.567 . . . . 0.0 109.551 168.359 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 29' ' ' LEU . . . . . 0.545 ' HG ' HG23 ' A' ' 30' ' ' VAL . 14.4 tp -87.54 -34.71 18.5 Favored 'General case' 0 N--CA 1.471 0.591 0 N-CA-C 117.058 2.244 . . . . 0.0 117.058 -179.518 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 30' ' ' VAL . . . . . 0.545 HG23 ' HG ' ' A' ' 29' ' ' LEU . 48.1 t -154.01 106.49 0.2 Allowed 'Isoleucine or valine' 0 N--CA 1.47 0.573 0 C-N-CA 130.733 3.613 . . . . 0.0 108.725 -179.859 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . -48.69 -87.13 0.01 OUTLIER Glycine 0 CA--C 1.53 0.994 1 O-C-N 130.232 4.707 . . . . 0.0 113.552 172.893 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 32' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.33 -0.25 1 O-C-N 110.707 -7.349 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 15' ' ' ACE . . . . . 0.436 ' H1 ' ' CG ' ' A' ' 16' ' ' ASN . . . . . . . . 0 C--O 1.23 0.064 . . . . . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 16' ' ' ASN . . . . . 0.441 ' O ' HD13 ' A' ' 19' ' ' LEU . 13.5 m-80 -148.72 45.39 1.02 Allowed 'General case' 0 N--CA 1.471 0.6 0 N-CA-C 117.998 2.592 . . . . 0.0 117.998 . . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 17' ' ' TYR . . . . . . . . . . . . 0.473 0.1 OUTLIER 54.39 109.36 0.01 OUTLIER 'General case' 0 N--CA 1.47 0.563 1 C-N-CA 136.916 6.086 . . . . 0.0 120.809 -3.712 . . . . . . . . 4 3 . 1 . 006 nuclear nobuild full ' A' A ' 18' ' ' HIS . . . . . 0.538 ' CE1' ' H ' ' A' ' 21' ' ' ASN 0.871 86.9 m-70 76.12 72.61 0.08 Allowed 'General case' 0 N--CA 1.469 0.518 1 CA-C-N 100.364 -7.653 . . . . 0.0 120.886 -161.519 . . . . . . . . 4 3 . 1 . 006 nuclear nobuild full ' A' A ' 19' ' ' LEU . . . . . 0.642 ' H ' ' HG3' ' A' ' 22' ' ' GLU 0.492 2.7 tt 65.64 99.0 0.04 OUTLIER 'General case' 0 N--CA 1.47 0.542 2 N-CA-C 130.135 7.087 . . . . 0.0 130.135 -35.814 . . . . . . . . 4 3 . 1 . 006 nuclear nobuild full ' A' A ' 20' ' ' GLU . . . . . . . . . . . . 0.253 6.0 pt-20 75.28 6.9 4.13 Favored 'General case' 0 N--CA 1.469 0.486 3 N-CA-C 126.54 5.756 . . . . 0.0 126.54 173.009 . . . . . . . . 3 2 . 1 . 006 nuclear nobuild full ' A' A ' 21' ' ' ASN . . . . . 0.538 ' H ' ' CE1' ' A' ' 18' ' ' HIS . 57.8 t-20 -85.21 -81.99 0.19 Allowed 'General case' 0 N--CA 1.47 0.57 1 N-CA-C 98.397 -4.668 . . . . 0.0 98.397 141.7 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 22' ' ' GLU . . . . . 0.642 ' HG3' ' H ' ' A' ' 19' ' ' LEU . 11.5 mm-40 42.42 -95.57 0.02 OUTLIER 'General case' 0 N--CA 1.469 0.49 0 N-CA-C 116.119 1.896 . . . . 0.0 116.119 162.39 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 23' ' ' VAL . . . . . . . . . . . . 0.541 0.6 OUTLIER 14.4 -76.97 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.47 0.561 1 N-CA-C 123.365 4.579 . . . . 0.0 123.365 140.969 . . . . . . . . 4 3 . 1 . 006 nuclear nobuild full ' A' A ' 24' ' ' ALA . . . . . . . . . . . . 0.251 . . -76.03 36.95 0.15 Allowed 'General case' 0 N--CA 1.47 0.538 1 CA-C-N 106.582 -4.826 . . . . 0.0 116.762 167.852 . . . . . . . . 3 2 . 1 . 006 nuclear nobuild full ' A' A ' 25' ' ' ARG . . . . . . . . . . . . 0.353 31.5 mtp180 -163.85 -48.19 0.03 OUTLIER 'General case' 0 N--CA 1.471 0.578 0 O-C-N 119.468 -2.02 . . . . 0.0 110.002 -179.413 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 16.2 mt -77.91 -128.35 0.01 OUTLIER 'General case' 0 N--CA 1.47 0.553 0 O-C-N 125.668 1.855 . . . . 0.0 107.475 165.361 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . 0.323 46.0 mttp 23.53 -72.69 0.0 OUTLIER 'General case' 0 N--CA 1.47 0.532 0 C-N-CA 129.665 3.186 . . . . 0.0 117.792 153.76 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 28' ' ' LYS . . . . . . . . . . . . 0.369 47.4 mtpt -91.24 13.71 16.42 Favored 'General case' 0 N--CA 1.471 0.589 0 O-C-N 118.436 -2.665 . . . . 0.0 117.147 -170.086 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 40.4 tp -149.7 -47.92 0.14 Allowed 'General case' 0 N--CA 1.47 0.553 0 CA-C-N 110.726 -2.943 . . . . 0.0 108.329 -174.464 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 62.1 t -86.23 -54.56 8.07 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.582 0 C-N-CA 124.459 1.103 . . . . 0.0 113.179 -179.291 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . 160.12 -86.89 0.11 Allowed Glycine 0 CA--C 1.53 0.992 0 CA-C-O 125.888 2.938 . . . . 0.0 115.484 -173.077 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 32' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.329 -0.299 0 O-C-N 120.363 -1.669 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' A' A ' 15' ' ' ACE . . . . . . . . . . . . . . . . . . . . 0 C--O 1.23 0.059 . . . . . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' A' A ' 16' ' ' ASN . . . . . 0.436 HD22 ' CD ' ' A' ' 20' ' ' GLU 0.461 4.5 m120 74.1 -117.46 0.04 OUTLIER 'General case' 0 N--CA 1.469 0.492 1 C-N-CA 134.085 4.954 . . . . 0.0 114.128 . . . . . . . . . 4 3 . 1 . 007 nuclear nobuild full ' A' A ' 17' ' ' TYR . . . . . . . . . . . . 0.582 0.1 OUTLIER 49.82 -68.06 0.0 OUTLIER 'General case' 0 N--CA 1.471 0.586 1 N-CA-C 132.138 7.829 . . . . 0.0 132.138 171.383 . . . . . . . . 4 3 . 1 . 007 nuclear nobuild full ' A' A ' 18' ' ' HIS . . . . . 0.435 ' H ' ' H ' ' A' ' 19' ' ' LEU . 0.5 OUTLIER -149.13 -11.45 0.32 Allowed 'General case' 0 N--CA 1.47 0.529 1 O-C-N 130.487 4.867 . . . . 0.0 107.232 176.196 . . . . . . . . 4 4 . 1 . 007 nuclear nobuild full ' A' A ' 19' ' ' LEU . . . . . 0.502 ' HA ' HD12 ' A' ' 19' ' ' LEU . 1.6 tp -78.25 -20.33 51.9 Favored 'General case' 0 N--CA 1.47 0.562 0 CA-C-O 125.616 2.626 . . . . 0.0 116.522 -171.487 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 20' ' ' GLU . . . . . 0.436 ' CD ' HD22 ' A' ' 16' ' ' ASN . 6.4 pt-20 -74.18 -47.76 33.53 Favored 'General case' 0 N--CA 1.47 0.563 2 CA-C-N 106.613 -4.812 . . . . 0.0 122.829 161.179 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 57.3 m-80 -97.77 61.18 1.56 Allowed 'General case' 0 N--CA 1.47 0.544 0 CA-C-O 127.315 3.436 . . . . 0.0 108.552 167.471 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -163.25 -39.49 0.03 OUTLIER 'General case' 0 N--CA 1.471 0.588 0 CA-C-N 109.415 -3.538 . . . . 0.0 112.08 -179.602 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 98.2 t -68.86 -45.28 80.96 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.604 1 CA-C-O 111.268 -4.206 . . . . 0.0 107.686 155.292 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -82.03 69.91 8.84 Favored 'General case' 0 N--CA 1.47 0.557 0 N-CA-C 116.772 2.138 . . . . 0.0 116.772 159.179 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 30.4 mtt-85 -171.89 -52.42 0.02 OUTLIER 'General case' 0 N--CA 1.471 0.592 1 CA-C-N 107.822 -4.263 . . . . 0.0 109.739 175.897 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 86.9 mt -83.05 -26.79 30.8 Favored 'General case' 0 N--CA 1.47 0.527 1 O-C-N 116.068 -4.145 . . . . 0.0 110.637 -167.196 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 24.9 tptp -82.86 -27.77 30.54 Favored 'General case' 0 N--CA 1.469 0.498 0 C-N-CA 115.128 -2.629 . . . . 0.0 109.506 -169.993 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 74.0 mttt -84.5 26.83 0.76 Allowed 'General case' 0 N--CA 1.47 0.539 0 C-N-CA 128.111 2.565 . . . . 0.0 116.388 166.431 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 29' ' ' LEU . . . . . 0.417 HD12 HG22 ' A' ' 30' ' ' VAL 0.342 3.4 pp -147.15 -21.37 0.4 Allowed 'General case' 0 N--CA 1.47 0.542 0 CA-C-O 115.731 -2.08 . . . . 0.0 114.257 158.991 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 30' ' ' VAL . . . . . 0.417 HG22 HD12 ' A' ' 29' ' ' LEU . 0.9 OUTLIER -151.44 145.27 16.32 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.579 0 CA-C-N 119.749 1.158 . . . . 0.0 111.924 170.21 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . -101.33 -43.27 2.21 Favored Glycine 0 CA--C 1.529 0.929 0 C-N-CA 128.272 2.844 . . . . 0.0 111.967 177.718 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 32' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.331 -0.232 1 O-C-N 113.688 -5.595 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 15' ' ' ACE . . . . . . . . . . . . . . . . . . . . 0 C--O 1.23 0.046 . . . . . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' A' A ' 16' ' ' ASN . . . . . . . . . . . . 0.338 25.0 t-20 44.02 90.17 0.01 OUTLIER 'General case' 0 N--CA 1.471 0.576 1 C-N-CA 135.038 5.335 . . . . 0.0 120.399 . . . . . . . . . 3 2 . 1 . 008 nuclear nobuild full ' A' A ' 17' ' ' TYR . . . . . 0.499 ' CE2' ' HB3' ' A' ' 18' ' ' HIS . 34.0 t80 -161.9 140.16 9.13 Favored 'General case' 0 N--CA 1.471 0.592 0 CA-C-N 124.415 3.28 . . . . 0.0 109.883 12.38 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 18' ' ' HIS . . . . . 0.499 ' HB3' ' CE2' ' A' ' 17' ' ' TYR 0.263 0.7 OUTLIER 77.14 29.18 0.59 Allowed 'General case' 0 N--CA 1.471 0.607 2 N-CA-C 128.05 6.315 . . . . 0.0 128.05 -176.324 . . . . . . . . 5 4 . 1 . 008 nuclear nobuild full ' A' A ' 19' ' ' LEU . . . . . 0.497 ' HB2' ' C ' ' A' ' 17' ' ' TYR . 0.4 OUTLIER 74.51 0.86 3.69 Favored 'General case' 0 N--CA 1.47 0.572 2 C-N-CA 144.464 9.105 . . . . 0.0 113.977 -18.658 . . . . . . . . 4 4 . 1 . 008 nuclear nobuild full ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 11.2 mt-10 -164.53 -77.06 0.03 OUTLIER 'General case' 0 N--CA 1.47 0.53 0 CA-C-N 112.594 -2.093 . . . . 0.0 115.56 -173.718 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 10.3 t-20 -85.98 78.07 9.53 Favored 'General case' 0 N--CA 1.47 0.569 0 N-CA-C 109.135 -0.691 . . . . 0.0 109.135 164.667 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 23.6 mt-10 -164.72 -54.4 0.03 OUTLIER 'General case' 0 N--CA 1.47 0.532 2 C-N-CA 138.718 6.807 . . . . 0.0 105.578 168.994 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 23' ' ' VAL . . . . . 0.599 HG13 ' HB3' ' A' ' 27' ' ' LYS 0.344 3.2 t -72.93 -35.52 49.21 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.478 0 CA-C-O 112.131 -3.795 . . . . 0.0 114.657 170.567 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -80.76 51.42 1.51 Allowed 'General case' 0 N--CA 1.47 0.56 0 CA-C-O 123.937 1.827 . . . . 0.0 111.448 167.918 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 46.7 mtp85 -163.8 -10.82 0.03 OUTLIER 'General case' 0 N--CA 1.47 0.565 0 N-CA-C 119.862 3.282 . . . . 0.0 119.862 178.704 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 1.7 pp -163.18 20.16 0.08 Allowed 'General case' 0 N--CA 1.469 0.497 0 N-CA-C 117.22 2.304 . . . . 0.0 117.22 177.638 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 27' ' ' LYS . . . . . 0.599 ' HB3' HG13 ' A' ' 23' ' ' VAL . 0.3 OUTLIER -156.49 45.46 0.42 Allowed 'General case' 0 N--CA 1.469 0.499 0 CA-C-N 112.446 -2.161 . . . . 0.0 105.433 -176.605 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 47.2 tptt 121.35 79.31 0.0 OUTLIER 'General case' 0 N--CA 1.47 0.562 1 C-N-CA 132.819 4.447 . . . . 0.0 108.008 -152.958 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 29' ' ' LEU . . . . . 0.406 ' HG ' ' H ' ' A' ' 30' ' ' VAL 0.553 32.9 tp 40.29 -118.99 0.34 Allowed 'General case' 0 N--CA 1.47 0.552 1 C-N-CA 144.141 8.976 . . . . 0.0 118.569 2.691 . . . . . . . . 4 3 . 1 . 008 nuclear nobuild full ' A' A ' 30' ' ' VAL . . . . . 0.406 ' H ' ' HG ' ' A' ' 29' ' ' LEU . 60.2 t -85.37 127.93 39.57 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.563 0 C-N-CA 129.797 3.239 . . . . 0.0 113.798 170.954 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . 146.47 88.96 0.08 OUTLIER Glycine 0 CA--C 1.53 1.002 0 CA-C-O 127.607 3.893 . . . . 0.0 114.813 179.877 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 32' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.33 -0.26 1 O-C-N 116.395 -4.003 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 15' ' ' ACE . . . . . . . . . . . . . . . . . . . . 0 C--O 1.23 0.045 . . . . . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' A' A ' 16' ' ' ASN . . . . . 0.435 ' H ' ' CG ' ' A' ' 18' ' ' HIS 0.514 32.1 p30 41.47 84.81 0.02 OUTLIER 'General case' 0 N--CA 1.47 0.551 1 N-CA-C 128.069 6.322 . . . . 0.0 128.069 . . . . . . . . . 4 3 . 1 . 009 nuclear nobuild full ' A' A ' 17' ' ' TYR . . . . . 0.671 ' HB2' ' HA ' ' A' ' 18' ' ' HIS 0.961 0.0 OUTLIER 61.53 -120.9 0.76 Allowed 'General case' 0 N--CA 1.469 0.518 2 C-N-CA 136.736 6.014 . . . . 0.0 119.613 15.891 . . . . . . . . 5 4 . 1 . 009 nuclear nobuild full ' A' A ' 18' ' ' HIS . . . . . 0.722 ' CD2' ' HB3' ' A' ' 19' ' ' LEU . 0.0 OUTLIER -150.62 112.55 4.54 Favored 'General case' 0 N--CA 1.47 0.531 2 C-N-CA 135.058 5.343 . . . . 0.0 113.759 1.358 . . . . . . . . 4 4 . 1 . 009 nuclear nobuild full ' A' A ' 19' ' ' LEU . . . . . 0.722 ' HB3' ' CD2' ' A' ' 18' ' ' HIS . 1.3 pp -152.83 84.72 1.22 Allowed 'General case' 0 N--CA 1.47 0.536 0 O-C-N 118.206 -2.809 . . . . 0.0 117.319 12.093 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 20' ' ' GLU . . . . . 0.607 ' HG3' ' H ' ' A' ' 21' ' ' ASN . 6.3 pt-20 -76.18 -51.48 12.04 Favored 'General case' 0 N--CA 1.47 0.542 1 CA-C-N 103.367 -6.288 . . . . 0.0 112.589 162.483 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 21' ' ' ASN . . . . . 0.607 ' H ' ' HG3' ' A' ' 20' ' ' GLU . 2.4 t-20 -85.02 65.07 9.05 Favored 'General case' 0 N--CA 1.469 0.518 0 CA-C-N 114.84 -1.073 . . . . 0.0 112.257 168.039 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 22' ' ' GLU . . . . . 0.65 ' HB2' ' HB2' ' A' ' 19' ' ' LEU . 12.1 mm-40 -164.24 -36.81 0.03 OUTLIER 'General case' 0 N--CA 1.47 0.56 1 O-C-N 131.439 5.462 . . . . 0.0 111.384 167.13 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 95.7 t -75.31 -27.23 19.25 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.555 0 CA-C-O 113.395 -3.193 . . . . 0.0 118.952 160.467 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 24' ' ' ALA . . . . . . . . . . . . 0.287 . . -165.7 94.27 0.59 Allowed 'General case' 0 N--CA 1.47 0.534 1 O-C-N 131.329 5.393 . . . . 0.0 103.393 168.781 . . . . . . . . 3 2 . 1 . 009 nuclear nobuild full ' A' A ' 25' ' ' ARG . . . . . 0.498 ' HG3' ' OD1' ' A' ' 21' ' ' ASN 0.797 51.2 mtt85 43.38 -76.02 0.0 OUTLIER 'General case' 0 N--CA 1.47 0.545 2 N-CA-C 130.16 7.096 . . . . 0.0 130.16 -6.319 . . . . . . . . 4 3 . 1 . 009 nuclear nobuild full ' A' A ' 26' ' ' LEU . . . . . . . . . . . . 0.429 68.8 tp -79.94 10.12 4.6 Favored 'General case' 0 N--CA 1.47 0.559 0 O-C-N 118.789 -2.444 . . . . 0.0 110.927 -167.607 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 34.6 tptt -154.22 31.95 0.43 Allowed 'General case' 0 N--CA 1.47 0.56 0 C-N-CA 129.298 3.039 . . . . 0.0 110.866 175.209 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 13.6 mmtt -147.18 33.79 0.89 Allowed 'General case' 0 N--CA 1.47 0.541 0 CA-C-N 110.792 -2.913 . . . . 0.0 116.562 -178.038 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 25.9 tp -155.29 -47.86 0.08 Allowed 'General case' 0 N--CA 1.47 0.547 0 CA-C-N 113.521 -1.672 . . . . 0.0 111.306 -168.019 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 22.2 t -82.97 103.11 9.81 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.538 0 O-C-N 120.236 -1.54 . . . . 0.0 113.916 171.753 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . -83.54 106.39 2.82 Favored Glycine 0 CA--C 1.531 1.041 1 CA-C-O 128.499 4.388 . . . . 0.0 115.106 -158.144 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 32' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.329 -0.288 1 O-C-N 115.808 -4.348 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 15' ' ' ACE . . . . . 0.465 ' H1 ' ' HA ' ' A' ' 16' ' ' ASN . . . . . . . . 0 C--O 1.23 0.042 . . . . . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 16' ' ' ASN . . . . . 0.465 ' HA ' ' H1 ' ' A' ' 15' ' ' ACE 0.455 19.2 t-20 -98.81 -71.07 0.7 Allowed 'General case' 0 N--CA 1.471 0.596 0 N-CA-C 120.976 3.695 . . . . 0.0 120.976 . . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 17' ' ' TYR . . . . . 0.492 ' CE1' ' HB3' ' A' ' 18' ' ' HIS . 0.2 OUTLIER 58.36 135.62 0.01 OUTLIER 'General case' 0 N--CA 1.471 0.579 2 C-N-CA 140.068 7.347 . . . . 0.0 122.267 8.283 . . . . . . . . 4 4 . 1 . 010 nuclear nobuild full ' A' A ' 18' ' ' HIS . . . . . 0.492 ' HB3' ' CE1' ' A' ' 17' ' ' TYR 0.466 0.1 OUTLIER 33.85 -115.36 0.07 Allowed 'General case' 0 N--CA 1.471 0.597 0 O-C-N 128.362 3.539 . . . . 0.0 114.385 169.814 . . . . . . . . 4 4 . 1 . 010 nuclear nobuild full ' A' A ' 19' ' ' LEU . . . . . 0.535 ' HA ' HD12 ' A' ' 19' ' ' LEU . 2.5 tp 50.87 -70.93 0.0 OUTLIER 'General case' 0 N--CA 1.47 0.528 1 CA-C-O 128.603 4.049 . . . . 0.0 111.113 140.009 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 2.6 pp20? -71.4 -47.15 57.86 Favored 'General case' 0 N--CA 1.47 0.531 0 C-N-CA 131.181 3.792 . . . . 0.0 117.779 -176.47 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 21' ' ' ASN . . . . . 0.444 ' O ' ' HG3' ' A' ' 25' ' ' ARG . 0.9 OUTLIER -93.71 -12.41 29.31 Favored 'General case' 0 N--CA 1.471 0.585 0 CA-C-O 113.739 -3.029 . . . . 0.0 114.072 171.918 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 22' ' ' GLU . . . . . 0.448 ' O ' ' HB2' ' A' ' 26' ' ' LEU . 29.8 mm-40 -63.86 -41.51 97.76 Favored 'General case' 0 N--CA 1.47 0.566 0 O-C-N 124.916 1.385 . . . . 0.0 108.165 165.407 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 53.8 t -79.27 59.24 0.14 Allowed 'Isoleucine or valine' 0 N--CA 1.471 0.585 0 O-C-N 119.035 -2.291 . . . . 0.0 115.544 166.183 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . 179.19 -33.48 0.01 OUTLIER 'General case' 0 N--CA 1.47 0.559 1 C-N-CA 134.514 5.125 . . . . 0.0 109.318 179.668 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 25' ' ' ARG . . . . . 0.444 ' HG3' ' O ' ' A' ' 21' ' ' ASN . 27.1 mtp85 -71.03 -75.08 0.13 Allowed 'General case' 0 N--CA 1.469 0.521 0 CA-C-O 117.418 -1.277 . . . . 0.0 113.539 167.178 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 26' ' ' LEU . . . . . 0.48 ' HA ' HD12 ' A' ' 26' ' ' LEU 0.405 1.0 OUTLIER 39.57 -75.28 0.0 OUTLIER 'General case' 0 N--CA 1.471 0.583 1 N-CA-C 126.058 5.577 . . . . 0.0 126.058 153.18 . . . . . . . . 5 4 . 1 . 010 nuclear nobuild full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . 0.265 35.4 tttt -85.47 -15.24 43.54 Favored 'General case' 0 N--CA 1.47 0.548 1 CA-C-N 106.157 -5.02 . . . . 0.0 112.449 -178.059 . . . . . . . . 3 2 . 1 . 010 nuclear nobuild full ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 58.3 mttp -92.11 18.4 8.13 Favored 'General case' 0 N--CA 1.471 0.585 0 O-C-N 119.13 -2.232 . . . . 0.0 114.724 170.259 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 13.0 tp -150.08 -46.88 0.13 Allowed 'General case' 0 N--CA 1.47 0.534 0 CA-C-O 114.467 -2.682 . . . . 0.0 109.576 -173.171 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 30' ' ' VAL . . . . . . . . . . . . 0.438 2.0 t -96.76 -88.27 0.12 Allowed 'Isoleucine or valine' 0 N--CA 1.47 0.533 0 N-CA-C 118.096 2.628 . . . . 0.0 118.096 -172.183 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . -123.54 69.51 0.46 Allowed Glycine 0 CA--C 1.53 1.011 0 O-C-N 127.11 2.756 . . . . 0.0 106.295 179.95 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 32' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.33 -0.268 0 CA-C-N 119.36 1.58 . . . . 0.0 . . . . . . . . . . 0 0 . 1 stop_ save_