data_2cdx_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 2cdx _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 ' 1' ' ' LEU . . . . . 0.47 ' C ' ' H ' ' A' ' 14' ' ' CYS . 3.4 tm? . . . . . 0 N--CA 1.495 1.782 0 CA-C-O 117.023 -1.465 . . . . 2.0 111.804 . . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 54.7 tptt -119.84 -55.31 2.1 Favored 'General case' 0 N--CA 1.514 2.757 0 CA-C-N 121.886 2.13 . . . . 2.0 109.181 179.656 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 3' ' ' CYS . . . . . . . . . . . . 0.312 1.9 m 76.6 -172.87 0.09 Allowed 'General case' 0 CA--C 1.563 1.471 0 N-CA-C 114.38 1.252 . . . . 2.0 114.38 -179.9 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 79.5 m-20 -91.05 152.48 20.63 Favored 'General case' 0 CA--C 1.55 0.955 0 N-CA-C 115.312 1.597 . . . . 2.0 115.312 -179.803 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 18.3 ptpt -90.84 -156.91 0.46 Allowed 'General case' 0 CA--C 1.579 2.087 0 N-CA-C 104.913 -2.254 . . . . 2.0 104.913 179.103 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 3.8 mm? -54.9 -34.0 62.6 Favored 'General case' 0 N--CA 1.512 2.637 0 O-C-N 117.679 -3.138 . . . . 2.0 115.154 179.665 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 7' ' ' ILE . . . . . . . . . . . . . 35.1 mt -75.74 141.43 72.21 Favored Pre-proline 0 CA--C 1.586 2.329 0 C-N-CA 125.312 1.445 . . . . 2.0 112.426 179.871 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 77.4 Cg_exo -55.94 -40.13 86.92 Favored 'Trans proline' 0 CA--C 1.57 2.321 0 C-N-CA 122.836 2.357 . . . . 2.0 117.964 179.596 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 9' ' ' ILE . . . . . . . . . . . . . 10.7 tp -97.75 93.04 3.13 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.726 0 C-N-CA 124.144 0.977 . . . . 2.0 111.083 179.969 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 10' ' ' ALA . . . . . . . . . . . . 0.466 . . -133.71 -166.97 1.86 Allowed 'General case' 0 CA--C 1.583 2.223 0 N-CA-C 114.828 1.418 . . . . 2.0 114.828 179.991 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 11' ' ' SER . . . . . . . . . . . . 0.368 2.0 t -43.66 165.69 0.01 OUTLIER 'General case' 0 CA--C 1.586 2.34 1 N-CA-C 127.027 5.936 . . . . 2.0 127.027 -179.351 . . . . . . . . 3 2 . 1 . 001 nuclear orig core ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 1.6 ttmp? -105.99 -74.96 0.64 Allowed 'General case' 0 CA--C 1.577 2.008 0 N-CA-C 121.475 3.88 . . . . 2.0 121.475 -179.545 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 13' ' ' THR . . . . . . . . . . . . . 14.9 t -135.22 124.32 24.37 Favored 'General case' 0 N--CA 1.506 2.33 0 N-CA-C 121.741 3.978 . . . . 2.0 121.741 -179.374 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 14' ' ' CYS . . . . . 0.539 ' SG ' ' HD2' ' A' ' 18' ' ' LYS . 0.5 OUTLIER -106.5 171.94 4.33 Favored Pre-proline 0 CA--C 1.599 2.863 0 C-N-CA 126.613 1.965 . . . . 2.0 108.938 179.493 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 15' ' ' PRO . . . . . . . . . . . . . 83.5 Cg_exo -49.04 174.63 0.03 OUTLIER 'Trans proline' 0 CA--C 1.57 2.288 1 N-CA-C 124.474 4.759 . . . . 2.0 124.474 -179.722 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . 32.82 -172.87 0.0 OUTLIER 'General case' 0 N--CA 1.5 2.065 1 N-CA-C 123.558 4.651 . . . . 2.0 123.558 179.734 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . -82.59 38.71 2.65 Favored Glycine 0 N--CA 1.502 3.092 0 O-C-N 120.296 -1.503 . . . . 2.0 113.861 179.459 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 18' ' ' LYS . . . . . 0.539 ' HD2' ' SG ' ' A' ' 14' ' ' CYS . 0.1 OUTLIER -82.91 74.63 9.85 Favored 'General case' 0 CA--C 1.566 1.573 0 C-N-CA 125.546 1.538 . . . . 2.0 109.059 179.902 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 7.8 p30 -57.18 -36.65 71.06 Favored 'General case' 0 N--CA 1.487 1.403 1 N-CA-C 122.821 4.378 . . . . 2.0 122.821 -179.626 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 88.2 mt -70.18 122.96 20.48 Favored 'General case' 0 CA--C 1.558 1.251 0 N-CA-C 117.209 2.3 . . . . 2.0 117.209 -179.801 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 21' ' ' CYS . . . . . 0.562 ' SG ' ' O ' ' A' ' 56' ' ' THR . 32.1 m -82.91 95.34 7.94 Favored 'General case' 0 CA--C 1.566 1.565 0 N-CA-C 102.516 -3.142 . . . . 2.0 102.516 179.314 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 22' ' ' TYR . . . . . . . . . . . . 0.442 0.0 OUTLIER -61.57 153.17 28.44 Favored 'General case' 0 CA--C 1.554 1.12 0 N-CA-C 118.018 2.599 . . . . 2.0 118.018 -179.478 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 39.2 ttmt -133.98 76.67 1.67 Allowed 'General case' 0 CA--C 1.563 1.442 0 N-CA-C 103.373 -2.825 . . . . 2.0 103.373 179.584 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 24' ' ' MET . . . . . . . . . . . . 0.262 5.9 ttt -63.17 78.67 0.02 OUTLIER 'General case' 0 CA--C 1.567 1.609 0 C-N-CA 126.037 1.735 . . . . 2.0 113.968 -179.838 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 25' ' ' PHE . . . . . . . . . . . . . 13.9 m-85 -72.35 147.37 46.35 Favored 'General case' 0 N--CA 1.485 1.318 0 N-CA-C 113.784 1.031 . . . . 2.0 113.784 179.976 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 26' ' ' MET . . . . . . . . . . . . . 73.4 mtp -72.04 127.16 31.68 Favored 'General case' 0 N--CA 1.493 1.696 0 O-C-N 121.307 -0.871 . . . . 2.0 108.85 179.51 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 27' ' ' MET . . . . . . . . . . . . . 27.9 ttt -55.76 -36.45 67.32 Favored 'General case' 0 N--CA 1.513 2.708 0 CA-C-N 121.621 2.01 . . . . 2.0 111.717 179.365 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 73.2 m -76.85 -29.6 55.93 Favored 'General case' 0 CA--C 1.585 2.308 0 N-CA-C 114.163 1.172 . . . . 2.0 114.163 179.324 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 8.9 t70 -150.76 81.12 1.34 Allowed 'General case' 0 CA--C 1.57 1.748 0 O-C-N 120.174 -1.579 . . . . 2.0 108.558 179.695 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 1.8 mm? -45.79 -75.98 0.03 OUTLIER 'General case' 0 CA--C 1.575 1.927 0 N-CA-C 120.688 3.588 . . . . 2.0 120.688 -179.507 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 31' ' ' THR . . . . . . . . . . . . 0.259 43.4 p -6.71 -66.87 0.0 OUTLIER 'General case' 0 N--CA 1.506 2.341 1 N-CA-C 122.511 4.263 . . . . 2.0 122.511 -179.735 . . . . . . . . 3 2 . 1 . 001 nuclear orig core ' A' A ' 32' ' ' ILE . . . . . . . . . . . . . 2.0 mp -99.04 106.89 40.96 Favored Pre-proline 0 CA--C 1.584 2.265 0 N-CA-C 102.173 -3.269 . . . . 2.0 102.173 179.726 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 33' ' ' PRO . . . . . . . . . . . . . 21.5 Cg_exo -59.39 166.02 8.34 Favored 'Trans proline' 0 CA--C 1.559 1.753 1 N-CA-C 123.744 4.478 . . . . 2.0 123.744 -179.658 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 34' ' ' VAL . . . . . . . . . . . . . 78.7 t -76.14 -51.67 19.47 Favored 'Isoleucine or valine' 0 CA--C 1.592 2.57 0 N-CA-C 103.125 -2.917 . . . . 2.0 103.125 178.637 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 59.9 mttm -143.43 167.52 21.99 Favored 'General case' 0 CA--C 1.564 1.494 0 CA-C-O 125.574 2.606 . . . . 2.0 108.652 179.451 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 9.1 mtp180 -142.88 119.56 11.13 Favored 'General case' 0 CA--C 1.582 2.191 1 N-CA-C 98.184 -4.747 . . . . 2.0 98.184 179.7 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . -157.8 -134.84 1.8 Allowed Glycine 0 N--CA 1.488 2.107 0 O-C-N 118.942 -2.349 . . . . 2.0 118.891 -179.44 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 38' ' ' CYS . . . . . . . . . . . . . 26.9 p -123.23 138.92 54.52 Favored 'General case' 0 N--CA 1.489 1.51 0 N-CA-C 117.421 2.378 . . . . 2.0 117.421 -179.821 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 39' ' ' ILE . . . . . . . . . . . . . 2.2 tp -164.65 159.01 1.29 Allowed 'Isoleucine or valine' 0 CA--C 1.576 1.959 0 N-CA-C 115.312 1.597 . . . . 2.0 115.312 -179.909 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 40' ' ' ASP . . . . . . . . . . . . . 9.3 p-10 -78.69 -48.14 15.58 Favored 'General case' 0 N--CA 1.506 2.363 0 O-C-N 119.751 -1.843 . . . . 2.0 114.313 179.595 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 91.2 t -135.83 144.02 34.7 Favored 'Isoleucine or valine' 0 CA--C 1.56 1.346 0 N-CA-C 102.972 -2.973 . . . . 2.0 102.972 179.703 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 42' ' ' CYS . . . . . . . . . . . . . 0.8 OUTLIER -58.37 105.49 0.55 Allowed Pre-proline 0 CA--C 1.603 3.01 0 N-CA-C 101.401 -3.555 . . . . 2.0 101.401 179.578 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 43' ' ' PRO . . . . . . . . . . . . . 24.7 Cg_exo -50.18 177.92 0.03 OUTLIER 'Trans proline' 0 C--N 1.372 1.811 1 N-CA-C 125.105 5.002 . . . . 2.0 125.105 -178.571 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 9.7 mtmp? -70.14 92.22 0.74 Allowed 'General case' 0 CA--C 1.566 1.589 0 N-CA-C 105.511 -2.033 . . . . 2.0 105.511 179.534 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 45' ' ' ASN . . . . . . . . . . . . . 2.5 p-10 -60.06 114.05 2.65 Favored 'General case' 0 CA--C 1.567 1.601 0 N-CA-C 116.73 2.122 . . . . 2.0 116.73 -179.402 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 7.8 t -80.09 -178.03 6.33 Favored 'General case' 0 CA--C 1.567 1.608 0 N-CA-C 114.667 1.358 . . . . 2.0 114.667 179.968 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 47' ' ' LEU . . . . . . . . . . . . . 97.4 mt -51.74 -28.34 14.8 Favored 'General case' 0 N--CA 1.505 2.309 0 N-CA-C 115.955 1.835 . . . . 2.0 115.955 179.777 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 79.1 mt -101.84 7.44 41.64 Favored 'General case' 0 CA--C 1.581 2.14 0 N-CA-C 114.518 1.303 . . . . 2.0 114.518 179.735 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 49' ' ' VAL . . . . . . . . . . . . . 13.9 p -148.14 159.67 7.4 Favored 'Isoleucine or valine' 0 N--CA 1.5 2.067 0 CA-C-N 122.195 2.27 . . . . 2.0 117.127 -179.518 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 13.3 tmtt? -155.27 86.65 1.09 Allowed 'General case' 0 CA--C 1.573 1.84 0 N-CA-C 101.625 -3.472 . . . . 2.0 101.625 179.562 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 36.7 m-85 -69.56 127.32 32.58 Favored 'General case' 0 CA--C 1.57 1.735 0 N-CA-C 121.442 3.867 . . . . 2.0 121.442 -179.297 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 52' ' ' VAL . . . . . . . . . . . . 0.323 8.6 t -99.51 162.51 2.98 Favored 'Isoleucine or valine' 0 CA--C 1.586 2.349 0 N-CA-C 102.574 -3.121 . . . . 2.0 102.574 178.881 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 53' ' ' CYS . . . . . . . . . . . . 0.318 1.2 p -166.2 153.47 9.83 Favored 'General case' 0 N--CA 1.495 1.801 0 O-C-N 117.388 -3.32 . . . . 2.0 117.993 -179.046 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 54' ' ' CYS . . . . . . . . . . . . 0.389 23.2 p -151.13 117.61 5.71 Favored 'General case' 0 CA--C 1.583 2.25 0 CA-C-O 122.946 1.355 . . . . 2.0 111.694 179.412 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 9.7 m120 -30.27 -0.8 0.0 OUTLIER 'General case' 0 CA--C 1.582 2.19 1 N-CA-C 129.681 6.919 . . . . 2.0 129.681 -179.596 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 56' ' ' THR . . . . . 0.562 ' O ' ' SG ' ' A' ' 21' ' ' CYS . 7.2 t -143.46 160.85 39.83 Favored 'General case' 0 N--CA 1.515 2.782 0 CA-C-N 125.564 3.802 . . . . 2.0 116.225 -179.747 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 57' ' ' ASP . . . . . . . . . . . . . 44.1 m-20 -46.27 104.07 0.05 OUTLIER 'General case' 0 N--CA 1.503 2.203 0 N-CA-C 118.416 2.747 . . . . 2.0 118.416 -179.783 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 58' ' ' ARG . . . . . . . . . . . . 0.315 27.7 mtm180 82.27 16.8 0.39 Allowed 'General case' 0 N--CA 1.507 2.405 0 C-N-CA 125.481 1.512 . . . . 2.0 115.057 -179.695 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 59' ' ' CYS . . . . . . . . . . . . . 34.0 t -63.84 -26.34 68.57 Favored 'General case' 0 CA--C 1.58 2.11 0 N-CA-C 115.148 1.536 . . . . 2.0 115.148 179.689 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 60' ' ' ASN . . . . . . . . . . . . . 51.2 p30 . . . . . 0 CA--C 1.568 1.652 0 CA-C-O 124.309 2.004 . . . . 2.0 114.975 179.837 . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' A' A ' 1' ' ' LEU . . . . . 0.454 HD22 ' SG ' ' A' ' 3' ' ' CYS . 14.2 tp . . . . . 0 CA--C 1.567 1.597 0 N-CA-C 113.883 1.068 . . . . 2.0 113.883 . . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 27.5 mtpt -89.87 130.33 36.11 Favored 'General case' 0 CA--C 1.571 1.776 0 N-CA-C 106.118 -1.808 . . . . 2.0 106.118 179.399 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 3' ' ' CYS . . . . . 0.454 ' SG ' HD22 ' A' ' 1' ' ' LEU . 90.8 m -131.75 -171.44 2.62 Favored 'General case' 0 N--CA 1.499 2.012 0 O-C-N 119.374 -2.079 . . . . 2.0 113.935 -179.84 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 77.9 m-20 -135.83 118.92 16.46 Favored 'General case' 0 CA--C 1.558 1.262 0 C-N-CA 123.562 0.745 . . . . 2.0 112.789 179.943 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -71.14 177.12 3.96 Favored 'General case' 0 CA--C 1.594 2.65 0 CA-C-N 120.34 1.427 . . . . 2.0 110.438 179.209 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 32.1 mt -48.72 -43.45 37.31 Favored 'General case' 0 N--CA 1.514 2.758 0 N-CA-C 119.394 3.109 . . . . 2.0 119.394 -179.84 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 7' ' ' ILE . . . . . . . . . . . . . 46.4 mm -35.62 139.11 0.39 Allowed Pre-proline 0 CA--C 1.583 2.214 0 N-CA-C 116.636 2.088 . . . . 2.0 116.636 -179.87 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 49.4 Cg_exo -37.39 -51.94 1.56 Allowed 'Trans proline' 0 CA--C 1.565 2.055 0 C-N-CA 123.673 2.916 . . . . 2.0 118.729 -179.961 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 9' ' ' ILE . . . . . . . . . . . . 0.31 17.4 tt -84.63 -71.69 0.41 Allowed 'Isoleucine or valine' 0 N--CA 1.496 1.852 0 N-CA-C 107.745 -1.206 . . . . 2.0 107.745 179.471 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . 58.76 137.55 0.01 OUTLIER 'General case' 0 CA--C 1.574 1.887 0 N-CA-C 119.447 3.128 . . . . 2.0 119.447 179.639 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 38.8 t -147.99 -143.61 0.14 Allowed 'General case' 0 CA--C 1.581 2.158 0 O-C-N 120.32 -1.487 . . . . 2.0 111.644 -179.943 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 12' ' ' LYS . . . . . . . . . . . . 0.369 3.9 ttmt 92.14 174.98 0.02 OUTLIER 'General case' 0 N--CA 1.503 2.188 0 C-N-CA 126.061 1.745 . . . . 2.0 115.172 -179.915 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 13' ' ' THR . . . . . . . . . . . . . 84.9 m -152.66 149.59 28.58 Favored 'General case' 0 N--CA 1.495 1.807 0 N-CA-C 114.007 1.114 . . . . 2.0 114.007 -179.689 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 14' ' ' CYS . . . . . . . . . . . . 0.295 0.1 OUTLIER -134.16 176.97 2.48 Favored Pre-proline 0 CA--C 1.599 2.85 0 C-N-CA 124.545 1.138 . . . . 2.0 109.625 179.398 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 15' ' ' PRO . . . . . . . . . . . . . 88.0 Cg_exo -52.99 172.2 0.2 Allowed 'Trans proline' 0 CA--C 1.572 2.422 1 N-CA-C 126.232 5.435 . . . . 2.0 126.232 -179.64 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -78.56 169.97 17.4 Favored 'General case' 0 N--CA 1.498 1.938 0 N-CA-C 107.965 -1.124 . . . . 2.0 107.965 179.247 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . 83.79 -50.41 4.4 Favored Glycine 1 N--CA 1.519 4.201 0 O-C-N 118.295 -2.753 . . . . 2.0 106.942 -178.953 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 73.9 mmtt -78.76 71.62 5.23 Favored 'General case' 0 CA--C 1.581 2.168 0 N-CA-C 104.259 -2.497 . . . . 2.0 104.259 179.105 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 8.5 p30 -82.15 -21.48 36.56 Favored 'General case' 0 N--CA 1.49 1.571 1 N-CA-C 121.928 4.047 . . . . 2.0 121.928 -179.513 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 86.0 mt -88.16 119.54 28.65 Favored 'General case' 0 CA--C 1.553 1.087 0 N-CA-C 113.298 0.851 . . . . 2.0 113.298 -179.934 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 4.5 m -83.96 100.82 11.28 Favored 'General case' 0 CA--C 1.58 2.131 1 N-CA-C 99.664 -4.198 . . . . 2.0 99.664 179.198 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 22' ' ' TYR . . . . . . . . . . . . . 4.7 p90 -75.45 159.58 31.19 Favored 'General case' 0 CA--C 1.556 1.181 0 N-CA-C 119.505 3.15 . . . . 2.0 119.505 -179.349 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 29.4 ttpt -139.03 98.65 3.58 Favored 'General case' 0 CA--C 1.565 1.556 0 N-CA-C 103.219 -2.882 . . . . 2.0 103.219 179.567 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 24' ' ' MET . . . . . 0.531 ' SD ' ' HB2' ' A' ' 35' ' ' LYS . 13.6 ttm -69.73 74.93 0.43 Allowed 'General case' 0 CA--C 1.57 1.737 0 N-CA-C 114.805 1.409 . . . . 2.0 114.805 -179.76 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 25' ' ' PHE . . . . . . . . . . . . . 4.5 m-30 -62.48 128.09 34.36 Favored 'General case' 0 N--CA 1.497 1.917 0 O-C-N 120.431 -1.418 . . . . 2.0 112.121 179.821 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 26' ' ' MET . . . . . . . . . . . . . 76.5 mtp -57.31 129.32 41.25 Favored 'General case' 0 N--CA 1.497 1.886 0 N-CA-C 114.305 1.224 . . . . 2.0 114.305 179.895 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 27' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -59.09 -39.42 82.12 Favored 'General case' 0 N--CA 1.512 2.644 0 CA-C-N 120.985 1.72 . . . . 2.0 110.742 179.381 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 48.9 m -68.75 -34.35 75.44 Favored 'General case' 0 CA--C 1.584 2.281 0 N-CA-C 113.647 0.981 . . . . 2.0 113.647 179.368 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 8.9 t70 -155.47 84.49 1.05 Allowed 'General case' 0 CA--C 1.572 1.794 0 O-C-N 120.631 -1.293 . . . . 2.0 109.343 179.671 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 2.3 mm? -44.43 -41.51 6.3 Favored 'General case' 0 CA--C 1.574 1.887 0 N-CA-C 120.76 3.615 . . . . 2.0 120.76 -179.776 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 31' ' ' THR . . . . . . . . . . . . . 43.3 p -41.06 -54.82 2.73 Favored 'General case' 0 N--CA 1.502 2.138 0 N-CA-C 119.587 3.18 . . . . 2.0 119.587 -179.784 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 32' ' ' ILE . . . . . . . . . . . . . 2.1 mp -96.61 114.63 64.81 Favored Pre-proline 0 CA--C 1.586 2.34 0 N-CA-C 106.7 -1.593 . . . . 2.0 106.7 179.914 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 33' ' ' PRO . . . . . . . . . . . . . 13.3 Cg_exo -70.29 151.0 65.84 Favored 'Trans proline' 0 CA--C 1.572 2.422 0 N-CA-C 119.261 2.754 . . . . 2.0 119.261 -179.871 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 34' ' ' VAL . . . . . . . . . . . . . 60.9 t -79.14 -38.75 20.63 Favored 'Isoleucine or valine' 0 N--CA 1.509 2.489 0 C-N-CA 124.397 1.079 . . . . 2.0 111.119 179.445 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 35' ' ' LYS . . . . . 0.531 ' HB2' ' SD ' ' A' ' 24' ' ' MET . 18.1 tptt -147.93 170.32 17.95 Favored 'General case' 0 CA--C 1.559 1.295 0 CA-C-O 123.986 1.85 . . . . 2.0 110.151 179.817 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 36' ' ' ARG . . . . . . . . . . . . 0.269 7.2 ttp180 -148.21 114.27 5.81 Favored 'General case' 0 CA--C 1.575 1.939 0 N-CA-C 101.423 -3.547 . . . . 2.0 101.423 -179.906 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . -145.65 -148.99 4.91 Favored Glycine 0 N--CA 1.496 2.694 0 N-CA-C 119.793 2.677 . . . . 2.0 119.793 -179.561 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 38' ' ' CYS . . . . . . . . . . . . . 13.6 p -126.42 137.27 53.4 Favored 'General case' 0 CA--C 1.571 1.752 0 C-N-CA 123.89 0.876 . . . . 2.0 112.064 179.933 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 39' ' ' ILE . . . . . . . . . . . . . 10.5 tp -165.03 165.77 0.55 Allowed 'Isoleucine or valine' 0 N--CA 1.509 2.494 0 O-C-N 120.595 -1.316 . . . . 2.0 113.997 -179.703 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 40' ' ' ASP . . . . . . . . . . . . . 7.9 p-10 -79.31 -46.95 16.7 Favored 'General case' 0 N--CA 1.505 2.29 0 O-C-N 119.283 -2.136 . . . . 2.0 114.471 179.493 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 80.5 t -130.75 152.03 36.87 Favored 'Isoleucine or valine' 0 CA--C 1.576 1.965 0 C-N-CA 127.134 2.174 . . . . 2.0 105.275 179.644 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 42' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -52.59 111.01 2.23 Favored Pre-proline 0 N--CA 1.526 3.332 0 N-CA-C 102.745 -3.057 . . . . 2.0 102.745 179.359 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 43' ' ' PRO . . . . . . . . . . . . 0.548 71.7 Cg_exo -11.94 -109.4 0.0 OUTLIER 'Trans proline' 0 C--N 1.378 2.079 2 C-N-CA 125.799 4.332 . . . . 2.0 123.02 -178.408 . . . . . . . . 3 2 . 1 . 002 nuclear orig core ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 6.0 mtmp? -159.8 95.28 1.18 Allowed 'General case' 0 CA--C 1.556 1.183 1 N-CA-C 96.68 -5.304 . . . . 2.0 96.68 179.691 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 45' ' ' ASN . . . . . . . . . . . . . 2.8 p-10 -62.66 97.47 0.1 Allowed 'General case' 0 CA--C 1.575 1.912 0 N-CA-C 116.404 2.001 . . . . 2.0 116.404 -179.522 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 13.7 t -79.64 -179.18 6.74 Favored 'General case' 0 CA--C 1.567 1.615 0 N-CA-C 114.35 1.241 . . . . 2.0 114.35 179.981 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 47' ' ' LEU . . . . . . . . . . . . 0.385 1.3 pp -54.52 -15.66 1.88 Allowed 'General case' 0 N--CA 1.509 2.521 0 N-CA-C 117.938 2.57 . . . . 2.0 117.938 179.819 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 84.5 mt -104.29 3.49 32.64 Favored 'General case' 0 CA--C 1.59 2.501 0 C-N-CA 125.463 1.505 . . . . 2.0 111.471 179.133 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 49' ' ' VAL . . . . . . . . . . . . . 6.7 p -157.7 156.09 4.43 Favored 'Isoleucine or valine' 0 CA--C 1.579 2.082 0 N-CA-C 118.439 2.755 . . . . 2.0 118.439 -179.584 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -145.81 72.37 1.3 Allowed 'General case' 0 CA--C 1.584 2.258 0 N-CA-C 103.143 -2.91 . . . . 2.0 103.143 179.097 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 97.2 m-85 -44.88 133.72 6.09 Favored 'General case' 0 CA--C 1.574 1.896 0 N-CA-C 120.402 3.482 . . . . 2.0 120.402 -179.498 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 52' ' ' VAL . . . . . . . . . . . . . 40.6 t -115.9 103.02 14.55 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.897 0 N-CA-C 103.081 -2.933 . . . . 2.0 103.081 179.726 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 53' ' ' CYS . . . . . . . . . . . . 0.255 4.2 m -121.11 153.65 37.19 Favored 'General case' 0 CA--C 1.569 1.695 0 N-CA-C 117.881 2.548 . . . . 2.0 117.881 -179.6 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 54' ' ' CYS . . . . . . . . . . . . 0.351 8.6 p -141.73 127.69 19.46 Favored 'General case' 0 CA--C 1.577 2.019 0 CA-C-O 122.427 1.108 . . . . 2.0 111.065 179.703 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 4.7 p-10 -53.15 36.24 0.0 OUTLIER 'General case' 0 N--CA 1.5 2.062 1 N-CA-C 125.8 5.481 . . . . 2.0 125.8 -179.56 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 56' ' ' THR . . . . . . . . . . . . 0.253 7.2 t -153.8 170.88 19.9 Favored 'General case' 0 N--CA 1.499 2.022 0 O-C-N 119.443 -2.035 . . . . 2.0 114.424 179.968 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 57' ' ' ASP . . . . . . . . . . . . . 73.3 m-20 -60.98 117.96 6.13 Favored 'General case' 0 CA--C 1.563 1.444 0 N-CA-C 114.487 1.291 . . . . 2.0 114.487 -179.807 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 58' ' ' ARG . . . . . . . . . . . . . 78.0 mtt85 64.09 20.51 12.22 Favored 'General case' 0 N--CA 1.5 2.075 0 N-CA-C 116.222 1.934 . . . . 2.0 116.222 -179.834 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 59' ' ' CYS . . . . . . . . . . . . . 49.3 t -62.84 -28.82 70.28 Favored 'General case' 0 CA--C 1.575 1.94 0 N-CA-C 116.7 2.111 . . . . 2.0 116.7 179.912 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 60' ' ' ASN . . . . . . . . . . . . . 41.3 p-10 . . . . . 0 CA--C 1.572 1.793 0 CA-C-O 124.252 1.977 . . . . 2.0 115.46 179.846 . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' A' A ' 1' ' ' LEU . . . . . 0.533 HD11 ' SG ' ' A' ' 3' ' ' CYS . 0.5 OUTLIER . . . . . 0 CA--C 1.579 2.058 0 CA-C-O 123.065 1.412 . . . . 2.0 112.51 . . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 53.9 mttp -145.2 111.28 5.56 Favored 'General case' 0 CA--C 1.566 1.559 0 N-CA-C 100.801 -3.777 . . . . 2.0 100.801 179.427 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 3' ' ' CYS . . . . . 0.533 ' SG ' HD11 ' A' ' 1' ' ' LEU . 90.7 m -133.02 156.85 46.6 Favored 'General case' 0 N--CA 1.491 1.588 0 O-C-N 120.335 -1.478 . . . . 2.0 113.909 -179.722 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 29.6 m-20 -105.63 117.18 33.35 Favored 'General case' 0 N--CA 1.487 1.415 0 N-CA-C 114.259 1.207 . . . . 2.0 114.259 -179.768 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 5' ' ' LYS . . . . . . . . . . . . 0.301 1.1 pttt -64.63 -179.9 0.55 Allowed 'General case' 0 CA--C 1.58 2.133 0 O-C-N 120.518 -1.364 . . . . 2.0 112.686 179.634 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -41.75 -43.82 3.03 Favored 'General case' 0 N--CA 1.502 2.171 1 N-CA-C 121.94 4.052 . . . . 2.0 121.94 -179.691 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 7' ' ' ILE . . . . . . . . . . . . . 35.8 mt -55.39 142.15 60.67 Favored Pre-proline 0 CA--C 1.588 2.416 0 CA-C-O 116.882 -1.532 . . . . 2.0 113.227 179.878 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 65.3 Cg_exo -35.54 -54.04 0.77 Allowed 'Trans proline' 0 CA--C 1.57 2.321 0 C-N-CA 123.914 3.076 . . . . 2.0 118.78 179.977 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 9' ' ' ILE . . . . . . . . . . . . . 1.6 pp -126.44 75.27 0.51 Allowed 'Isoleucine or valine' 0 CA--C 1.575 1.924 0 N-CA-C 107.253 -1.388 . . . . 2.0 107.253 179.658 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -80.23 -163.32 0.54 Allowed 'General case' 0 CA--C 1.579 2.087 0 N-CA-C 119.19 3.033 . . . . 2.0 119.19 -179.749 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 8.8 t -57.12 -178.94 0.03 OUTLIER 'General case' 0 CA--C 1.582 2.201 0 N-CA-C 118.091 2.626 . . . . 2.0 118.091 -179.845 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 12' ' ' LYS . . . . . . . . . . . . 0.25 37.1 ttpt -120.97 -93.5 0.52 Allowed 'General case' 0 CA--C 1.578 2.021 0 N-CA-C 118.324 2.712 . . . . 2.0 118.324 -179.64 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 13' ' ' THR . . . . . . . . . . . . . 32.6 m -46.59 134.56 9.36 Favored 'General case' 0 N--CA 1.501 2.087 0 N-CA-C 120.259 3.429 . . . . 2.0 120.259 -179.454 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 3.9 t -149.47 154.57 38.51 Favored Pre-proline 0 CA--C 1.598 2.823 0 C-N-CA 124.616 1.166 . . . . 2.0 111.174 -179.932 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 15' ' ' PRO . . . . . . . . . . . . . 58.4 Cg_exo -43.25 157.63 0.1 Allowed 'Trans proline' 0 CA--C 1.575 2.535 1 N-CA-C 126.659 5.6 . . . . 2.0 126.659 -179.66 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -79.76 168.92 18.68 Favored 'General case' 0 N--CA 1.499 1.981 0 C-N-CA 124.87 1.268 . . . . 2.0 111.385 179.642 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . 83.75 -51.59 4.59 Favored Glycine 1 N--CA 1.519 4.197 0 O-C-N 119.381 -2.074 . . . . 2.0 108.215 -179.049 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 21.1 mmtm -71.87 101.44 2.64 Favored 'General case' 0 CA--C 1.572 1.803 0 C-N-CA 129.048 2.939 . . . . 2.0 106.764 179.386 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 19' ' ' ASN . . . . . . . . . . . . 0.34 0.2 OUTLIER -106.94 -8.11 16.76 Favored 'General case' 0 N--CA 1.499 2.012 0 N-CA-C 117.406 2.372 . . . . 2.0 117.406 179.862 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 89.0 mt -100.2 113.97 27.04 Favored 'General case' 0 CA--C 1.563 1.471 0 C-N-CA 126.141 1.776 . . . . 2.0 109.593 179.605 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 1.3 m -80.23 101.05 8.63 Favored 'General case' 0 CA--C 1.577 1.996 0 N-CA-C 101.457 -3.535 . . . . 2.0 101.457 179.226 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 22' ' ' TYR . . . . . . . . . . . . 0.37 13.2 p90 -75.91 160.29 30.06 Favored 'General case' 0 N--CA 1.484 1.23 0 N-CA-C 119.145 3.016 . . . . 2.0 119.145 -179.509 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 60.2 tttt -135.98 87.31 2.3 Favored 'General case' 0 CA--C 1.565 1.527 0 N-CA-C 103.125 -2.917 . . . . 2.0 103.125 179.846 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 24' ' ' MET . . . . . 0.496 ' HB3' ' H ' ' A' ' 35' ' ' LYS . 24.2 ttt -61.89 76.75 0.02 OUTLIER 'General case' 0 N--CA 1.492 1.659 0 N-CA-C 118.242 2.682 . . . . 2.0 118.242 -179.58 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 25' ' ' PHE . . . . . . . . . . . . . 12.5 m-30 -69.53 128.0 34.96 Favored 'General case' 0 CA--C 1.568 1.656 0 O-C-N 120.598 -1.313 . . . . 2.0 112.328 179.839 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 26' ' ' MET . . . . . . . . . . . . . 32.2 mtm -64.16 132.02 49.17 Favored 'General case' 0 N--CA 1.501 2.087 0 O-C-N 120.308 -1.495 . . . . 2.0 108.524 179.619 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 27' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -53.48 -31.12 44.45 Favored 'General case' 0 N--CA 1.511 2.58 0 CA-C-N 121.772 2.078 . . . . 2.0 114.045 179.775 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 50.3 m -83.73 -39.77 19.7 Favored 'General case' 0 CA--C 1.587 2.371 0 C-N-CA 124.634 1.174 . . . . 2.0 112.004 179.218 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 38.6 t70 -131.66 88.32 2.56 Favored 'General case' 0 CA--C 1.572 1.789 0 N-CA-C 107.08 -1.452 . . . . 2.0 107.08 179.773 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 2.2 mm? -60.57 -82.66 0.02 OUTLIER 'General case' 0 CA--C 1.578 2.022 0 N-CA-C 121.078 3.733 . . . . 2.0 121.078 -179.413 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 31' ' ' THR . . . . . . . . . . . . 0.344 13.9 t -19.13 -52.22 0.01 OUTLIER 'General case' 0 N--CA 1.51 2.543 1 N-CA-C 123.257 4.54 . . . . 2.0 123.257 -179.643 . . . . . . . . 3 2 . 1 . 003 nuclear orig core ' A' A ' 32' ' ' ILE . . . . . . . . . . . . . 1.7 mp -97.28 105.93 28.5 Favored Pre-proline 0 CA--C 1.59 2.518 1 N-CA-C 99.314 -4.328 . . . . 2.0 99.314 179.432 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 33' ' ' PRO . . . . . . . . . . . . . 5.5 Cg_endo -73.14 178.23 6.81 Favored 'Trans proline' 0 CA--C 1.568 2.19 0 N-CA-C 120.323 3.163 . . . . 2.0 120.323 -179.446 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 34' ' ' VAL . . . . . . . . . . . . . 56.0 t -85.79 -63.05 1.33 Allowed 'Isoleucine or valine' 0 CA--C 1.585 2.292 0 N-CA-C 106.865 -1.531 . . . . 2.0 106.865 179.309 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 35' ' ' LYS . . . . . 0.496 ' H ' ' HB3' ' A' ' 24' ' ' MET . 38.9 ttmt -139.34 113.62 8.92 Favored 'General case' 0 CA--C 1.558 1.281 0 C-N-CA 124.419 1.088 . . . . 2.0 113.609 -179.9 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 36' ' ' ARG . . . . . . . . . . . . 0.345 51.8 ttp180 -85.69 73.27 10.45 Favored 'General case' 0 CA--C 1.59 2.485 0 O-C-N 120.257 -1.527 . . . . 2.0 110.319 179.971 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . -98.44 -145.84 19.48 Favored Glycine 0 N--CA 1.501 2.976 1 N-CA-C 123.535 4.174 . . . . 2.0 123.535 -179.507 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 38' ' ' CYS . . . . . . . . . . . . . 14.6 p -126.64 132.99 51.1 Favored 'General case' 0 N--CA 1.498 1.955 0 N-CA-C 114.887 1.44 . . . . 2.0 114.887 179.921 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 39' ' ' ILE . . . . . 0.518 HG13 ' H ' ' A' ' 40' ' ' ASP . 6.2 tp -152.81 -174.8 0.18 Allowed 'Isoleucine or valine' 0 N--CA 1.502 2.174 0 C-N-CA 124.7 1.2 . . . . 2.0 111.598 -179.93 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 40' ' ' ASP . . . . . 0.518 ' H ' HG13 ' A' ' 39' ' ' ILE . 4.0 p30 -119.55 -25.94 5.87 Favored 'General case' 0 N--CA 1.5 2.046 0 O-C-N 119.339 -2.101 . . . . 2.0 113.075 179.212 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 54.9 t -137.14 16.53 0.84 Allowed 'Isoleucine or valine' 0 N--CA 1.504 2.235 0 CA-C-N 120.546 1.521 . . . . 2.0 113.001 179.853 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 42' ' ' CYS . . . . . . . . . . . . 0.314 3.1 m 81.59 111.91 0.03 OUTLIER Pre-proline 0 CA--C 1.61 3.271 1 N-CA-C 95.454 -5.758 . . . . 2.0 95.454 -178.972 . . . . . . . . 3 2 . 1 . 003 nuclear orig core ' A' A ' 43' ' ' PRO . . . . . . . . . . . . 0.498 41.5 Cg_exo -22.03 -75.27 0.02 OUTLIER 'Trans proline' 0 C--N 1.376 1.998 1 N-CA-C 125.061 4.985 . . . . 2.0 125.061 -178.635 . . . . . . . . 3 2 . 1 . 003 nuclear orig core ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 3.4 mtpp -179.74 101.64 0.03 OUTLIER 'General case' 0 CA--C 1.564 1.489 1 N-CA-C 99.881 -4.118 . . . . 2.0 99.881 179.832 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 45' ' ' ASN . . . . . . . . . . . . . 2.5 p-10 -73.82 139.69 45.29 Favored 'General case' 0 N--CA 1.492 1.661 0 O-C-N 120.268 -1.52 . . . . 2.0 114.573 -179.811 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 12.3 t -148.34 -173.48 4.33 Favored 'General case' 0 N--CA 1.49 1.551 0 N-CA-C 112.896 0.702 . . . . 2.0 112.896 179.936 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 47' ' ' LEU . . . . . . . . . . . . . 2.6 pp -57.76 -15.34 7.78 Favored 'General case' 0 N--CA 1.508 2.439 0 N-CA-C 116.578 2.066 . . . . 2.0 116.578 179.572 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 10.0 tp -96.78 -27.0 14.93 Favored 'General case' 0 CA--C 1.579 2.064 0 C-N-CA 126.513 1.925 . . . . 2.0 112.049 179.374 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 49' ' ' VAL . . . . . . . . . . . . . 10.9 p -154.15 146.9 13.87 Favored 'Isoleucine or valine' 0 CA--C 1.579 2.059 0 N-CA-C 119.021 2.971 . . . . 2.0 119.021 -179.522 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 18.9 ttpt -132.18 120.64 22.52 Favored 'General case' 0 CA--C 1.572 1.819 0 N-CA-C 101.7 -3.444 . . . . 2.0 101.7 179.526 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -103.05 135.27 45.04 Favored 'General case' 0 N--CA 1.506 2.34 0 O-C-N 118.393 -2.692 . . . . 2.0 117.635 -179.293 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 52' ' ' VAL . . . . . . . . . . . . . 25.4 t -102.22 97.39 5.59 Favored 'Isoleucine or valine' 0 CA--C 1.575 1.91 0 N-CA-C 104.012 -2.588 . . . . 2.0 104.012 179.588 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 53' ' ' CYS . . . . . . . . . . . . . 0.8 OUTLIER -100.22 132.56 45.51 Favored 'General case' 0 CA--C 1.576 1.966 0 N-CA-C 119.975 3.324 . . . . 2.0 119.975 -179.331 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 54' ' ' CYS . . . . . . . . . . . . . 51.4 t -117.14 124.76 49.97 Favored 'General case' 0 N--CA 1.495 1.82 0 C-N-CA 124.401 1.081 . . . . 2.0 110.305 179.909 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 2.6 t30 -67.54 49.03 0.05 OUTLIER 'General case' 0 N--CA 1.503 2.204 1 N-CA-C 124.22 4.896 . . . . 2.0 124.22 -179.368 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 56' ' ' THR . . . . . . . . . . . . 0.332 5.9 t -163.17 171.12 16.77 Favored 'General case' 0 N--CA 1.503 2.208 0 O-C-N 119.673 -1.892 . . . . 2.0 113.346 179.663 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 57' ' ' ASP . . . . . . . . . . . . . 20.0 m-20 -70.32 107.47 3.78 Favored 'General case' 0 CA--C 1.57 1.722 0 N-CA-C 115.661 1.726 . . . . 2.0 115.661 -179.8 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 58' ' ' ARG . . . . . . . . . . . . 0.278 74.7 mtm180 78.2 13.14 1.61 Allowed 'General case' 0 N--CA 1.502 2.162 0 N-CA-C 116.52 2.044 . . . . 2.0 116.52 179.833 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 59' ' ' CYS . . . . . . . . . . . . . 44.3 t -69.33 -10.79 59.51 Favored 'General case' 0 CA--C 1.577 2.019 0 N-CA-C 117.253 2.316 . . . . 2.0 117.253 179.742 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 60' ' ' ASN . . . . . . . . . . . . . 45.4 p30 . . . . . 0 CA--C 1.561 1.403 0 CA-C-O 125.537 2.589 . . . . 2.0 113.737 179.953 . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' A' A ' 1' ' ' LEU . . . . . . . . . . . . 0.313 0.3 OUTLIER . . . . . 0 CA--C 1.57 1.734 0 N-CA-C 113.798 1.036 . . . . 2.0 113.798 . . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 4.1 mmmm -69.09 130.24 42.17 Favored 'General case' 0 N--CA 1.494 1.748 0 O-C-N 120.736 -1.227 . . . . 2.0 110.626 179.833 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 70.7 m -135.1 -169.95 2.48 Favored 'General case' 0 CA--C 1.572 1.792 0 O-C-N 120.493 -1.379 . . . . 2.0 114.364 -179.855 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER -129.8 132.9 46.66 Favored 'General case' 0 N--CA 1.49 1.567 0 C-N-CA 124.98 1.312 . . . . 2.0 110.23 179.909 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 11.9 ptmt -83.84 172.57 12.02 Favored 'General case' 0 CA--C 1.591 2.534 0 CA-C-N 120.183 1.356 . . . . 2.0 107.671 179.088 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 52.1 mt -42.49 -43.69 3.78 Favored 'General case' 0 N--CA 1.514 2.726 0 N-CA-C 119.336 3.087 . . . . 2.0 119.336 -179.758 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 7' ' ' ILE . . . . . . . . . . . . . 43.8 mm -48.02 131.44 12.09 Favored Pre-proline 0 CA--C 1.583 2.213 0 CA-C-O 115.975 -1.964 . . . . 2.0 112.088 179.968 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 8' ' ' PRO . . . . . . . . . . . . 0.323 13.9 Cg_exo -16.01 -68.75 0.01 OUTLIER 'Trans proline' 0 CA--C 1.563 1.965 0 C-N-CA 124.758 3.639 . . . . 2.0 121.547 -179.751 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 9' ' ' ILE . . . . . . . . . . . . 0.298 15.1 tt -88.18 -72.01 0.46 Allowed 'Isoleucine or valine' 0 CA--C 1.573 1.862 0 CA-C-O 118.824 -0.608 . . . . 2.0 109.517 179.72 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . 52.77 152.02 0.0 OUTLIER 'General case' 0 CA--C 1.576 1.949 1 N-CA-C 121.972 4.064 . . . . 2.0 121.972 179.711 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 20.2 t -148.46 135.27 19.92 Favored 'General case' 0 N--CA 1.492 1.64 0 O-C-N 120.469 -1.394 . . . . 2.0 114.133 -179.97 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 78.1 tttt -135.75 135.16 39.74 Favored 'General case' 0 N--CA 1.493 1.709 0 C-N-CA 125.201 1.4 . . . . 2.0 107.759 179.782 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 13' ' ' THR . . . . . . . . . . . . . 14.3 t -117.12 104.4 11.19 Favored 'General case' 0 N--CA 1.504 2.235 0 CA-C-N 120.845 1.657 . . . . 2.0 111.108 179.962 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 14' ' ' CYS . . . . . . . . . . . . 0.294 0.0 OUTLIER -123.64 168.24 13.02 Favored Pre-proline 0 CA--C 1.588 2.435 0 O-C-N 121.077 -1.014 . . . . 2.0 113.376 179.925 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 15' ' ' PRO . . . . . . . . . . . . . 53.5 Cg_exo -62.78 166.99 12.65 Favored 'Trans proline' 0 N--CA 1.505 2.152 1 N-CA-C 124.989 4.957 . . . . 2.0 124.989 -179.631 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -69.45 173.69 5.65 Favored 'General case' 0 N--CA 1.498 1.958 0 C-N-CA 123.661 0.784 . . . . 2.0 109.14 179.382 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . 84.55 -52.58 4.72 Favored Glycine 0 N--CA 1.516 3.978 0 O-C-N 118.36 -2.712 . . . . 2.0 106.669 -178.963 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 39.4 mmtt -78.74 61.01 2.92 Favored 'General case' 0 CA--C 1.598 2.79 0 N-CA-C 105.224 -2.139 . . . . 2.0 105.224 179.08 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 7.4 p30 -60.96 -41.92 97.27 Favored 'General case' 0 N--CA 1.481 1.123 0 N-CA-C 119.627 3.195 . . . . 2.0 119.627 -179.582 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 97.4 mt -71.93 112.24 7.86 Favored 'General case' 0 CA--C 1.554 1.113 0 N-CA-C 115.44 1.644 . . . . 2.0 115.44 -179.87 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 1.4 m -82.62 97.85 8.71 Favored 'General case' 0 CA--C 1.577 1.994 0 N-CA-C 100.323 -3.954 . . . . 2.0 100.323 179.255 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 22' ' ' TYR . . . . . . . . . . . . 0.381 1.2 p90 -64.87 161.12 18.97 Favored 'General case' 0 CA--C 1.562 1.43 0 N-CA-C 120.65 3.574 . . . . 2.0 120.65 -179.347 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 7.3 tppt? -138.3 98.32 3.58 Favored 'General case' 0 CA--C 1.568 1.665 0 N-CA-C 102.546 -3.131 . . . . 2.0 102.546 179.86 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 24' ' ' MET . . . . . . . . . . . . . 10.0 ttt -72.59 85.86 1.18 Allowed 'General case' 0 CA--C 1.565 1.525 0 O-C-N 120.498 -1.377 . . . . 2.0 112.17 -179.892 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 25' ' ' PHE . . . . . . . . . . . . . 2.4 m-30 -76.91 117.68 18.75 Favored 'General case' 0 CA--C 1.569 1.69 0 N-CA-C 106.675 -1.602 . . . . 2.0 106.675 179.632 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 26' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -56.52 129.05 39.17 Favored 'General case' 0 N--CA 1.497 1.912 0 O-C-N 121.047 -1.033 . . . . 2.0 113.668 -179.781 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 27' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -42.83 -44.01 4.28 Favored 'General case' 0 N--CA 1.506 2.331 0 N-CA-C 117.326 2.343 . . . . 2.0 117.326 -179.787 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 53.1 m -76.13 -42.29 47.35 Favored 'General case' 0 CA--C 1.581 2.161 0 N-CA-C 113.287 0.847 . . . . 2.0 113.287 179.566 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 64.4 t0 -133.34 96.28 3.69 Favored 'General case' 0 CA--C 1.568 1.663 0 N-CA-C 105.705 -1.961 . . . . 2.0 105.705 179.712 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 2.8 mm? -64.95 -63.41 1.12 Allowed 'General case' 0 CA--C 1.568 1.669 0 N-CA-C 118.602 2.815 . . . . 2.0 118.602 -179.601 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 31' ' ' THR . . . . . . . . . . . . . 81.3 p -33.41 -46.68 0.19 Allowed 'General case' 0 N--CA 1.508 2.44 0 N-CA-C 120.426 3.491 . . . . 2.0 120.426 -179.673 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 32' ' ' ILE . . . . . . . . . . . . . 2.2 mp -87.39 111.35 40.8 Favored Pre-proline 0 CA--C 1.589 2.444 0 N-CA-C 103.756 -2.683 . . . . 2.0 103.756 179.649 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 33' ' ' PRO . . . . . . . . . . . . . 6.1 Cg_exo -71.42 144.68 46.06 Favored 'Trans proline' 0 CA--C 1.565 2.06 0 N-CA-C 118.214 2.351 . . . . 2.0 118.214 -179.764 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 34' ' ' VAL . . . . . . . . . . . . 0.314 14.3 m -98.0 -14.65 7.69 Favored 'Isoleucine or valine' 0 N--CA 1.508 2.459 0 N-CA-C 113.762 1.023 . . . . 2.0 113.762 179.456 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . 0.276 3.1 tmtt? -161.93 155.45 21.14 Favored 'General case' 0 CA--C 1.568 1.658 0 C-N-CA 126.332 1.853 . . . . 2.0 108.623 179.472 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 36' ' ' ARG . . . . . . . . . . . . 0.305 13.1 ttp180 -140.64 105.52 4.95 Favored 'General case' 0 CA--C 1.581 2.154 0 N-CA-C 103.024 -2.954 . . . . 2.0 103.024 -180.0 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . -134.14 -139.96 4.22 Favored Glycine 0 N--CA 1.502 3.066 0 N-CA-C 121.622 3.409 . . . . 2.0 121.622 -179.502 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 38' ' ' CYS . . . . . . . . . . . . . 0.8 OUTLIER -135.24 142.4 45.96 Favored 'General case' 0 N--CA 1.498 1.967 0 N-CA-C 113.645 0.98 . . . . 2.0 113.645 -179.971 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 39' ' ' ILE . . . . . 0.404 HG23 ' HD3' ' A' ' 43' ' ' PRO . 8.2 tp -166.57 171.36 0.21 Allowed 'Isoleucine or valine' 0 N--CA 1.507 2.4 0 O-C-N 120.777 -1.202 . . . . 2.0 114.085 -179.623 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 40' ' ' ASP . . . . . . . . . . . . . 20.6 m-20 -87.46 -52.67 5.23 Favored 'General case' 0 CA--C 1.577 1.992 0 O-C-N 120.131 -1.606 . . . . 2.0 112.163 179.364 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 95.7 t -132.8 39.58 0.7 Allowed 'Isoleucine or valine' 0 N--CA 1.51 2.537 0 N-CA-C 114.131 1.16 . . . . 2.0 114.131 -179.624 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 42' ' ' CYS . . . . . . . . . . . . 0.257 2.5 m 73.28 114.89 0.03 OUTLIER Pre-proline 0 N--CA 1.515 2.818 0 N-CA-C 103.278 -2.86 . . . . 2.0 103.278 -179.579 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 43' ' ' PRO . . . . . 0.404 ' HD3' HG23 ' A' ' 39' ' ' ILE . 12.7 Cg_exo -58.7 170.58 2.5 Favored 'Trans proline' 0 C--N 1.373 1.844 0 CA-C-N 127.039 3.549 . . . . 2.0 118.796 -179.318 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 56.4 mtmt -64.45 99.11 0.28 Allowed 'General case' 0 CA--C 1.574 1.887 0 CA-C-O 123.558 1.647 . . . . 2.0 108.023 179.719 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 45' ' ' ASN . . . . . . . . . . . . 0.276 4.0 p-10 -71.89 -157.87 0.04 OUTLIER 'General case' 0 CA--C 1.569 1.702 0 N-CA-C 118.215 2.672 . . . . 2.0 118.215 -179.555 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 46' ' ' SER . . . . . . . . . . . . 0.315 6.3 t 78.11 -43.46 0.38 Allowed 'General case' 0 N--CA 1.489 1.48 0 N-CA-C 117.519 2.414 . . . . 2.0 117.519 179.945 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 47' ' ' LEU . . . . . . . . . . . . . 2.6 pp -47.6 -49.83 25.84 Favored 'General case' 0 N--CA 1.507 2.417 0 CA-C-N 120.348 1.431 . . . . 2.0 113.264 179.643 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 90.3 mt -156.34 25.68 0.35 Allowed 'General case' 0 CA--C 1.586 2.335 0 C-N-CA 126.947 2.099 . . . . 2.0 109.031 179.434 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 49' ' ' VAL . . . . . . . . . . . . . 3.7 p -168.07 171.24 0.18 Allowed 'Isoleucine or valine' 0 CA--C 1.587 2.38 0 N-CA-C 119.425 3.12 . . . . 2.0 119.425 -178.902 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 23.1 ttpt -151.62 75.1 1.15 Allowed 'General case' 0 CA--C 1.583 2.245 0 N-CA-C 101.501 -3.518 . . . . 2.0 101.501 178.954 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 99.0 m-85 -51.37 131.85 28.9 Favored 'General case' 0 CA--C 1.565 1.531 1 N-CA-C 123.17 4.507 . . . . 2.0 123.17 -179.241 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 52' ' ' VAL . . . . . . . . . . . . . 7.0 t -100.46 139.92 20.72 Favored 'Isoleucine or valine' 0 CA--C 1.577 2.018 1 N-CA-C 99.297 -4.334 . . . . 2.0 99.297 179.023 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 53' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -145.45 143.68 30.17 Favored 'General case' 0 CA--C 1.568 1.643 0 O-C-N 118.509 -2.619 . . . . 2.0 115.683 -179.148 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 54' ' ' CYS . . . . . . . . . . . . . 25.7 p -126.78 120.46 29.39 Favored 'General case' 0 CA--C 1.572 1.821 0 C-N-CA 123.448 0.699 . . . . 2.0 110.314 179.905 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 9.0 m120 -51.27 6.81 0.0 OUTLIER 'General case' 0 N--CA 1.506 2.367 1 N-CA-C 125.471 5.36 . . . . 2.0 125.471 -179.506 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 56' ' ' THR . . . . . . . . . . . . 0.252 5.5 t -137.6 175.98 9.12 Favored 'General case' 0 N--CA 1.504 2.233 0 CA-C-N 123.31 2.777 . . . . 2.0 117.315 -179.758 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 57' ' ' ASP . . . . . . . . . . . . . 38.1 m-20 -61.4 116.2 4.47 Favored 'General case' 0 N--CA 1.487 1.415 0 N-CA-C 115.366 1.617 . . . . 2.0 115.366 -179.931 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 58' ' ' ARG . . . . . . . . . . . . 0.315 38.2 mtp180 62.37 21.26 12.43 Favored 'General case' 0 CA--C 1.578 2.046 0 N-CA-C 117.999 2.592 . . . . 2.0 117.999 -179.969 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 59' ' ' CYS . . . . . . . . . . . . . 29.1 p -72.96 -24.7 60.82 Favored 'General case' 0 CA--C 1.573 1.862 0 N-CA-C 116.816 2.154 . . . . 2.0 116.816 179.829 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 60' ' ' ASN . . . . . . . . . . . . . 41.2 p-10 . . . . . 0 CA--C 1.56 1.334 0 CA-C-O 124.161 1.934 . . . . 2.0 112.229 179.849 . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' A' A ' 1' ' ' LEU . . . . . 0.479 HD22 ' SG ' ' A' ' 3' ' ' CYS . 6.0 tp . . . . . 0 CA--C 1.57 1.721 0 N-CA-C 113.497 0.925 . . . . 2.0 113.497 . . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -85.66 137.36 32.89 Favored 'General case' 0 CA--C 1.571 1.779 0 N-CA-C 107.886 -1.153 . . . . 2.0 107.886 179.711 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 3' ' ' CYS . . . . . 0.479 ' SG ' HD22 ' A' ' 1' ' ' LEU . 88.2 m -139.59 167.38 22.23 Favored 'General case' 0 N--CA 1.494 1.772 0 O-C-N 119.653 -1.904 . . . . 2.0 114.216 -179.89 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 69.4 m-80 -111.36 138.28 48.04 Favored 'General case' 0 CA--C 1.563 1.48 0 N-CA-C 116.969 2.211 . . . . 2.0 116.969 -179.858 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 5' ' ' LYS . . . . . 0.456 ' H ' ' HB2' ' A' ' 10' ' ' ALA 0.26 14.8 ptpt -87.56 172.17 9.95 Favored 'General case' 0 CA--C 1.587 2.396 0 CA-C-N 120.223 1.374 . . . . 2.0 107.481 178.912 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 1.5 mm? -39.98 -49.34 2.48 Favored 'General case' 0 N--CA 1.506 2.369 0 N-CA-C 120.897 3.665 . . . . 2.0 120.897 -179.835 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 7' ' ' ILE . . . . . . . . . . . . . 21.5 mt -73.7 147.11 86.5 Favored Pre-proline 0 CA--C 1.585 2.325 0 N-CA-C 114.2 1.185 . . . . 2.0 114.2 -179.79 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 70.6 Cg_exo -44.79 -45.54 13.53 Favored 'Trans proline' 0 CA--C 1.567 2.164 0 N-CA-C 119.864 2.986 . . . . 2.0 119.864 179.827 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 9' ' ' ILE . . . . . . . . . . . . 0.297 0.2 OUTLIER -59.37 -46.96 92.15 Favored 'Isoleucine or valine' 0 N--CA 1.514 2.726 0 CA-C-N 120.571 1.532 . . . . 2.0 112.356 179.611 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 10' ' ' ALA . . . . . 0.456 ' HB2' ' H ' ' A' ' 5' ' ' LYS . . . 55.97 159.2 0.01 OUTLIER 'General case' 0 CA--C 1.578 2.032 1 N-CA-C 123.918 4.784 . . . . 2.0 123.918 179.345 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 8.2 t -66.3 -174.31 0.26 Allowed 'General case' 0 CA--C 1.58 2.103 0 N-CA-C 117.763 2.505 . . . . 2.0 117.763 -179.902 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 12' ' ' LYS . . . . . . . . . . . . 0.309 50.4 tptt -98.23 -90.56 0.28 Allowed 'General case' 0 CA--C 1.572 1.801 1 N-CA-C 123.304 4.557 . . . . 2.0 123.304 -179.485 . . . . . . . . 3 2 . 1 . 005 nuclear orig core ' A' A ' 13' ' ' THR . . . . . . . . . . . . . 8.4 t -156.92 170.81 21.64 Favored 'General case' 0 N--CA 1.506 2.351 0 N-CA-C 120.108 3.373 . . . . 2.0 120.108 -179.143 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 14' ' ' CYS . . . . . . . . . . . . 0.419 0.5 OUTLIER -146.4 168.44 11.59 Favored Pre-proline 0 CA--C 1.6 2.902 0 C-N-CA 126.104 1.761 . . . . 2.0 108.713 179.215 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 15' ' ' PRO . . . . . . . . . . . . . 92.2 Cg_exo -45.07 171.37 0.02 OUTLIER 'Trans proline' 0 CA--C 1.571 2.347 1 N-CA-C 128.673 6.374 . . . . 2.0 128.673 -179.488 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -78.72 165.36 23.69 Favored 'General case' 0 N--CA 1.499 1.986 0 N-CA-C 104.506 -2.405 . . . . 2.0 104.506 178.944 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . 85.34 -47.94 3.93 Favored Glycine 1 N--CA 1.524 4.512 0 O-C-N 117.082 -3.511 . . . . 2.0 105.37 -178.642 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 39.9 mmtm -83.3 63.78 7.42 Favored 'General case' 0 CA--C 1.604 3.031 1 N-CA-C 99.939 -4.097 . . . . 2.0 99.939 178.493 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 37.3 p-10 -80.85 -20.49 42.23 Favored 'General case' 0 N--CA 1.483 1.18 0 N-CA-C 121.527 3.899 . . . . 2.0 121.527 -179.261 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 70.7 mt -88.59 112.95 23.64 Favored 'General case' 0 CA--C 1.555 1.136 0 CA-C-N 119.284 0.947 . . . . 2.0 110.586 179.771 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 21' ' ' CYS . . . . . 0.404 ' HB2' ' SG ' ' A' ' 59' ' ' CYS . 1.7 m -79.91 95.4 6.08 Favored 'General case' 0 CA--C 1.576 1.947 0 N-CA-C 100.389 -3.93 . . . . 2.0 100.389 179.257 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 22' ' ' TYR . . . . . . . . . . . . 0.266 0.0 OUTLIER -76.14 154.72 35.24 Favored 'General case' 0 CA--C 1.552 1.054 0 N-CA-C 121.008 3.707 . . . . 2.0 121.008 -179.35 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 31.8 mtmt -117.73 92.2 3.77 Favored 'General case' 0 CA--C 1.559 1.317 1 N-CA-C 99.626 -4.212 . . . . 2.0 99.626 179.311 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 24' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -71.13 72.97 0.63 Allowed 'General case' 0 CA--C 1.578 2.027 0 C-N-CA 124.374 1.07 . . . . 2.0 108.719 179.912 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 25' ' ' PHE . . . . . . . . . . . . . 9.6 m-30 -62.1 133.23 54.99 Favored 'General case' 0 N--CA 1.486 1.367 0 O-C-N 120.709 -1.245 . . . . 2.0 113.152 -179.856 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 26' ' ' MET . . . . . . . . . . . . . 34.4 mtp -64.48 131.2 46.44 Favored 'General case' 0 N--CA 1.489 1.503 0 N-CA-C 113.131 0.789 . . . . 2.0 113.131 -179.995 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 27' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -54.22 -38.83 66.15 Favored 'General case' 0 N--CA 1.514 2.731 0 CA-C-N 120.779 1.627 . . . . 2.0 112.164 179.461 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 50.4 m -79.73 -32.52 41.15 Favored 'General case' 0 CA--C 1.586 2.337 0 N-CA-C 114.062 1.134 . . . . 2.0 114.062 179.418 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 52.7 t0 -146.86 84.31 1.6 Allowed 'General case' 0 CA--C 1.573 1.85 0 O-C-N 120.599 -1.313 . . . . 2.0 109.723 179.871 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 1.6 mm? -51.18 -67.52 0.24 Allowed 'General case' 0 CA--C 1.576 1.972 0 N-CA-C 120.763 3.616 . . . . 2.0 120.763 -179.496 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 31' ' ' THR . . . . . . . . . . . . 0.337 15.3 t -19.22 -61.97 0.02 OUTLIER 'General case' 0 N--CA 1.51 2.538 1 N-CA-C 121.825 4.009 . . . . 2.0 121.825 -179.793 . . . . . . . . 3 2 . 1 . 005 nuclear orig core ' A' A ' 32' ' ' ILE . . . . . . . . . . . . . 1.8 mp -100.71 103.68 26.02 Favored Pre-proline 0 CA--C 1.589 2.468 1 N-CA-C 99.661 -4.2 . . . . 2.0 99.661 179.577 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 33' ' ' PRO . . . . . . . . . . . . . 14.5 Cg_endo -62.8 171.1 6.28 Favored 'Trans proline' 0 CA--C 1.561 1.862 1 N-CA-C 123.372 4.335 . . . . 2.0 123.372 -179.512 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 34' ' ' VAL . . . . . . . . . . . . . 97.8 t -73.66 -55.57 12.05 Favored 'Isoleucine or valine' 0 CA--C 1.59 2.49 0 N-CA-C 104.467 -2.42 . . . . 2.0 104.467 178.963 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 36.7 tttm -136.35 162.17 33.75 Favored 'General case' 0 CA--C 1.564 1.496 0 CA-C-O 124.449 2.071 . . . . 2.0 108.963 179.601 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 36' ' ' ARG . . . . . . . . . . . . 0.346 40.2 ttp180 -138.26 108.61 6.49 Favored 'General case' 0 CA--C 1.574 1.866 1 N-CA-C 98.495 -4.631 . . . . 2.0 98.495 179.533 . . . . . . . . 3 2 . 1 . 005 nuclear orig core ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . -145.04 -147.77 4.7 Favored Glycine 0 N--CA 1.489 2.21 0 O-C-N 119.053 -2.279 . . . . 2.0 118.387 -179.56 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 38' ' ' CYS . . . . . . . . . . . . . 19.1 p -115.47 137.51 51.98 Favored 'General case' 0 CA--C 1.562 1.421 0 C-N-CA 123.723 0.809 . . . . 2.0 111.587 179.959 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 39' ' ' ILE . . . . . . . . . . . . . 3.4 tp -160.23 166.12 0.73 Allowed 'Isoleucine or valine' 0 N--CA 1.495 1.809 0 O-C-N 120.879 -1.138 . . . . 2.0 113.838 -179.906 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 40' ' ' ASP . . . . . . . . . . . . . 9.6 p30 -80.87 -102.05 0.03 OUTLIER 'General case' 0 N--CA 1.507 2.406 0 N-CA-C 103.736 -2.69 . . . . 2.0 103.736 179.435 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 87.7 t -85.98 162.12 2.87 Favored 'Isoleucine or valine' 0 CA--C 1.58 2.126 0 N-CA-C 104.595 -2.372 . . . . 2.0 104.595 178.982 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 42' ' ' CYS . . . . . . . . . . . . . 1.7 m -63.78 107.24 1.19 Allowed Pre-proline 0 CA--C 1.605 3.068 1 N-CA-C 100.007 -4.071 . . . . 2.0 100.007 179.554 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 43' ' ' PRO . . . . . . . . . . . . . 26.4 Cg_exo -50.37 -178.02 0.01 OUTLIER 'Trans proline' 0 C--N 1.372 1.791 1 N-CA-C 125.088 4.996 . . . . 2.0 125.088 -178.709 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 96.7 mttt -73.08 103.15 3.74 Favored 'General case' 0 CA--C 1.568 1.639 0 N-CA-C 104.187 -2.523 . . . . 2.0 104.187 179.386 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 45' ' ' ASN . . . . . . . . . . . . 0.25 2.0 p-10 -67.6 117.45 9.56 Favored 'General case' 0 CA--C 1.563 1.466 0 N-CA-C 117.174 2.287 . . . . 2.0 117.174 -179.358 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 14.9 t -82.73 179.27 7.83 Favored 'General case' 0 CA--C 1.565 1.54 0 N-CA-C 113.776 1.028 . . . . 2.0 113.776 179.962 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 47' ' ' LEU . . . . . . . . . . . . . 88.8 mt -51.55 -25.01 5.97 Favored 'General case' 0 N--CA 1.507 2.391 0 N-CA-C 116.424 2.009 . . . . 2.0 116.424 179.768 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 78.7 mt -102.51 7.33 40.2 Favored 'General case' 0 CA--C 1.579 2.093 0 C-N-CA 125.131 1.372 . . . . 2.0 114.636 179.591 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 49' ' ' VAL . . . . . . . . . . . . . 9.0 p -153.93 159.24 3.37 Favored 'Isoleucine or valine' 0 N--CA 1.502 2.13 0 N-CA-C 117.505 2.409 . . . . 2.0 117.505 -179.644 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER -153.78 78.47 1.13 Allowed 'General case' 0 CA--C 1.576 1.967 0 N-CA-C 102.752 -3.055 . . . . 2.0 102.752 179.343 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER -58.69 128.81 39.05 Favored 'General case' 0 CA--C 1.569 1.697 1 N-CA-C 122.7 4.333 . . . . 2.0 122.7 -179.341 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 52' ' ' VAL . . . . . . . . . . . . 0.284 14.1 t -103.13 151.88 6.11 Favored 'Isoleucine or valine' 0 CA--C 1.578 2.047 0 N-CA-C 102.107 -3.294 . . . . 2.0 102.107 179.047 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 53' ' ' CYS . . . . . . . . . . . . 0.261 0.8 OUTLIER -147.5 160.82 42.17 Favored 'General case' 0 CA--C 1.568 1.65 0 N-CA-C 119.178 3.029 . . . . 2.0 119.178 -179.026 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 54' ' ' CYS . . . . . . . . . . . . . 29.0 p -143.34 120.69 11.61 Favored 'General case' 0 CA--C 1.574 1.895 0 C-N-CA 123.928 0.891 . . . . 2.0 110.342 179.78 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 14.8 m120 -55.45 12.01 0.0 OUTLIER 'General case' 0 N--CA 1.508 2.467 1 N-CA-C 124.518 5.007 . . . . 2.0 124.518 -179.674 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 56' ' ' THR . . . . . . . . . . . . 0.274 4.9 t -138.26 177.82 7.59 Favored 'General case' 0 N--CA 1.502 2.134 0 CA-C-N 123.077 2.671 . . . . 2.0 116.794 -179.839 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 57' ' ' ASP . . . . . . . . . . . . . 69.9 m-20 -65.11 120.76 13.27 Favored 'General case' 0 CA--C 1.565 1.541 0 N-CA-C 115.779 1.77 . . . . 2.0 115.779 -179.755 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 58' ' ' ARG . . . . . . . . . . . . . 10.7 mmm180 56.45 31.19 18.39 Favored 'General case' 0 CA--C 1.586 2.348 0 N-CA-C 115.193 1.553 . . . . 2.0 115.193 -179.919 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 59' ' ' CYS . . . . . 0.404 ' SG ' ' HB2' ' A' ' 21' ' ' CYS . 29.7 p -83.77 -21.13 32.3 Favored 'General case' 0 N--CA 1.495 1.813 0 N-CA-C 116.432 2.012 . . . . 2.0 116.432 179.848 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 60' ' ' ASN . . . . . . . . . . . . . 25.3 p-10 . . . . . 0 CA--C 1.56 1.34 0 CA-C-O 124.967 2.318 . . . . 2.0 113.079 179.886 . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' A' A ' 1' ' ' LEU . . . . . 0.563 HD11 ' SG ' ' A' ' 3' ' ' CYS . 0.7 OUTLIER . . . . . 0 CA--C 1.576 1.944 0 CA-C-O 123.257 1.503 . . . . 2.0 113.785 . . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 1.6 mptp? -151.87 108.41 3.47 Favored 'General case' 0 CA--C 1.565 1.523 0 N-CA-C 101.15 -3.648 . . . . 2.0 101.15 179.631 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 3' ' ' CYS . . . . . 0.563 ' SG ' HD11 ' A' ' 1' ' ' LEU . 90.7 m -114.01 -168.38 1.35 Allowed 'General case' 0 N--CA 1.499 1.979 0 CA-C-N 122.131 2.241 . . . . 2.0 115.941 -179.926 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 80.4 m-20 -139.4 113.35 8.68 Favored 'General case' 0 CA--C 1.56 1.329 0 C-N-CA 123.843 0.857 . . . . 2.0 110.547 179.911 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -66.74 -179.03 0.8 Allowed 'General case' 0 CA--C 1.583 2.243 0 CA-C-N 121.202 1.819 . . . . 2.0 111.44 179.416 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -45.03 -41.87 7.9 Favored 'General case' 0 N--CA 1.509 2.493 0 N-CA-C 120.86 3.652 . . . . 2.0 120.86 -179.704 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 7' ' ' ILE . . . . . . . . . . . . . 38.5 mt -57.03 144.13 69.74 Favored Pre-proline 0 CA--C 1.586 2.348 0 C-N-CA 124.602 1.161 . . . . 2.0 113.53 179.861 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 90.1 Cg_exo -46.48 -42.6 22.99 Favored 'Trans proline' 0 CA--C 1.572 2.382 0 N-CA-C 118.901 2.616 . . . . 2.0 118.901 179.828 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 9' ' ' ILE . . . . . . . . . . . . 0.264 9.5 pt -88.37 -67.49 0.73 Allowed 'Isoleucine or valine' 0 N--CA 1.499 2.018 0 C-N-CA 123.799 0.84 . . . . 2.0 112.125 179.669 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 10' ' ' ALA . . . . . . . . . . . . 0.259 . . 63.61 166.45 0.14 Allowed 'General case' 0 CA--C 1.581 2.166 0 N-CA-C 120.149 3.388 . . . . 2.0 120.149 179.818 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 15.8 t -87.01 149.86 24.46 Favored 'General case' 0 N--CA 1.495 1.819 0 O-C-N 121.099 -1.0 . . . . 2.0 113.437 179.984 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 12' ' ' LYS . . . . . . . . . . . . 0.388 9.0 ptpp? -84.21 -98.03 0.06 Allowed 'General case' 0 CA--C 1.584 2.287 1 N-CA-C 123.523 4.638 . . . . 2.0 123.523 -179.431 . . . . . . . . 3 2 . 1 . 006 nuclear orig core ' A' A ' 13' ' ' THR . . . . . . . . . . . . . 35.7 m -22.58 129.56 0.02 OUTLIER 'General case' 0 N--CA 1.505 2.285 1 N-CA-C 123.494 4.627 . . . . 2.0 123.494 -179.558 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 52.9 t -156.34 146.05 15.47 Favored Pre-proline 0 CA--C 1.594 2.665 0 C-N-CA 125.525 1.53 . . . . 2.0 110.095 179.72 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 15' ' ' PRO . . . . . . . . . . . . . 44.2 Cg_exo -47.76 169.91 0.06 OUTLIER 'Trans proline' 0 CA--C 1.576 2.606 1 N-CA-C 126.042 5.362 . . . . 2.0 126.042 -179.836 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -78.02 165.77 23.64 Favored 'General case' 0 N--CA 1.496 1.865 0 C-N-CA 124.8 1.24 . . . . 2.0 110.236 179.532 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . 82.86 -48.37 4.0 Favored Glycine 1 N--CA 1.517 4.039 0 O-C-N 119.049 -2.282 . . . . 2.0 109.256 -179.106 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 35.7 mmtm -77.34 91.99 3.88 Favored 'General case' 0 CA--C 1.573 1.858 0 N-CA-C 101.953 -3.351 . . . . 2.0 101.953 179.262 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 9.9 p30 -98.38 -27.23 14.19 Favored 'General case' 0 N--CA 1.491 1.612 0 N-CA-C 117.369 2.359 . . . . 2.0 117.369 -179.85 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 76.6 mt -83.7 114.12 21.35 Favored 'General case' 0 CA--C 1.557 1.233 0 N-CA-C 116.148 1.907 . . . . 2.0 116.148 -179.849 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 21' ' ' CYS . . . . . 0.417 ' SG ' HD21 ' A' ' 1' ' ' LEU . 5.2 m -84.45 91.44 7.83 Favored 'General case' 0 CA--C 1.578 2.031 1 N-CA-C 99.989 -4.078 . . . . 2.0 99.989 179.152 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 22' ' ' TYR . . . . . . . . . . . . . 8.1 p90 -75.47 158.89 31.98 Favored 'General case' 0 CA--C 1.552 1.036 0 N-CA-C 120.461 3.504 . . . . 2.0 120.461 -179.311 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 19.0 ptpt -133.21 101.55 5.24 Favored 'General case' 0 CA--C 1.562 1.406 0 N-CA-C 104.952 -2.24 . . . . 2.0 104.952 179.491 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 24' ' ' MET . . . . . . . . . . . . . 0.1 OUTLIER -68.81 86.92 0.34 Allowed 'General case' 0 N--CA 1.485 1.285 0 C-N-CA 125.438 1.495 . . . . 2.0 112.542 179.949 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 25' ' ' PHE . . . . . . . . . . . . . 8.2 m-30 -78.28 108.33 11.54 Favored 'General case' 0 CA--C 1.563 1.444 0 N-CA-C 104.601 -2.37 . . . . 2.0 104.601 179.568 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 26' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -58.27 128.5 37.43 Favored 'General case' 0 CA--C 1.57 1.712 0 CA-C-O 117.869 -1.062 . . . . 2.0 110.806 179.999 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 27' ' ' MET . . . . . . . . . . . . . 31.0 mtp -41.59 -36.73 0.98 Allowed 'General case' 0 N--CA 1.51 2.54 0 N-CA-C 117.949 2.574 . . . . 2.0 117.949 -179.891 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 67.3 m -89.23 -32.57 17.36 Favored 'General case' 0 CA--C 1.588 2.424 0 C-N-CA 124.189 0.996 . . . . 2.0 112.151 179.293 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 15.9 m-20 -130.44 87.61 2.53 Favored 'General case' 0 CA--C 1.576 1.945 0 O-C-N 119.424 -2.047 . . . . 2.0 105.592 179.748 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 1.5 mm? -74.26 -75.22 0.16 Allowed 'General case' 0 CA--C 1.578 2.022 0 N-CA-C 119.652 3.205 . . . . 2.0 119.652 -179.528 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 31' ' ' THR . . . . . . . . . . . . 0.257 80.7 p -17.92 -68.27 0.02 OUTLIER 'General case' 0 N--CA 1.508 2.47 0 N-CA-C 121.065 3.728 . . . . 2.0 121.065 -179.588 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 32' ' ' ILE . . . . . . . . . . . . . 1.9 mp -90.79 108.02 24.68 Favored Pre-proline 0 CA--C 1.585 2.315 1 N-CA-C 99.714 -4.18 . . . . 2.0 99.714 179.503 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 33' ' ' PRO . . . . . . . . . . . . . 43.1 Cg_endo -61.7 162.85 20.19 Favored 'Trans proline' 0 CA--C 1.56 1.787 0 N-CA-C 119.012 2.659 . . . . 2.0 119.012 -179.659 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 34' ' ' VAL . . . . . . . . . . . . . 14.2 t -88.19 -47.74 15.35 Favored 'Isoleucine or valine' 0 N--CA 1.503 2.2 0 N-CA-C 107.011 -1.477 . . . . 2.0 107.011 179.148 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 4.6 tptp -124.78 155.27 39.63 Favored 'General case' 0 CA--C 1.564 1.505 0 CA-C-O 124.159 1.933 . . . . 2.0 108.559 179.605 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 2.9 mtp180 -141.74 110.85 6.29 Favored 'General case' 0 CA--C 1.566 1.576 0 N-CA-C 100.495 -3.891 . . . . 2.0 100.495 179.782 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . -141.94 -152.74 5.77 Favored Glycine 0 N--CA 1.487 2.035 0 N-CA-C 118.8 2.28 . . . . 2.0 118.8 -179.7 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 38' ' ' CYS . . . . . 0.421 ' HB3' ' SG ' ' A' ' 3' ' ' CYS . 25.7 p -127.66 126.69 42.43 Favored 'General case' 0 CA--C 1.562 1.441 0 C-N-CA 123.581 0.752 . . . . 2.0 112.401 179.902 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 39' ' ' ILE . . . . . . . . . . . . . 8.2 tp -147.81 179.22 0.8 Allowed 'Isoleucine or valine' 0 N--CA 1.497 1.878 0 C-N-CA 124.007 0.923 . . . . 2.0 112.858 -179.702 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 40' ' ' ASP . . . . . . . . . . . . . 18.0 p-10 -102.91 -43.86 5.41 Favored 'General case' 0 CA--C 1.569 1.702 0 O-C-N 120.267 -1.521 . . . . 2.0 113.539 179.707 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 4.3 t -137.2 35.94 0.56 Allowed 'Isoleucine or valine' 0 N--CA 1.509 2.496 0 CA-C-N 120.086 1.312 . . . . 2.0 112.459 179.975 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 42' ' ' CYS . . . . . . . . . . . . 0.349 2.7 m 75.31 122.03 0.03 OUTLIER Pre-proline 0 CA--C 1.614 3.415 1 N-CA-C 99.919 -4.104 . . . . 2.0 99.919 -179.26 . . . . . . . . 3 2 . 1 . 006 nuclear orig core ' A' A ' 43' ' ' PRO . . . . . . . . . . . . . 27.4 Cg_exo -55.01 -4.08 0.34 Allowed 'Trans proline' 0 N--CA 1.503 2.077 1 N-CA-C 129.512 6.697 . . . . 2.0 129.512 -178.851 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 44' ' ' LYS . . . . . . . . . . . . 0.331 69.3 mttt 110.1 104.66 0.0 OUTLIER 'General case' 0 N--CA 1.494 1.738 0 N-CA-C 100.685 -3.82 . . . . 2.0 100.685 -179.446 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 45' ' ' ASN . . . . . . . . . . . . . 4.0 p-10 -72.77 101.34 3.08 Favored 'General case' 0 CA--C 1.566 1.592 0 N-CA-C 116.449 2.018 . . . . 2.0 116.449 -179.393 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 14.1 t -81.64 178.43 8.34 Favored 'General case' 0 CA--C 1.567 1.625 0 N-CA-C 113.245 0.832 . . . . 2.0 113.245 179.888 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 47' ' ' LEU . . . . . . . . . . . . 0.392 3.4 pp -57.3 -12.78 2.64 Favored 'General case' 0 N--CA 1.508 2.466 0 N-CA-C 117.072 2.249 . . . . 2.0 117.072 179.729 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 77.3 mt -106.61 4.22 27.75 Favored 'General case' 0 CA--C 1.584 2.253 0 C-N-CA 125.549 1.54 . . . . 2.0 111.867 179.209 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 49' ' ' VAL . . . . . . . . . . . . . 14.4 p -157.44 149.33 9.78 Favored 'Isoleucine or valine' 0 N--CA 1.501 2.11 0 CA-C-N 123.378 2.808 . . . . 2.0 116.988 -179.604 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 17.3 ttpt -141.51 73.18 1.41 Allowed 'General case' 0 CA--C 1.58 2.112 0 N-CA-C 104.173 -2.529 . . . . 2.0 104.173 179.539 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER -59.85 130.15 45.35 Favored 'General case' 0 N--CA 1.494 1.755 0 N-CA-C 120.819 3.637 . . . . 2.0 120.819 -179.367 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 52' ' ' VAL . . . . . . . . . . . . . 18.7 t -99.69 121.17 50.04 Favored 'Isoleucine or valine' 0 CA--C 1.574 1.891 1 N-CA-C 100.091 -4.04 . . . . 2.0 100.091 179.244 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 53' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -121.42 135.57 55.05 Favored 'General case' 0 CA--C 1.574 1.896 0 N-CA-C 117.715 2.487 . . . . 2.0 117.715 -179.198 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 54' ' ' CYS . . . . . . . . . . . . . 31.2 p -118.17 120.14 36.81 Favored 'General case' 0 N--CA 1.495 1.788 0 C-N-CA 124.112 0.965 . . . . 2.0 111.96 179.835 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 25.0 p-10 -63.06 40.5 0.01 OUTLIER 'General case' 0 N--CA 1.506 2.36 1 N-CA-C 123.028 4.455 . . . . 2.0 123.028 -179.509 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 5.9 t -155.16 172.57 17.92 Favored 'General case' 0 N--CA 1.497 1.911 0 O-C-N 119.656 -1.902 . . . . 2.0 113.999 179.946 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 57' ' ' ASP . . . . . . . . . . . . . 85.5 m-20 -67.46 122.44 17.97 Favored 'General case' 0 CA--C 1.568 1.648 0 N-CA-C 116.538 2.051 . . . . 2.0 116.538 -179.851 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 58' ' ' ARG . . . . . . . . . . . . 0.254 37.5 mtm105 56.35 28.81 14.03 Favored 'General case' 0 CA--C 1.574 1.901 0 N-CA-C 117.935 2.568 . . . . 2.0 117.935 179.802 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 59' ' ' CYS . . . . . . . . . . . . . 30.2 p -86.14 14.63 6.07 Favored 'General case' 0 CA--C 1.579 2.074 0 N-CA-C 117.191 2.293 . . . . 2.0 117.191 179.893 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 60' ' ' ASN . . . . . . . . . . . . . 35.7 p-10 . . . . . 0 CA--C 1.561 1.369 0 CA-C-O 124.012 1.863 . . . . 2.0 112.541 -179.948 . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' A' A ' 1' ' ' LEU . . . . . 0.496 ' O ' ' SG ' ' A' ' 14' ' ' CYS . 6.7 tt . . . . . 0 N--CA 1.502 2.175 0 CA-C-O 116.779 -1.581 . . . . 2.0 110.926 . . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 2' ' ' LYS . . . . . 0.45 ' CD ' ' HG ' ' A' ' 11' ' ' SER . 26.3 tttp -111.62 -47.31 3.17 Favored 'General case' 0 N--CA 1.521 3.08 0 CA-C-N 122.72 2.509 . . . . 2.0 113.798 -179.831 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 3' ' ' CYS . . . . . 0.415 ' SG ' HD23 ' A' ' 1' ' ' LEU 0.454 1.9 m 83.09 -136.65 0.01 OUTLIER 'General case' 0 CA--C 1.564 1.518 0 N-CA-C 119.483 3.142 . . . . 2.0 119.483 179.786 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 35.7 m-20 -131.67 131.54 43.21 Favored 'General case' 0 N--CA 1.484 1.242 0 N-CA-C 116.363 1.986 . . . . 2.0 116.363 -179.448 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 5' ' ' LYS . . . . . 0.458 ' H ' ' HB2' ' A' ' 10' ' ' ALA . 19.8 ptmt -76.11 -164.35 0.37 Allowed 'General case' 0 N--CA 1.501 2.077 0 CA-C-N 119.746 1.157 . . . . 2.0 108.398 179.193 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 4.5 mm? -52.65 -30.54 32.25 Favored 'General case' 0 N--CA 1.514 2.753 0 O-C-N 117.617 -3.177 . . . . 2.0 114.586 179.666 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 7' ' ' ILE . . . . . . . . . . . . . 51.2 mm -66.72 132.76 94.05 Favored Pre-proline 0 CA--C 1.587 2.365 0 C-N-CA 125.356 1.462 . . . . 2.0 109.784 179.562 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 8' ' ' PRO . . . . . . . . . . . . 0.314 20.5 Cg_exo -18.61 -71.76 0.02 OUTLIER 'Trans proline' 0 CA--C 1.568 2.225 1 N-CA-C 123.136 4.244 . . . . 2.0 123.136 -179.859 . . . . . . . . 3 2 . 1 . 007 nuclear orig core ' A' A ' 9' ' ' ILE . . . . . . . . . . . . . 17.2 tt -135.37 73.12 0.36 Allowed 'Isoleucine or valine' 0 N--CA 1.503 2.191 0 CA-C-O 122.183 0.992 . . . . 2.0 109.15 179.966 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 10' ' ' ALA . . . . . 0.458 ' HB2' ' H ' ' A' ' 5' ' ' LYS 0.359 . . -71.46 -101.11 0.01 OUTLIER 'General case' 0 CA--C 1.583 2.223 1 N-CA-C 125.576 5.399 . . . . 2.0 125.576 -179.433 . . . . . . . . 4 3 . 1 . 007 nuclear orig core ' A' A ' 11' ' ' SER . . . . . 0.45 ' HG ' ' CD ' ' A' ' 2' ' ' LYS 0.253 4.9 t -63.21 -169.76 0.03 OUTLIER 'General case' 0 CA--C 1.581 2.154 1 N-CA-C 123.356 4.576 . . . . 2.0 123.356 -179.255 . . . . . . . . 4 3 . 1 . 007 nuclear orig core ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 6.7 tptp -132.19 -79.55 0.5 Allowed 'General case' 0 CA--C 1.582 2.191 0 N-CA-C 118.921 2.934 . . . . 2.0 118.921 -179.788 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 13' ' ' THR . . . . . . . . . . . . . 8.1 t -134.15 118.5 17.75 Favored 'General case' 0 N--CA 1.511 2.583 0 N-CA-C 120.286 3.439 . . . . 2.0 120.286 -179.615 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 14' ' ' CYS . . . . . 0.56 ' SG ' ' HD2' ' A' ' 18' ' ' LYS . 0.5 OUTLIER -101.56 179.86 0.93 Allowed Pre-proline 0 CA--C 1.596 2.74 0 C-N-CA 125.663 1.585 . . . . 2.0 110.555 179.604 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 15' ' ' PRO . . . . . . . . . . . . . 87.8 Cg_exo -51.26 177.05 0.04 OUTLIER 'Trans proline' 0 CA--C 1.572 2.406 1 N-CA-C 123.606 4.426 . . . . 2.0 123.606 -179.876 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 16' ' ' ALA . . . . . . . . . . . . 0.253 . . 19.06 -164.96 0.0 OUTLIER 'General case' 0 N--CA 1.5 2.075 1 N-CA-C 124.009 4.818 . . . . 2.0 124.009 179.768 . . . . . . . . 3 2 . 1 . 007 nuclear orig core ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . -81.95 37.03 2.51 Favored Glycine 0 N--CA 1.502 3.059 0 O-C-N 119.886 -1.758 . . . . 2.0 113.636 179.503 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 18' ' ' LYS . . . . . 0.56 ' HD2' ' SG ' ' A' ' 14' ' ' CYS . 0.1 OUTLIER -83.51 82.26 8.37 Favored 'General case' 0 CA--C 1.563 1.469 0 C-N-CA 125.613 1.565 . . . . 2.0 106.886 179.937 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 8.5 p30 -69.34 -34.15 74.19 Favored 'General case' 0 CA--C 1.558 1.278 1 N-CA-C 122.715 4.339 . . . . 2.0 122.715 -179.542 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 49.4 mt -68.91 118.36 11.75 Favored 'General case' 0 CA--C 1.56 1.344 0 N-CA-C 115.951 1.834 . . . . 2.0 115.951 -179.844 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 21' ' ' CYS . . . . . 0.535 ' SG ' ' O ' ' A' ' 56' ' ' THR . 34.4 m -81.88 96.39 7.63 Favored 'General case' 0 CA--C 1.572 1.808 0 N-CA-C 103.143 -2.91 . . . . 2.0 103.143 179.304 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 22' ' ' TYR . . . . . . . . . . . . 0.4 0.0 OUTLIER -68.45 158.21 34.2 Favored 'General case' 0 CA--C 1.56 1.34 0 N-CA-C 119.716 3.228 . . . . 2.0 119.716 -179.515 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 29.4 mtmt -131.36 89.36 2.71 Favored 'General case' 0 CA--C 1.557 1.246 1 N-CA-C 99.664 -4.198 . . . . 2.0 99.664 179.466 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 24' ' ' MET . . . . . 0.41 ' HB3' ' H ' ' A' ' 35' ' ' LYS . 20.4 ttt -71.24 68.31 0.5 Allowed 'General case' 0 CA--C 1.571 1.755 0 O-C-N 121.171 -0.956 . . . . 2.0 111.688 -179.842 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 25' ' ' PHE . . . . . . . . . . . . . 11.3 m-30 -59.0 127.18 30.93 Favored 'General case' 0 N--CA 1.486 1.339 0 O-C-N 120.798 -1.189 . . . . 2.0 113.292 -179.932 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 26' ' ' MET . . . . . . . . . . . . . 84.5 mtp -59.95 128.77 38.51 Favored 'General case' 0 N--CA 1.493 1.689 0 CA-C-O 118.048 -0.977 . . . . 2.0 111.577 179.877 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 27' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -54.44 -35.99 63.56 Favored 'General case' 0 N--CA 1.511 2.604 0 CA-C-N 121.474 1.943 . . . . 2.0 112.529 179.62 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 75.6 m -83.96 -14.05 51.84 Favored 'General case' 0 CA--C 1.591 2.54 0 N-CA-C 114.525 1.305 . . . . 2.0 114.525 179.268 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -161.49 77.92 0.55 Allowed 'General case' 0 N--CA 1.499 2.023 0 O-C-N 119.408 -2.058 . . . . 2.0 108.302 179.855 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 2.4 mm? -46.32 -79.99 0.01 OUTLIER 'General case' 0 CA--C 1.576 1.944 1 N-CA-C 123.532 4.642 . . . . 2.0 123.532 -179.399 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 31' ' ' THR . . . . . . . . . . . . 0.337 14.6 t -19.75 -52.44 0.01 OUTLIER 'General case' 0 N--CA 1.508 2.453 1 N-CA-C 122.941 4.423 . . . . 2.0 122.941 -179.689 . . . . . . . . 3 2 . 1 . 007 nuclear orig core ' A' A ' 32' ' ' ILE . . . . . . . . . . . . . 1.8 mp -97.86 106.94 37.36 Favored Pre-proline 0 CA--C 1.591 2.523 0 N-CA-C 101.617 -3.475 . . . . 2.0 101.617 179.545 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 33' ' ' PRO . . . . . . . . . . . . . 3.1 Cg_endo -65.3 167.47 16.47 Favored 'Trans proline' 0 CA--C 1.559 1.772 1 N-CA-C 122.63 4.05 . . . . 2.0 122.63 -179.659 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 34' ' ' VAL . . . . . . . . . . . . . 96.5 t -75.38 -53.37 16.26 Favored 'Isoleucine or valine' 0 CA--C 1.591 2.531 0 N-CA-C 104.546 -2.39 . . . . 2.0 104.546 178.965 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 35' ' ' LYS . . . . . 0.41 ' H ' ' HB3' ' A' ' 24' ' ' MET . 97.6 mttt -149.13 117.82 6.61 Favored 'General case' 0 CA--C 1.552 1.055 0 C-N-CA 125.494 1.518 . . . . 2.0 110.795 179.63 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 36' ' ' ARG . . . . . . . . . . . . 0.358 28.1 ttp180 -88.63 109.59 20.23 Favored 'General case' 0 CA--C 1.594 2.653 0 N-CA-C 101.715 -3.439 . . . . 2.0 101.715 179.689 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . -141.04 -135.81 3.22 Favored Glycine 0 N--CA 1.497 2.764 0 N-CA-C 121.264 3.266 . . . . 2.0 121.264 -179.28 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 38' ' ' CYS . . . . . . . . . . . . . 29.7 p -125.73 141.8 51.83 Favored 'General case' 0 N--CA 1.491 1.598 0 N-CA-C 116.116 1.895 . . . . 2.0 116.116 -179.826 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 39' ' ' ILE . . . . . . . . . . . . . 2.4 tp -164.73 166.69 0.51 Allowed 'Isoleucine or valine' 0 CA--C 1.574 1.881 0 N-CA-C 114.465 1.283 . . . . 2.0 114.465 -179.906 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 40' ' ' ASP . . . . . . . . . . . . . 8.0 p-10 -82.74 -51.51 7.62 Favored 'General case' 0 N--CA 1.505 2.289 0 O-C-N 119.868 -1.77 . . . . 2.0 113.402 179.536 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 87.7 t -133.72 143.28 39.16 Favored 'Isoleucine or valine' 0 CA--C 1.563 1.474 0 N-CA-C 102.271 -3.233 . . . . 2.0 102.271 179.677 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 42' ' ' CYS . . . . . . . . . . . . . 1.0 OUTLIER -57.69 105.41 0.53 Allowed Pre-proline 0 CA--C 1.602 2.967 0 N-CA-C 101.872 -3.381 . . . . 2.0 101.872 179.638 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 43' ' ' PRO . . . . . . . . . . . . . 39.8 Cg_exo -48.41 174.17 0.03 OUTLIER 'Trans proline' 0 C--N 1.371 1.755 1 N-CA-C 126.201 5.423 . . . . 2.0 126.201 -178.638 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 57.2 mttp -72.81 89.22 1.36 Allowed 'General case' 0 CA--C 1.568 1.648 0 CA-C-N 112.889 -1.96 . . . . 2.0 105.927 179.597 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 45' ' ' ASN . . . . . . . . . . . . . 4.1 p-10 -63.62 154.54 32.49 Favored 'General case' 0 CA--C 1.567 1.601 0 N-CA-C 117.301 2.334 . . . . 2.0 117.301 -179.614 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 22.5 t -123.33 -173.18 2.67 Favored 'General case' 0 N--CA 1.485 1.286 0 N-CA-C 113.802 1.038 . . . . 2.0 113.802 179.993 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 47' ' ' LEU . . . . . . . . . . . . 0.35 1.0 OUTLIER -56.7 -15.54 4.75 Favored 'General case' 0 N--CA 1.508 2.463 0 N-CA-C 116.338 1.977 . . . . 2.0 116.338 179.63 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 88.8 mt -101.95 -2.43 29.77 Favored 'General case' 0 CA--C 1.588 2.436 0 C-N-CA 125.986 1.714 . . . . 2.0 111.809 179.138 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 49' ' ' VAL . . . . . . . . . . . . . 11.2 p -154.23 165.37 1.37 Allowed 'Isoleucine or valine' 0 CA--C 1.583 2.236 0 N-CA-C 117.254 2.316 . . . . 2.0 117.254 -179.522 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 61.7 tttp -159.14 93.55 1.15 Allowed 'General case' 0 CA--C 1.573 1.829 1 N-CA-C 99.759 -4.163 . . . . 2.0 99.759 179.394 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 83.8 m-85 -72.41 124.01 24.25 Favored 'General case' 0 CA--C 1.568 1.673 0 N-CA-C 121.363 3.838 . . . . 2.0 121.363 -179.309 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 52' ' ' VAL . . . . . . . . . . . . 0.283 78.9 t -100.01 156.7 4.04 Favored 'Isoleucine or valine' 0 CA--C 1.585 2.307 0 N-CA-C 102.816 -3.031 . . . . 2.0 102.816 179.101 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 53' ' ' CYS . . . . . . . . . . . . 0.324 1.4 p -164.86 160.63 19.63 Favored 'General case' 0 N--CA 1.5 2.04 0 O-C-N 117.33 -3.356 . . . . 2.0 119.329 -179.034 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 54' ' ' CYS . . . . . . . . . . . . 0.395 25.4 p -152.35 119.7 5.95 Favored 'General case' 0 CA--C 1.584 2.258 0 CA-C-O 122.85 1.31 . . . . 2.0 111.866 179.471 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 10.6 m120 -34.01 -9.55 0.0 OUTLIER 'General case' 0 N--CA 1.504 2.234 1 N-CA-C 129.839 6.977 . . . . 2.0 129.839 -179.54 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 56' ' ' THR . . . . . 0.535 ' O ' ' SG ' ' A' ' 21' ' ' CYS . 7.9 t -130.79 161.43 31.77 Favored 'General case' 0 N--CA 1.513 2.687 0 CA-C-N 124.861 3.482 . . . . 2.0 115.727 -179.81 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 57' ' ' ASP . . . . . . . . . . . . . 5.5 m-20 -48.22 120.89 3.86 Favored 'General case' 0 N--CA 1.497 1.902 0 N-CA-C 114.796 1.406 . . . . 2.0 114.796 -179.835 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 58' ' ' ARG . . . . . . . . . . . . 0.281 63.4 mtt180 70.92 9.92 6.87 Favored 'General case' 0 N--CA 1.502 2.141 0 N-CA-C 115.699 1.741 . . . . 2.0 115.699 -179.76 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 59' ' ' CYS . . . . . . . . . . . . . 35.7 t -61.57 -32.22 72.3 Favored 'General case' 0 CA--C 1.574 1.867 0 N-CA-C 115.632 1.716 . . . . 2.0 115.632 179.775 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 60' ' ' ASN . . . . . . . . . . . . . 47.9 p30 . . . . . 0 CA--C 1.567 1.602 0 CA-C-O 124.652 2.168 . . . . 2.0 112.848 179.813 . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' A' A ' 1' ' ' LEU . . . . . 0.503 HD11 ' SG ' ' A' ' 3' ' ' CYS . 0.5 OUTLIER . . . . . 0 CA--C 1.582 2.203 0 CA-C-O 122.467 1.127 . . . . 2.0 112.823 . . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 6.3 tmtt? -145.76 108.3 4.46 Favored 'General case' 0 N--CA 1.494 1.766 0 N-CA-C 101.076 -3.675 . . . . 2.0 101.076 179.855 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 3' ' ' CYS . . . . . 0.503 ' SG ' HD11 ' A' ' 1' ' ' LEU . 71.7 m -123.13 174.75 7.04 Favored 'General case' 0 N--CA 1.495 1.781 0 N-CA-C 119.126 3.01 . . . . 2.0 119.126 -179.474 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 18.0 m-20 -102.84 137.62 40.81 Favored 'General case' 0 CA--C 1.56 1.362 0 C-N-CA 124.193 0.997 . . . . 2.0 110.852 179.778 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 22.0 ptmt -84.84 -160.93 0.52 Allowed 'General case' 0 CA--C 1.593 2.631 0 CA-C-N 120.376 1.444 . . . . 2.0 108.113 179.224 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -46.0 -42.75 13.58 Favored 'General case' 0 N--CA 1.509 2.483 0 N-CA-C 119.136 3.013 . . . . 2.0 119.136 -179.996 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 7' ' ' ILE . . . . . . . . . . . . . 42.6 mm -65.88 138.77 96.54 Favored Pre-proline 0 CA--C 1.585 2.295 0 N-CA-C 115.542 1.682 . . . . 2.0 115.542 -179.74 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 80.0 Cg_exo -48.16 -40.55 34.55 Favored 'Trans proline' 0 CA--C 1.569 2.256 0 N-CA-C 121.063 3.447 . . . . 2.0 121.063 179.844 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 9' ' ' ILE . . . . . . . . . . . . . 34.4 mm -106.39 30.25 0.96 Allowed 'Isoleucine or valine' 0 CA--C 1.589 2.473 0 N-CA-C 114.169 1.174 . . . . 2.0 114.169 -179.817 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -74.52 160.63 30.66 Favored 'General case' 0 CA--C 1.574 1.9 0 O-C-N 118.108 -2.87 . . . . 2.0 117.205 -179.91 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 96.4 p -153.41 119.99 5.59 Favored 'General case' 0 N--CA 1.501 2.115 0 O-C-N 120.448 -1.407 . . . . 2.0 112.27 -179.919 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -148.49 138.69 22.5 Favored 'General case' 0 N--CA 1.497 1.888 0 O-C-N 120.801 -1.187 . . . . 2.0 113.41 -179.804 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 13' ' ' THR . . . . . . . . . . . . . 50.9 m -74.2 130.26 39.4 Favored 'General case' 0 N--CA 1.505 2.32 0 O-C-N 120.574 -1.329 . . . . 2.0 110.897 179.829 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 14' ' ' CYS . . . . . 0.451 ' SG ' ' HD2' ' A' ' 15' ' ' PRO 0.256 12.7 t -135.27 162.51 57.02 Favored Pre-proline 0 CA--C 1.594 2.641 0 N-CA-C 113.99 1.108 . . . . 2.0 113.99 -179.625 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 15' ' ' PRO . . . . . 0.451 ' HD2' ' SG ' ' A' ' 14' ' ' CYS . 68.4 Cg_exo -50.49 161.81 1.12 Allowed 'Trans proline' 0 CA--C 1.575 2.551 1 N-CA-C 125.538 5.169 . . . . 2.0 125.538 -179.822 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 16' ' ' ALA . . . . . 0.434 ' C ' ' H ' ' A' ' 18' ' ' LYS . . . -84.36 171.83 12.31 Favored 'General case' 0 N--CA 1.498 1.954 0 C-N-CA 124.94 1.296 . . . . 2.0 111.757 179.581 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . 81.76 -46.93 3.56 Favored Glycine 1 N--CA 1.523 4.461 0 O-C-N 119.245 -2.159 . . . . 2.0 108.618 -178.938 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 18' ' ' LYS . . . . . 0.434 ' H ' ' C ' ' A' ' 16' ' ' ALA . 72.8 mmtt -78.64 85.44 4.68 Favored 'General case' 0 CA--C 1.575 1.934 0 C-N-CA 129.017 2.927 . . . . 2.0 104.446 179.336 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 8.1 p30 -82.96 -23.97 33.19 Favored 'General case' 0 N--CA 1.496 1.832 0 N-CA-C 119.642 3.201 . . . . 2.0 119.642 -179.775 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 61.9 mt -88.66 121.71 31.32 Favored 'General case' 0 CA--C 1.551 0.998 0 C-N-CA 123.96 0.904 . . . . 2.0 113.11 -179.966 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 1.3 m -82.26 97.42 8.27 Favored 'General case' 0 CA--C 1.577 1.999 1 N-CA-C 99.001 -4.444 . . . . 2.0 99.001 179.064 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 22' ' ' TYR . . . . . . . . . . . . 0.263 0.0 OUTLIER -82.69 153.55 25.29 Favored 'General case' 0 N--CA 1.482 1.163 0 N-CA-C 118.795 2.887 . . . . 2.0 118.795 -179.429 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 13.4 ptmt -126.32 96.65 4.77 Favored 'General case' 0 CA--C 1.561 1.381 0 N-CA-C 103.938 -2.616 . . . . 2.0 103.938 179.629 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 24' ' ' MET . . . . . . . . . . . . 0.28 42.0 ttm -65.1 70.98 0.04 OUTLIER 'General case' 0 CA--C 1.57 1.742 0 C-N-CA 126.301 1.84 . . . . 2.0 113.911 -179.856 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 25' ' ' PHE . . . . . . . . . . . . . 4.0 m-30 -58.09 133.65 55.75 Favored 'General case' 0 N--CA 1.493 1.715 0 O-C-N 120.55 -1.344 . . . . 2.0 114.014 179.939 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 26' ' ' MET . . . . . . . . . . . . . 58.1 mtp -66.62 131.61 46.37 Favored 'General case' 0 N--CA 1.492 1.632 0 CA-C-O 118.609 -0.71 . . . . 2.0 111.948 179.941 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 27' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -54.06 -41.21 67.88 Favored 'General case' 0 N--CA 1.513 2.716 0 CA-C-N 120.702 1.592 . . . . 2.0 112.542 179.562 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 50.5 m -77.89 -35.26 50.99 Favored 'General case' 0 CA--C 1.585 2.299 0 N-CA-C 113.892 1.071 . . . . 2.0 113.892 179.475 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 11.8 t70 -141.19 82.17 1.82 Allowed 'General case' 0 CA--C 1.574 1.88 0 O-C-N 120.635 -1.29 . . . . 2.0 109.383 179.871 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 2.3 mm? -47.73 -71.42 0.07 Allowed 'General case' 0 CA--C 1.579 2.078 0 N-CA-C 119.876 3.287 . . . . 2.0 119.876 -179.671 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 31' ' ' THR . . . . . . . . . . . . . 56.2 p -15.18 -64.32 0.01 OUTLIER 'General case' 0 N--CA 1.511 2.587 0 N-CA-C 121.787 3.995 . . . . 2.0 121.787 -179.814 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 32' ' ' ILE . . . . . . . . . . . . . 1.8 mp -94.78 110.98 52.52 Favored Pre-proline 0 CA--C 1.587 2.392 0 N-CA-C 101.948 -3.353 . . . . 2.0 101.948 179.609 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 33' ' ' PRO . . . . . . . . . . . . . 5.2 Cg_exo -67.03 164.33 30.43 Favored 'Trans proline' 0 CA--C 1.557 1.665 0 N-CA-C 122.201 3.885 . . . . 2.0 122.201 -179.557 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 34' ' ' VAL . . . . . . . . . . . . . 58.7 t -70.74 -45.6 72.99 Favored 'Isoleucine or valine' 0 CA--C 1.595 2.679 0 N-CA-C 106.462 -1.681 . . . . 2.0 106.462 178.883 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 5.3 tptm -152.42 167.78 27.61 Favored 'General case' 0 CA--C 1.567 1.623 0 C-N-CA 126.626 1.97 . . . . 2.0 109.797 179.773 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 12.5 mtt180 -144.3 110.26 5.38 Favored 'General case' 0 CA--C 1.574 1.868 0 N-CA-C 104.196 -2.52 . . . . 2.0 104.196 179.495 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . -141.83 -135.53 3.13 Favored Glycine 0 N--CA 1.494 2.5 0 O-C-N 120.699 -1.25 . . . . 2.0 115.116 -179.872 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 38' ' ' CYS . . . . . . . . . . . . . 16.1 p -129.33 136.23 49.75 Favored 'General case' 0 N--CA 1.491 1.614 0 CA-C-N 118.174 0.987 . . . . 2.0 112.45 179.713 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 39' ' ' ILE . . . . . . . . . . . . . 3.3 tp -150.38 162.08 3.82 Favored 'Isoleucine or valine' 0 CA--C 1.577 2.003 0 N-CA-C 113.78 1.03 . . . . 2.0 113.78 -179.866 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 40' ' ' ASP . . . . . . . . . . . . . 8.1 p-10 -79.64 -49.84 11.53 Favored 'General case' 0 N--CA 1.513 2.713 0 O-C-N 119.139 -2.226 . . . . 2.0 114.504 179.753 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 70.3 t -134.47 143.72 37.1 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.415 0 N-CA-C 102.537 -3.135 . . . . 2.0 102.537 179.645 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 42' ' ' CYS . . . . . . . . . . . . 0.258 1.9 m -57.55 104.95 0.46 Allowed Pre-proline 0 CA--C 1.599 2.836 0 N-CA-C 102.032 -3.321 . . . . 2.0 102.032 179.67 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 43' ' ' PRO . . . . . . . . . . . . . 25.2 Cg_exo -50.75 179.87 0.02 OUTLIER 'Trans proline' 0 C--N 1.371 1.757 1 N-CA-C 125.466 5.141 . . . . 2.0 125.466 -178.693 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 29.9 mtpp -69.79 96.31 0.97 Allowed 'General case' 0 CA--C 1.565 1.522 0 N-CA-C 105.506 -2.035 . . . . 2.0 105.506 179.535 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 45' ' ' ASN . . . . . . . . . . . . 0.252 2.1 p-10 -62.62 112.91 2.69 Favored 'General case' 0 CA--C 1.567 1.604 0 N-CA-C 116.763 2.134 . . . . 2.0 116.763 -179.456 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 12.4 t -80.17 -179.8 7.25 Favored 'General case' 0 CA--C 1.567 1.604 0 N-CA-C 114.511 1.301 . . . . 2.0 114.511 179.943 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 47' ' ' LEU . . . . . . . . . . . . . 93.3 mt -49.77 -28.55 6.38 Favored 'General case' 0 N--CA 1.507 2.39 0 N-CA-C 116.708 2.114 . . . . 2.0 116.708 179.822 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 78.6 mt -102.54 12.73 36.01 Favored 'General case' 0 CA--C 1.579 2.082 0 C-N-CA 124.849 1.259 . . . . 2.0 114.06 179.655 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 49' ' ' VAL . . . . . . . . . . . . . 9.4 p -155.85 158.62 3.29 Favored 'Isoleucine or valine' 0 N--CA 1.502 2.168 0 N-CA-C 118.114 2.635 . . . . 2.0 118.114 -179.699 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 59.9 tttp -153.57 75.51 1.05 Allowed 'General case' 0 CA--C 1.581 2.135 0 N-CA-C 103.011 -2.959 . . . . 2.0 103.011 179.296 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 18.2 m-85 -50.38 120.79 4.88 Favored 'General case' 0 CA--C 1.572 1.806 0 N-CA-C 121.58 3.918 . . . . 2.0 121.58 -179.53 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 52' ' ' VAL . . . . . . . . . . . . 0.256 25.2 t -101.76 140.79 19.46 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.958 0 N-CA-C 101.968 -3.345 . . . . 2.0 101.968 179.294 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 53' ' ' CYS . . . . . . . . . . . . 0.425 6.8 p -155.71 158.95 39.08 Favored 'General case' 0 N--CA 1.493 1.702 0 N-CA-C 118.821 2.897 . . . . 2.0 118.821 -178.866 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 54' ' ' CYS . . . . . . . . . . . . 0.408 21.6 p -148.57 127.57 12.75 Favored 'General case' 0 CA--C 1.579 2.087 0 CA-C-O 122.606 1.193 . . . . 2.0 110.971 179.505 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 12.3 m120 -42.65 16.31 0.0 OUTLIER 'General case' 0 N--CA 1.504 2.262 1 N-CA-C 127.338 6.051 . . . . 2.0 127.338 -179.481 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 6.9 t -148.14 177.27 9.53 Favored 'General case' 0 N--CA 1.501 2.104 0 CA-C-N 123.179 2.718 . . . . 2.0 115.012 -179.935 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 57' ' ' ASP . . . . . . . . . . . . . 43.4 m-20 -62.86 124.03 19.99 Favored 'General case' 0 CA--C 1.56 1.362 0 C-N-CA 124.126 0.971 . . . . 2.0 112.792 -180.0 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 58' ' ' ARG . . . . . . . . . . . . . 71.3 mtp180 64.66 18.73 11.55 Favored 'General case' 0 N--CA 1.499 1.981 0 N-CA-C 117.01 2.226 . . . . 2.0 117.01 -179.962 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 59' ' ' CYS . . . . . . . . . . . . . 36.8 t -71.18 -19.56 62.39 Favored 'General case' 0 CA--C 1.579 2.078 0 N-CA-C 117.081 2.252 . . . . 2.0 117.081 179.902 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 60' ' ' ASN . . . . . . . . . . . . . 10.2 p30 . . . . . 0 CA--C 1.567 1.615 0 CA-C-O 125.21 2.433 . . . . 2.0 112.823 179.803 . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' A' A ' 1' ' ' LEU . . . . . . . . . . . . 0.301 0.3 OUTLIER . . . . . 0 CA--C 1.571 1.788 0 N-CA-C 114.117 1.154 . . . . 2.0 114.117 . . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 28.2 mttp -70.66 128.74 37.11 Favored 'General case' 0 N--CA 1.494 1.748 0 O-C-N 120.735 -1.228 . . . . 2.0 110.451 179.764 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 71.8 m -137.84 -176.52 4.45 Favored 'General case' 0 CA--C 1.566 1.562 0 CA-C-O 122.619 1.2 . . . . 2.0 113.323 -179.816 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 91.8 m-20 -122.86 97.42 5.44 Favored 'General case' 0 CA--C 1.554 1.102 0 C-N-CA 123.583 0.753 . . . . 2.0 111.739 179.957 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 5' ' ' LYS . . . . . . . . . . . . 0.315 22.4 ptmt -56.15 164.14 1.37 Allowed 'General case' 0 CA--C 1.589 2.476 0 CA-C-N 120.396 1.453 . . . . 2.0 112.475 179.465 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 6' ' ' LEU . . . . . . . . . . . . 0.358 2.4 tm? -30.66 -49.52 0.12 Allowed 'General case' 0 N--CA 1.511 2.625 1 N-CA-C 122.648 4.314 . . . . 2.0 122.648 -179.139 . . . . . . . . 3 2 . 1 . 009 nuclear orig core ' A' A ' 7' ' ' ILE . . . . . . . . . . . . . 49.0 mm -55.08 149.16 25.89 Favored Pre-proline 0 CA--C 1.594 2.649 0 N-CA-C 114.425 1.268 . . . . 2.0 114.425 179.889 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 97.3 Cg_exo -47.21 -54.16 5.42 Favored 'Trans proline' 0 CA--C 1.575 2.549 0 C-N-CA 123.059 2.506 . . . . 2.0 118.282 179.881 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 9' ' ' ILE . . . . . . . . . . . . 0.256 10.8 tp -74.65 -48.31 35.05 Favored 'Isoleucine or valine' 0 N--CA 1.507 2.42 0 N-CA-C 114.459 1.281 . . . . 2.0 114.459 179.684 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . 24.52 120.1 0.0 OUTLIER 'General case' 0 CA--C 1.58 2.114 1 N-CA-C 124.202 4.89 . . . . 2.0 124.202 179.739 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 94.1 p -112.18 100.59 8.95 Favored 'General case' 0 CA--C 1.568 1.668 0 N-CA-C 117.116 2.265 . . . . 2.0 117.116 -179.754 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 16.6 tppt? -117.35 127.3 53.92 Favored 'General case' 0 N--CA 1.495 1.805 0 N-CA-C 108.05 -1.092 . . . . 2.0 108.05 179.715 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 13' ' ' THR . . . . . . . . . . . . . 9.8 t -135.99 78.47 1.72 Allowed 'General case' 0 N--CA 1.503 2.185 0 O-C-N 120.782 -1.199 . . . . 2.0 111.398 -179.973 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 14' ' ' CYS . . . . . . . . . . . . 0.272 0.1 OUTLIER -103.88 170.87 5.64 Favored Pre-proline 0 CA--C 1.587 2.398 0 N-CA-C 115.364 1.616 . . . . 2.0 115.364 -179.939 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 15' ' ' PRO . . . . . . . . . . . . . 86.2 Cg_exo -55.72 164.82 4.08 Favored 'Trans proline' 0 N--CA 1.501 1.954 1 N-CA-C 126.197 5.422 . . . . 2.0 126.197 -179.617 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -70.19 175.91 4.24 Favored 'General case' 0 N--CA 1.498 1.946 0 C-N-CA 123.935 0.894 . . . . 2.0 109.437 179.398 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . 83.65 -53.2 4.83 Favored Glycine 1 N--CA 1.518 4.141 0 O-C-N 118.341 -2.724 . . . . 2.0 106.558 -179.101 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 18' ' ' LYS . . . . . 0.465 ' NZ ' ' HD2' ' A' ' 40' ' ' ASP . 18.3 mmtm -80.3 65.83 5.59 Favored 'General case' 0 CA--C 1.602 2.977 0 N-CA-C 103.113 -2.921 . . . . 2.0 103.113 178.926 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 9.8 p30 -64.67 -38.84 92.38 Favored 'General case' 0 N--CA 1.482 1.156 0 N-CA-C 120.69 3.589 . . . . 2.0 120.69 -179.475 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 89.4 mt -72.36 117.02 13.5 Favored 'General case' 0 CA--C 1.55 0.959 0 N-CA-C 115.704 1.742 . . . . 2.0 115.704 -179.764 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 1.5 m -84.79 91.9 8.1 Favored 'General case' 0 CA--C 1.576 1.978 1 N-CA-C 98.902 -4.481 . . . . 2.0 98.902 179.084 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 22' ' ' TYR . . . . . . . . . . . . 0.321 4.4 p90 -65.56 153.69 40.81 Favored 'General case' 0 N--CA 1.481 1.08 0 N-CA-C 119.674 3.212 . . . . 2.0 119.674 -179.368 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 29.5 ttpt -132.21 96.14 3.82 Favored 'General case' 0 CA--C 1.562 1.422 0 N-CA-C 104.171 -2.529 . . . . 2.0 104.171 179.857 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 24' ' ' MET . . . . . 0.518 ' SD ' ' HB3' ' A' ' 35' ' ' LYS . 15.0 ttt -68.12 86.05 0.25 Allowed 'General case' 0 CA--C 1.567 1.609 0 N-CA-C 114.356 1.243 . . . . 2.0 114.356 -179.722 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 25' ' ' PHE . . . . . . . . . . . . . 3.0 m-30 -81.76 108.51 15.35 Favored 'General case' 0 CA--C 1.569 1.696 0 N-CA-C 105.153 -2.166 . . . . 2.0 105.153 179.649 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 26' ' ' MET . . . . . . . . . . . . . 22.3 ttt -58.11 137.99 56.47 Favored 'General case' 0 N--CA 1.496 1.841 0 O-C-N 120.885 -1.134 . . . . 2.0 113.864 -179.864 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 27' ' ' MET . . . . . . . . . . . . . 2.2 mmt -48.21 -39.69 21.94 Favored 'General case' 0 N--CA 1.508 2.456 0 N-CA-C 115.359 1.614 . . . . 2.0 115.359 179.929 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 59.4 m -80.76 -38.91 27.79 Favored 'General case' 0 CA--C 1.584 2.275 0 C-N-CA 123.611 0.765 . . . . 2.0 112.932 179.538 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 59.0 t0 -132.63 99.44 4.64 Favored 'General case' 0 CA--C 1.572 1.825 0 N-CA-C 106.573 -1.64 . . . . 2.0 106.573 179.733 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 2.4 mm? -76.55 -77.35 0.14 Allowed 'General case' 0 CA--C 1.578 2.046 0 N-CA-C 117.59 2.441 . . . . 2.0 117.59 -179.658 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 31' ' ' THR . . . . . . . . . . . . . 56.5 p -14.24 -69.81 0.01 OUTLIER 'General case' 0 N--CA 1.511 2.58 0 N-CA-C 121.15 3.759 . . . . 2.0 121.15 -179.804 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 32' ' ' ILE . . . . . . . . . . . . . 2.0 mp -89.44 112.47 51.73 Favored Pre-proline 0 CA--C 1.589 2.451 1 N-CA-C 99.562 -4.236 . . . . 2.0 99.562 179.552 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 33' ' ' PRO . . . . . . . . . . . . . 6.0 Cg_exo -66.87 158.19 57.73 Favored 'Trans proline' 0 CA--C 1.554 1.512 0 N-CA-C 119.706 2.925 . . . . 2.0 119.706 -179.41 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 34' ' ' VAL . . . . . . . . . . . . 0.255 13.2 m -85.16 -37.18 12.0 Favored 'Isoleucine or valine' 0 CA--C 1.585 2.315 0 CA-C-O 121.627 0.727 . . . . 2.0 109.82 179.078 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 35' ' ' LYS . . . . . 0.518 ' HB3' ' SD ' ' A' ' 24' ' ' MET . 34.8 ttmt -145.66 163.87 33.53 Favored 'General case' 0 CA--C 1.569 1.706 0 CA-C-O 123.72 1.724 . . . . 2.0 109.293 179.59 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 14.4 mtp180 -145.39 132.22 20.11 Favored 'General case' 0 CA--C 1.576 1.964 0 N-CA-C 102.815 -3.031 . . . . 2.0 102.815 179.585 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . -153.21 -146.35 4.35 Favored Glycine 0 N--CA 1.488 2.162 0 O-C-N 119.797 -1.815 . . . . 2.0 117.61 -179.775 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 38' ' ' CYS . . . . . . . . . . . . . 10.5 p -129.33 132.5 47.12 Favored 'General case' 0 CA--C 1.571 1.765 0 C-N-CA 123.668 0.787 . . . . 2.0 111.481 179.944 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 39' ' ' ILE . . . . . . . . . . . . . 9.9 tp -158.98 172.66 0.39 Allowed 'Isoleucine or valine' 0 N--CA 1.503 2.198 0 O-C-N 120.692 -1.255 . . . . 2.0 113.08 -179.773 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 40' ' ' ASP . . . . . 0.465 ' HD2' ' NZ ' ' A' ' 18' ' ' LYS . 0.0 OUTLIER -95.3 -46.39 6.75 Favored 'General case' 0 N--CA 1.498 1.945 0 O-C-N 119.858 -1.776 . . . . 2.0 114.173 179.724 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 69.0 t -130.87 25.82 1.63 Allowed 'Isoleucine or valine' 0 N--CA 1.512 2.631 0 N-CA-C 114.934 1.457 . . . . 2.0 114.934 -179.584 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 42' ' ' CYS . . . . . . . . . . . . 0.283 2.8 m 81.21 114.07 0.03 OUTLIER Pre-proline 0 N--CA 1.526 3.339 1 N-CA-C 96.337 -5.431 . . . . 2.0 96.337 -179.15 . . . . . . . . 3 2 . 1 . 009 nuclear orig core ' A' A ' 43' ' ' PRO . . . . . . . . . . . . 0.472 31.5 Cg_exo -34.46 -96.52 0.0 OUTLIER 'Trans proline' 0 CA--C 1.565 2.027 1 N-CA-C 123.617 4.43 . . . . 2.0 123.617 -178.832 . . . . . . . . 3 2 . 1 . 009 nuclear orig core ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 44.7 mttm -159.28 95.86 1.27 Allowed 'General case' 0 CA--C 1.562 1.426 1 N-CA-C 98.706 -4.553 . . . . 2.0 98.706 179.696 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 45' ' ' ASN . . . . . . . . . . . . . 5.2 p-10 -72.91 -168.3 0.46 Allowed 'General case' 0 CA--C 1.572 1.812 0 N-CA-C 117.793 2.516 . . . . 2.0 117.793 -179.594 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 46' ' ' SER . . . . . . . . . . . . 0.349 5.5 t 80.79 -41.6 0.18 Allowed 'General case' 0 N--CA 1.491 1.605 0 N-CA-C 118.236 2.68 . . . . 2.0 118.236 179.907 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 47' ' ' LEU . . . . . . . . . . . . 0.252 2.7 pp -49.36 -51.1 36.83 Favored 'General case' 0 N--CA 1.508 2.473 0 CA-C-N 120.724 1.602 . . . . 2.0 113.07 179.696 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 92.3 mt -155.37 27.44 0.4 Allowed 'General case' 0 CA--C 1.589 2.444 0 C-N-CA 126.688 1.995 . . . . 2.0 108.269 179.428 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 49' ' ' VAL . . . . . . . . . . . . . 14.5 p -169.33 168.24 0.27 Allowed 'Isoleucine or valine' 0 CA--C 1.582 2.201 0 N-CA-C 118.932 2.938 . . . . 2.0 118.932 -179.139 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 28.4 ttpt -146.92 74.26 1.34 Allowed 'General case' 0 CA--C 1.581 2.141 0 N-CA-C 102.251 -3.24 . . . . 2.0 102.251 178.977 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 54.3 m-85 -53.04 126.45 20.64 Favored 'General case' 0 CA--C 1.572 1.816 0 N-CA-C 120.187 3.403 . . . . 2.0 120.187 -179.41 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 52' ' ' VAL . . . . . . . . . . . . . 55.9 t -100.43 110.86 28.43 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.853 0 N-CA-C 101.176 -3.639 . . . . 2.0 101.176 179.371 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 53' ' ' CYS . . . . . . . . . . . . 0.312 1.4 p -123.68 136.61 54.57 Favored 'General case' 0 CA--C 1.569 1.709 0 N-CA-C 118.406 2.743 . . . . 2.0 118.406 -179.211 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 54' ' ' CYS . . . . . . . . . . . . 0.307 19.6 p -128.41 124.92 37.48 Favored 'General case' 0 CA--C 1.578 2.026 0 CA-C-O 122.722 1.248 . . . . 2.0 110.533 179.75 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 12.4 p-10 -52.9 32.36 0.0 OUTLIER 'General case' 0 N--CA 1.498 1.964 1 N-CA-C 127.675 6.176 . . . . 2.0 127.675 -179.544 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 56' ' ' THR . . . . . . . . . . . . 0.256 9.4 t -150.24 170.01 20.0 Favored 'General case' 0 N--CA 1.501 2.114 0 O-C-N 119.342 -2.098 . . . . 2.0 114.238 179.95 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 57' ' ' ASP . . . . . . . . . . . . . 39.5 m-20 -62.0 118.96 7.97 Favored 'General case' 0 N--CA 1.488 1.427 0 N-CA-C 113.894 1.072 . . . . 2.0 113.894 -179.925 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 58' ' ' ARG . . . . . . . . . . . . 0.277 21.5 mtt85 65.84 18.69 11.19 Favored 'General case' 0 N--CA 1.498 1.941 0 N-CA-C 117.403 2.372 . . . . 2.0 117.403 -179.881 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 59' ' ' CYS . . . . . . . . . . . . . 48.4 t -63.78 -32.47 73.98 Favored 'General case' 0 CA--C 1.577 1.999 0 N-CA-C 116.567 2.062 . . . . 2.0 116.567 179.899 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 60' ' ' ASN . . . . . . . . . . . . . 19.6 p30 . . . . . 0 CA--C 1.566 1.566 0 CA-C-O 124.993 2.33 . . . . 2.0 114.58 179.859 . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' A' A ' 1' ' ' LEU . . . . . 0.444 HD22 ' SG ' ' A' ' 3' ' ' CYS . 6.2 tp . . . . . 0 CA--C 1.572 1.824 0 N-CA-C 114.727 1.381 . . . . 2.0 114.727 . . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 15.8 mtmm -86.77 140.96 29.21 Favored 'General case' 0 CA--C 1.576 1.946 0 O-C-N 120.993 -1.067 . . . . 2.0 108.314 179.549 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 3' ' ' CYS . . . . . 0.444 ' SG ' HD22 ' A' ' 1' ' ' LEU . 85.7 m -137.39 174.41 10.63 Favored 'General case' 0 N--CA 1.499 1.988 0 O-C-N 119.339 -2.101 . . . . 2.0 115.251 -179.906 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 60.8 m-20 -123.65 103.41 8.4 Favored 'General case' 0 CA--C 1.574 1.868 0 N-CA-C 119.119 3.007 . . . . 2.0 119.119 -179.839 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 19.2 ptmt -59.23 170.62 0.9 Allowed 'General case' 0 CA--C 1.6 2.875 0 O-C-N 119.67 -1.893 . . . . 2.0 111.934 179.264 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 4.2 mm? -31.37 -49.99 0.16 Allowed 'General case' 0 N--CA 1.511 2.58 1 N-CA-C 122.234 4.161 . . . . 2.0 122.234 -179.758 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 7' ' ' ILE . . . . . . . . . . . . . 20.9 mt -69.57 148.11 96.81 Favored Pre-proline 0 CA--C 1.584 2.258 0 N-CA-C 115.256 1.576 . . . . 2.0 115.256 -179.816 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 82.6 Cg_exo -51.47 -48.3 21.97 Favored 'Trans proline' 0 CA--C 1.574 2.475 0 C-N-CA 123.154 2.57 . . . . 2.0 117.167 179.681 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 9' ' ' ILE . . . . . . . . . . . . 0.283 11.3 tp -61.85 -46.49 96.41 Favored 'Isoleucine or valine' 0 N--CA 1.511 2.593 0 CA-C-N 119.712 1.142 . . . . 2.0 112.444 179.521 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . 54.51 175.77 0.03 OUTLIER 'General case' 0 CA--C 1.579 2.091 1 N-CA-C 126.484 5.735 . . . . 2.0 126.484 179.336 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 8.7 t -68.68 -169.99 0.19 Allowed 'General case' 0 CA--C 1.58 2.099 0 N-CA-C 118.548 2.796 . . . . 2.0 118.548 -179.833 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 12' ' ' LYS . . . . . . . . . . . . 0.297 2.5 tppp? -106.01 -90.66 0.41 Allowed 'General case' 0 CA--C 1.572 1.819 1 N-CA-C 122.967 4.432 . . . . 2.0 122.967 -179.545 . . . . . . . . 3 2 . 1 . 010 nuclear orig core ' A' A ' 13' ' ' THR . . . . . . . . . . . . . 7.8 t -154.39 165.15 37.3 Favored 'General case' 0 N--CA 1.51 2.543 1 N-CA-C 121.903 4.038 . . . . 2.0 121.903 -179.116 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -132.62 170.15 12.12 Favored Pre-proline 0 CA--C 1.599 2.854 0 C-N-CA 126.119 1.767 . . . . 2.0 108.717 179.331 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 15' ' ' PRO . . . . . . . . . . . . . 61.0 Cg_exo -59.3 -179.11 0.16 Allowed 'Trans proline' 0 CA--C 1.574 2.488 1 N-CA-C 124.941 4.939 . . . . 2.0 124.941 -179.784 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -78.83 164.12 24.76 Favored 'General case' 0 N--CA 1.5 2.04 0 N-CA-C 106.174 -1.787 . . . . 2.0 106.174 179.278 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . 84.45 -48.58 4.08 Favored Glycine 1 N--CA 1.523 4.437 0 N-CA-C 105.714 -2.954 . . . . 2.0 105.714 -178.769 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 28.4 mmtm -81.69 63.9 6.16 Favored 'General case' 0 CA--C 1.596 2.731 0 N-CA-C 102.052 -3.314 . . . . 2.0 102.052 178.698 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 45.5 p-10 -84.09 -13.59 52.64 Favored 'General case' 0 N--CA 1.487 1.397 0 N-CA-C 121.034 3.716 . . . . 2.0 121.034 -179.451 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 76.8 mt -91.14 113.84 26.21 Favored 'General case' 0 CA--C 1.553 1.087 0 CA-C-N 119.083 0.856 . . . . 2.0 111.166 179.862 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 1.8 m -80.32 94.12 6.06 Favored 'General case' 0 CA--C 1.574 1.9 0 N-CA-C 101.303 -3.592 . . . . 2.0 101.303 179.235 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 22' ' ' TYR . . . . . . . . . . . . 0.302 0.0 OUTLIER -72.26 148.13 45.77 Favored 'General case' 0 CA--C 1.551 0.993 0 N-CA-C 121.446 3.869 . . . . 2.0 121.446 -179.313 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 58.5 mttp -111.29 92.2 3.95 Favored 'General case' 0 CA--C 1.561 1.38 1 N-CA-C 99.233 -4.358 . . . . 2.0 99.233 179.249 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 24' ' ' MET . . . . . . . . . . . . . 27.9 ttt -72.24 67.99 0.72 Allowed 'General case' 0 CA--C 1.573 1.852 0 O-C-N 120.811 -1.181 . . . . 2.0 111.55 -179.873 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 25' ' ' PHE . . . . . . . . . . . . . 10.8 m-30 -57.64 131.19 49.48 Favored 'General case' 0 N--CA 1.486 1.362 0 N-CA-C 114.804 1.409 . . . . 2.0 114.804 -179.861 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 26' ' ' MET . . . . . . . . . . . . . 42.3 mtt -65.58 130.81 44.61 Favored 'General case' 0 N--CA 1.493 1.698 0 CA-C-O 118.536 -0.745 . . . . 2.0 110.74 179.778 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 27' ' ' MET . . . . . . . . . . . . . 8.6 tmm? -56.47 -35.24 67.72 Favored 'General case' 0 N--CA 1.51 2.543 0 CA-C-N 121.106 1.775 . . . . 2.0 112.131 179.561 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 49.2 m -76.32 -36.49 58.26 Favored 'General case' 0 CA--C 1.586 2.364 0 C-N-CA 124.276 1.031 . . . . 2.0 113.14 179.315 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 10.3 t0 -144.21 84.2 1.76 Allowed 'General case' 0 CA--C 1.577 1.992 0 O-C-N 120.692 -1.255 . . . . 2.0 107.766 179.794 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 1.9 mm? -48.46 -74.63 0.03 OUTLIER 'General case' 0 CA--C 1.574 1.887 0 N-CA-C 121.002 3.704 . . . . 2.0 121.002 -179.482 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 31' ' ' THR . . . . . . . . . . . . 0.283 12.2 t -18.41 -60.2 0.02 OUTLIER 'General case' 0 N--CA 1.508 2.44 0 N-CA-C 121.366 3.839 . . . . 2.0 121.366 -179.942 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 32' ' ' ILE . . . . . . . . . . . . . 1.8 mp -95.9 103.76 14.34 Favored Pre-proline 0 CA--C 1.59 2.491 0 N-CA-C 101.414 -3.551 . . . . 2.0 101.414 179.641 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 33' ' ' PRO . . . . . . . . . . . . . 55.6 Cg_endo -65.69 170.3 11.49 Favored 'Trans proline' 0 CA--C 1.56 1.791 1 N-CA-C 123.571 4.412 . . . . 2.0 123.571 -179.521 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 34' ' ' VAL . . . . . . . . . . . . . 54.9 t -73.04 -50.64 30.75 Favored 'Isoleucine or valine' 0 CA--C 1.594 2.642 0 N-CA-C 105.303 -2.11 . . . . 2.0 105.303 178.889 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 2.0 tptm -141.5 157.68 44.82 Favored 'General case' 0 CA--C 1.562 1.43 0 C-N-CA 126.618 1.967 . . . . 2.0 109.007 179.654 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 36' ' ' ARG . . . . . . . . . . . . 0.333 45.2 ttp180 -132.61 67.54 1.53 Allowed 'General case' 0 N--CA 1.498 1.937 0 N-CA-C 104.069 -2.567 . . . . 2.0 104.069 179.484 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . -94.23 -142.75 12.66 Favored Glycine 0 CA--C 1.545 1.924 1 N-CA-C 124.788 4.675 . . . . 2.0 124.788 -179.439 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 38' ' ' CYS . . . . . 0.415 ' HB2' ' SG ' ' A' ' 3' ' ' CYS 0.275 40.3 t -129.86 131.65 46.17 Favored 'General case' 0 CA--C 1.567 1.6 0 C-N-CA 125.23 1.412 . . . . 2.0 113.588 -179.575 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 39' ' ' ILE . . . . . . . . . . . . . 4.4 tp -153.75 172.95 0.68 Allowed 'Isoleucine or valine' 0 N--CA 1.504 2.23 0 N-CA-C 115.079 1.511 . . . . 2.0 115.079 -179.72 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 40' ' ' ASP . . . . . . . . . . . . . 10.1 p-10 -84.67 -54.98 4.35 Favored 'General case' 0 N--CA 1.513 2.677 0 O-C-N 119.315 -2.116 . . . . 2.0 113.683 179.694 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 73.5 t -128.34 148.39 32.83 Favored 'Isoleucine or valine' 0 CA--C 1.564 1.51 0 N-CA-C 103.16 -2.904 . . . . 2.0 103.16 179.522 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 42' ' ' CYS . . . . . . . . . . . . . 1.0 OUTLIER -61.42 105.22 0.56 Allowed Pre-proline 0 CA--C 1.603 2.988 1 N-CA-C 99.936 -4.098 . . . . 2.0 99.936 179.456 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 43' ' ' PRO . . . . . . . . . . . . 0.257 25.9 Cg_exo -49.6 175.93 0.03 OUTLIER 'Trans proline' 0 C--N 1.372 1.77 1 N-CA-C 125.23 5.05 . . . . 2.0 125.23 -178.555 . . . . . . . . 3 2 . 1 . 010 nuclear orig core ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 97.3 mttt -72.72 92.5 1.56 Allowed 'General case' 0 CA--C 1.569 1.684 0 N-CA-C 106.388 -1.708 . . . . 2.0 106.388 179.579 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 45' ' ' ASN . . . . . . . . . . . . . 2.6 p-10 -65.53 156.89 31.19 Favored 'General case' 0 CA--C 1.565 1.531 0 N-CA-C 116.429 2.011 . . . . 2.0 116.429 -179.607 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 11.3 t -132.44 -170.45 2.43 Favored 'General case' 0 N--CA 1.487 1.394 0 N-CA-C 113.614 0.968 . . . . 2.0 113.614 179.896 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 47' ' ' LEU . . . . . . . . . . . . 0.285 3.9 pp -58.41 -10.99 2.41 Favored 'General case' 0 N--CA 1.507 2.388 0 N-CA-C 117.125 2.268 . . . . 2.0 117.125 179.836 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 85.3 mt -104.57 -7.64 19.57 Favored 'General case' 0 CA--C 1.584 2.253 0 C-N-CA 126.281 1.833 . . . . 2.0 112.418 179.437 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 49' ' ' VAL . . . . . . . . . . . . . 8.1 p -156.17 164.33 1.27 Allowed 'Isoleucine or valine' 0 CA--C 1.579 2.085 0 N-CA-C 116.906 2.187 . . . . 2.0 116.906 -179.615 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 58.0 tttp -159.04 76.09 0.7 Allowed 'General case' 0 CA--C 1.577 2.015 0 N-CA-C 104.585 -2.376 . . . . 2.0 104.585 179.32 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 33.4 m-85 -51.76 126.04 16.73 Favored 'General case' 0 CA--C 1.571 1.755 1 N-CA-C 123.162 4.504 . . . . 2.0 123.162 -179.509 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 52' ' ' VAL . . . . . . . . . . . . 0.294 14.7 t -104.86 154.58 6.36 Favored 'Isoleucine or valine' 0 CA--C 1.581 2.143 0 N-CA-C 102.642 -3.095 . . . . 2.0 102.642 179.016 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 53' ' ' CYS . . . . . . . . . . . . . 1.3 p -153.0 159.94 42.96 Favored 'General case' 0 N--CA 1.496 1.857 0 O-C-N 117.851 -3.031 . . . . 2.0 118.277 -179.16 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 54' ' ' CYS . . . . . . . . . . . . . 27.6 p -145.23 120.66 10.32 Favored 'General case' 0 CA--C 1.574 1.879 0 C-N-CA 123.801 0.84 . . . . 2.0 110.358 179.784 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 16.0 m120 -55.18 12.26 0.0 OUTLIER 'General case' 0 N--CA 1.508 2.46 1 N-CA-C 124.719 5.081 . . . . 2.0 124.719 -179.618 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 56' ' ' THR . . . . . . . . . . . . 0.253 5.5 t -137.88 176.93 8.27 Favored 'General case' 0 N--CA 1.505 2.29 0 CA-C-N 123.078 2.672 . . . . 2.0 116.071 -179.91 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 57' ' ' ASP . . . . . . . . . . . . . 72.1 m-20 -63.68 121.11 13.16 Favored 'General case' 0 CA--C 1.567 1.633 0 N-CA-C 115.528 1.677 . . . . 2.0 115.528 -179.788 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 58' ' ' ARG . . . . . . . . . . . . 0.29 23.4 mtt180 59.65 14.76 4.21 Favored 'General case' 0 N--CA 1.503 2.203 0 N-CA-C 117.959 2.577 . . . . 2.0 117.959 -179.901 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 59' ' ' CYS . . . . . . . . . . . . . 29.3 p -68.0 -14.22 62.8 Favored 'General case' 0 N--CA 1.496 1.864 0 N-CA-C 118.349 2.722 . . . . 2.0 118.349 179.947 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 60' ' ' ASN . . . . . . . . . . . . . 32.5 p-10 . . . . . 0 CA--C 1.56 1.346 0 CA-C-O 125.216 2.436 . . . . 2.0 111.598 179.848 . . . . . . . . 0 0 . 1 . 011 nuclear orig core ' A' A ' 1' ' ' LEU . . . . . 0.56 HD11 ' SG ' ' A' ' 3' ' ' CYS . 0.4 OUTLIER . . . . . 0 CA--C 1.576 1.953 0 CA-C-O 122.51 1.148 . . . . 2.0 111.639 . . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 2.7 mppt? -145.0 97.74 3.06 Favored 'General case' 0 N--CA 1.486 1.371 0 N-CA-C 101.855 -3.387 . . . . 2.0 101.855 179.533 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 3' ' ' CYS . . . . . 0.56 ' SG ' HD11 ' A' ' 1' ' ' LEU . 72.6 m -105.48 -166.48 1.22 Allowed 'General case' 0 N--CA 1.49 1.562 0 N-CA-C 115.416 1.636 . . . . 2.0 115.416 -179.691 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 78.3 m-20 -126.68 121.42 32.05 Favored 'General case' 0 CA--C 1.559 1.3 0 CA-C-O 116.751 -1.595 . . . . 2.0 108.951 179.778 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 5' ' ' LYS . . . . . 0.448 ' HG2' ' H ' ' A' ' 11' ' ' SER . 0.0 OUTLIER -71.61 178.64 3.44 Favored 'General case' 0 CA--C 1.588 2.427 0 CA-C-N 123.579 2.9 . . . . 2.0 110.756 179.452 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 68.1 tp -58.41 -54.14 50.38 Favored 'General case' 0 N--CA 1.506 2.344 0 O-C-N 118.944 -2.347 . . . . 2.0 116.614 -179.768 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 7' ' ' ILE . . . . . . . . . . . . . 53.9 mt -52.21 141.71 30.31 Favored Pre-proline 0 CA--C 1.586 2.357 0 CA-C-O 117.175 -1.393 . . . . 2.0 114.515 -179.838 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 63.1 Cg_exo -39.03 -47.26 2.9 Favored 'Trans proline' 0 C--N 1.378 2.094 0 N-CA-C 120.271 3.143 . . . . 2.0 120.271 179.901 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 9' ' ' ILE . . . . . . . . . . . . . 11.3 tp -60.74 -39.55 82.08 Favored 'Isoleucine or valine' 0 N--CA 1.507 2.402 0 N-CA-C 113.932 1.086 . . . . 2.0 113.932 179.617 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . 48.55 111.34 0.0 OUTLIER 'General case' 0 CA--C 1.579 2.06 1 N-CA-C 123.97 4.804 . . . . 2.0 123.97 179.384 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 11' ' ' SER . . . . . 0.448 ' H ' ' HG2' ' A' ' 5' ' ' LYS . 98.2 p -58.05 153.45 14.57 Favored 'General case' 0 N--CA 1.501 2.082 0 C-N-CA 124.605 1.162 . . . . 2.0 114.117 179.689 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 12' ' ' LYS . . . . . . . . . . . . 0.279 81.4 tttt -90.93 -93.32 0.13 Allowed 'General case' 0 CA--C 1.581 2.165 0 N-CA-C 121.493 3.886 . . . . 2.0 121.493 -179.544 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 13' ' ' THR . . . . . . . . . . . . . 33.4 m -41.91 136.81 1.95 Allowed 'General case' 0 N--CA 1.498 1.974 0 N-CA-C 120.47 3.507 . . . . 2.0 120.47 -179.567 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 4.1 t -153.19 153.75 29.92 Favored Pre-proline 0 CA--C 1.601 2.934 0 C-N-CA 124.793 1.237 . . . . 2.0 111.226 -179.959 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 15' ' ' PRO . . . . . . . . . . . . . 65.7 Cg_exo -45.27 160.36 0.14 Allowed 'Trans proline' 0 CA--C 1.579 2.741 1 N-CA-C 126.083 5.378 . . . . 2.0 126.083 -179.819 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 16' ' ' ALA . . . . . 0.419 ' C ' ' H ' ' A' ' 18' ' ' LYS . . . -82.27 168.22 17.82 Favored 'General case' 0 N--CA 1.5 2.064 0 C-N-CA 125.177 1.391 . . . . 2.0 112.944 179.731 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . 82.96 -49.65 4.26 Favored Glycine 1 N--CA 1.522 4.374 0 N-CA-C 108.162 -1.975 . . . . 2.0 108.162 -179.01 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 18' ' ' LYS . . . . . 0.419 ' H ' ' C ' ' A' ' 16' ' ' ALA . 30.1 mmtm -72.41 94.8 1.68 Allowed 'General case' 0 CA--C 1.575 1.915 0 C-N-CA 129.32 3.048 . . . . 2.0 105.898 179.354 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 10.2 p30 -94.11 -25.03 17.33 Favored 'General case' 0 N--CA 1.498 1.932 0 N-CA-C 117.212 2.301 . . . . 2.0 117.212 179.913 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 70.2 mt -84.05 111.22 19.11 Favored 'General case' 0 CA--C 1.558 1.28 0 C-N-CA 125.596 1.558 . . . . 2.0 113.617 179.968 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 2.0 m -81.25 101.31 9.64 Favored 'General case' 0 CA--C 1.578 2.026 1 N-CA-C 99.621 -4.214 . . . . 2.0 99.621 179.158 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 22' ' ' TYR . . . . . . . . . . . . . 5.8 p90 -83.66 164.26 19.78 Favored 'General case' 0 N--CA 1.48 1.074 0 N-CA-C 120.843 3.646 . . . . 2.0 120.843 -179.31 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 23' ' ' LYS . . . . . . . . . . . . 0.303 10.6 ptpp? -137.66 101.87 4.59 Favored 'General case' 0 CA--C 1.566 1.577 0 N-CA-C 104.389 -2.448 . . . . 2.0 104.389 179.306 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 24' ' ' MET . . . . . . . . . . . . . 4.7 ttt -65.41 92.8 0.13 Allowed 'General case' 0 CA--C 1.563 1.442 0 C-N-CA 125.149 1.38 . . . . 2.0 114.07 -179.803 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 25' ' ' PHE . . . . . . . . . . . . . 5.3 m-30 -81.61 104.14 11.82 Favored 'General case' 0 CA--C 1.568 1.636 0 N-CA-C 103.853 -2.647 . . . . 2.0 103.853 179.491 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 26' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -57.09 127.72 33.37 Favored 'General case' 0 N--CA 1.494 1.753 0 O-C-N 120.797 -1.189 . . . . 2.0 112.279 -179.809 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 27' ' ' MET . . . . . . . . . . . . . 0.1 OUTLIER -48.82 -32.74 9.24 Favored 'General case' 0 N--CA 1.509 2.496 0 N-CA-C 116.613 2.079 . . . . 2.0 116.613 -179.944 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 50.5 m -75.03 -30.61 61.13 Favored 'General case' 0 CA--C 1.592 2.594 0 O-C-N 121.512 -0.743 . . . . 2.0 112.238 179.162 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 56.5 t0 -151.04 92.2 1.79 Allowed 'General case' 0 CA--C 1.571 1.769 0 N-CA-C 105.083 -2.191 . . . . 2.0 105.083 179.687 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 3.2 mm? -65.56 -66.7 0.51 Allowed 'General case' 0 CA--C 1.571 1.769 0 N-CA-C 118.837 2.903 . . . . 2.0 118.837 -179.526 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 31' ' ' THR . . . . . . . . . . . . . 72.1 p -33.83 -48.44 0.29 Allowed 'General case' 0 N--CA 1.506 2.355 0 N-CA-C 120.457 3.503 . . . . 2.0 120.457 -179.704 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 32' ' ' ILE . . . . . . . . . . . . . 2.1 mp -93.96 107.27 26.88 Favored Pre-proline 0 CA--C 1.586 2.356 0 N-CA-C 101.606 -3.479 . . . . 2.0 101.606 179.554 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 33' ' ' PRO . . . . . . . . . . . . . 12.6 Cg_exo -68.79 149.08 72.55 Favored 'Trans proline' 0 CA--C 1.561 1.842 0 N-CA-C 118.383 2.417 . . . . 2.0 118.383 -179.602 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 34' ' ' VAL . . . . . . . . . . . . 0.283 24.5 t -86.75 -29.77 5.88 Favored 'Isoleucine or valine' 0 CA--C 1.583 2.249 0 C-N-CA 123.579 0.751 . . . . 2.0 111.543 179.421 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER -144.81 167.02 23.58 Favored 'General case' 0 CA--C 1.559 1.317 0 CA-C-O 123.602 1.668 . . . . 2.0 110.067 179.453 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 6.6 mtp180 -150.69 108.89 3.75 Favored 'General case' 0 CA--C 1.571 1.773 0 N-CA-C 104.814 -2.291 . . . . 2.0 104.814 -179.867 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . -140.97 -144.58 4.46 Favored Glycine 0 N--CA 1.498 2.824 0 N-CA-C 118.393 2.117 . . . . 2.0 118.393 -179.697 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 38' ' ' CYS . . . . . . . . . . . . . 20.8 p -130.93 131.99 44.81 Favored 'General case' 0 N--CA 1.494 1.738 0 N-CA-C 113.653 0.983 . . . . 2.0 113.653 179.99 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 39' ' ' ILE . . . . . . . . . . . . . 9.6 tp -152.85 175.83 0.58 Allowed 'Isoleucine or valine' 0 N--CA 1.498 1.969 0 C-N-CA 124.182 0.993 . . . . 2.0 112.751 -179.839 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 40' ' ' ASP . . . . . . . . . . . . . 13.3 p-10 -108.02 -28.88 9.3 Favored 'General case' 0 N--CA 1.497 1.908 0 O-C-N 119.527 -1.983 . . . . 2.0 113.53 179.354 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 8.0 t -140.35 27.54 0.48 Allowed 'Isoleucine or valine' 0 N--CA 1.506 2.334 0 CA-C-N 120.134 1.334 . . . . 2.0 112.649 179.952 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 42' ' ' CYS . . . . . . . . . . . . 0.359 2.8 m 77.11 115.75 0.03 OUTLIER Pre-proline 0 CA--C 1.615 3.469 1 N-CA-C 97.03 -5.174 . . . . 2.0 97.03 -179.221 . . . . . . . . 3 2 . 1 . 011 nuclear orig core ' A' A ' 43' ' ' PRO . . . . . . . . . . . . 0.45 80.0 Cg_exo -30.06 -60.06 0.13 Allowed 'Trans proline' 0 C--N 1.371 1.745 1 N-CA-C 127.799 6.038 . . . . 2.0 127.799 -178.484 . . . . . . . . 3 2 . 1 . 011 nuclear orig core ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 9.1 mtmm 160.78 91.14 0.0 OUTLIER 'General case' 0 CA--C 1.561 1.373 1 N-CA-C 98.512 -4.625 . . . . 2.0 98.512 -179.879 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 45' ' ' ASN . . . . . . . . . . . . . 4.6 p-10 -66.02 113.76 4.68 Favored 'General case' 0 CA--C 1.572 1.798 0 N-CA-C 114.759 1.392 . . . . 2.0 114.759 -179.713 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 10.8 t -113.02 -169.96 1.58 Allowed 'General case' 0 N--CA 1.492 1.669 0 N-CA-C 114.09 1.145 . . . . 2.0 114.09 -179.947 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 47' ' ' LEU . . . . . . . . . . . . . 6.7 mp -54.77 -16.33 2.5 Favored 'General case' 0 N--CA 1.509 2.492 0 N-CA-C 116.984 2.216 . . . . 2.0 116.984 179.803 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 74.6 mt -103.98 -3.49 24.59 Favored 'General case' 0 CA--C 1.578 2.046 0 C-N-CA 125.577 1.551 . . . . 2.0 112.366 179.456 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 49' ' ' VAL . . . . . . . . . . . . . 7.2 p -166.91 150.78 1.56 Allowed 'Isoleucine or valine' 0 N--CA 1.5 2.071 0 N-CA-C 118.114 2.635 . . . . 2.0 118.114 -179.645 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 55.7 tttp -134.1 111.06 10.03 Favored 'General case' 0 CA--C 1.571 1.781 1 N-CA-C 98.259 -4.719 . . . . 2.0 98.259 179.391 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 86.8 m-85 -92.3 122.31 34.65 Favored 'General case' 0 N--CA 1.497 1.917 0 N-CA-C 118.573 2.805 . . . . 2.0 118.573 -179.353 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 52' ' ' VAL . . . . . . . . . . . . . 53.3 t -92.6 106.25 17.64 Favored 'Isoleucine or valine' 0 N--CA 1.503 2.208 0 N-CA-C 102.982 -2.97 . . . . 2.0 102.982 179.522 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 53' ' ' CYS . . . . . . . . . . . . 0.261 0.7 OUTLIER -108.16 139.32 43.01 Favored 'General case' 0 CA--C 1.575 1.923 0 N-CA-C 118.988 2.958 . . . . 2.0 118.988 -179.323 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 54' ' ' CYS . . . . . . . . . . . . . 30.0 p -127.71 118.83 24.54 Favored 'General case' 0 CA--C 1.575 1.922 0 C-N-CA 124.035 0.934 . . . . 2.0 110.834 179.821 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 4.8 p-10 -57.11 37.61 0.0 OUTLIER 'General case' 0 N--CA 1.508 2.463 1 N-CA-C 124.981 5.178 . . . . 2.0 124.981 -179.584 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 6.3 t -158.55 174.33 15.24 Favored 'General case' 0 N--CA 1.503 2.21 0 O-C-N 119.326 -2.109 . . . . 2.0 114.168 179.939 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 57' ' ' ASP . . . . . . . . . . . . . 69.4 m-20 -66.94 129.56 40.28 Favored 'General case' 0 CA--C 1.571 1.782 0 O-C-N 120.325 -1.485 . . . . 2.0 114.82 179.932 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 58' ' ' ARG . . . . . . . . . . . . 0.332 40.1 mtp85 52.19 24.71 2.91 Favored 'General case' 0 N--CA 1.499 2.008 0 N-CA-C 118.726 2.862 . . . . 2.0 118.726 179.917 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 59' ' ' CYS . . . . . . . . . . . . . 29.2 p -77.37 -19.89 55.57 Favored 'General case' 0 CA--C 1.579 2.06 0 O-C-N 120.668 -1.27 . . . . 2.0 114.352 179.608 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 60' ' ' ASN . . . . . . . . . . . . . 34.9 p-10 . . . . . 0 CA--C 1.563 1.473 0 CA-C-O 124.392 2.044 . . . . 2.0 113.525 179.881 . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' A' A ' 1' ' ' LEU . . . . . 0.47 ' C ' ' H ' ' A' ' 14' ' ' CYS . 3.4 tm? . . . . . 0 N--CA 1.495 1.782 0 CA-C-O 117.023 -1.465 . . . . 2.0 111.804 . . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 54.7 tptt -119.84 -55.31 2.1 Favored 'General case' 0 N--CA 1.514 2.757 0 CA-C-N 121.886 2.13 . . . . 2.0 109.181 179.656 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 3' ' ' CYS . . . . . . . . . . . . 0.312 1.9 m 76.6 -172.87 0.09 Allowed 'General case' 0 CA--C 1.563 1.471 0 N-CA-C 114.38 1.252 . . . . 2.0 114.38 -179.9 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 79.5 m-20 -91.05 152.48 20.63 Favored 'General case' 0 CA--C 1.55 0.955 0 N-CA-C 115.312 1.597 . . . . 2.0 115.312 -179.803 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 18.3 ptpt -90.84 -156.91 0.46 Allowed 'General case' 0 CA--C 1.579 2.087 0 N-CA-C 104.913 -2.254 . . . . 2.0 104.913 179.103 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 3.8 mm? -54.9 -34.0 62.6 Favored 'General case' 0 N--CA 1.512 2.637 0 O-C-N 117.679 -3.138 . . . . 2.0 115.154 179.665 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 7' ' ' ILE . . . . . . . . . . . . . 35.1 mt -75.74 141.43 72.21 Favored Pre-proline 0 CA--C 1.586 2.329 0 C-N-CA 125.312 1.445 . . . . 2.0 112.426 179.871 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 77.4 Cg_exo -55.94 -40.13 86.92 Favored 'Trans proline' 0 CA--C 1.57 2.321 0 C-N-CA 122.836 2.357 . . . . 2.0 117.964 179.596 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 9' ' ' ILE . . . . . . . . . . . . . 10.7 tp -97.75 93.04 3.13 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.726 0 C-N-CA 124.144 0.977 . . . . 2.0 111.083 179.969 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . 0.466 . . -133.71 -166.97 1.86 Allowed 'General case' 0 CA--C 1.583 2.223 0 N-CA-C 114.828 1.418 . . . . 2.0 114.828 179.991 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 11' ' ' SER . . . . . . . . . . . . 0.368 2.0 t -43.66 165.69 0.01 OUTLIER 'General case' 0 CA--C 1.586 2.34 1 N-CA-C 127.027 5.936 . . . . 2.0 127.027 -179.351 . . . . . . . . 3 2 . 1 . 001 nuclear orig full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 1.6 ttmp? -105.99 -74.96 0.64 Allowed 'General case' 0 CA--C 1.577 2.008 0 N-CA-C 121.475 3.88 . . . . 2.0 121.475 -179.545 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 13' ' ' THR . . . . . . . . . . . . . 14.9 t -135.22 124.32 24.37 Favored 'General case' 0 N--CA 1.506 2.33 0 N-CA-C 121.741 3.978 . . . . 2.0 121.741 -179.374 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 14' ' ' CYS . . . . . 0.539 ' SG ' ' HD2' ' A' ' 18' ' ' LYS . 0.5 OUTLIER -106.5 171.94 4.33 Favored Pre-proline 0 CA--C 1.599 2.863 0 C-N-CA 126.613 1.965 . . . . 2.0 108.938 179.493 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 15' ' ' PRO . . . . . . . . . . . . . 83.5 Cg_exo -49.04 174.63 0.03 OUTLIER 'Trans proline' 0 CA--C 1.57 2.288 1 N-CA-C 124.474 4.759 . . . . 2.0 124.474 -179.722 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . 32.82 -172.87 0.0 OUTLIER 'General case' 0 N--CA 1.5 2.065 1 N-CA-C 123.558 4.651 . . . . 2.0 123.558 179.734 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . -82.59 38.71 2.65 Favored Glycine 0 N--CA 1.502 3.092 0 O-C-N 120.296 -1.503 . . . . 2.0 113.861 179.459 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 18' ' ' LYS . . . . . 0.539 ' HD2' ' SG ' ' A' ' 14' ' ' CYS . 0.1 OUTLIER -82.91 74.63 9.85 Favored 'General case' 0 CA--C 1.566 1.573 0 C-N-CA 125.546 1.538 . . . . 2.0 109.059 179.902 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 7.8 p30 -57.18 -36.65 71.06 Favored 'General case' 0 N--CA 1.487 1.403 1 N-CA-C 122.821 4.378 . . . . 2.0 122.821 -179.626 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 88.2 mt -70.18 122.96 20.48 Favored 'General case' 0 CA--C 1.558 1.251 0 N-CA-C 117.209 2.3 . . . . 2.0 117.209 -179.801 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 21' ' ' CYS . . . . . 0.562 ' SG ' ' O ' ' A' ' 56' ' ' THR . 32.1 m -82.91 95.34 7.94 Favored 'General case' 0 CA--C 1.566 1.565 0 N-CA-C 102.516 -3.142 . . . . 2.0 102.516 179.314 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 22' ' ' TYR . . . . . . . . . . . . 0.442 0.0 OUTLIER -61.57 153.17 28.44 Favored 'General case' 0 CA--C 1.554 1.12 0 N-CA-C 118.018 2.599 . . . . 2.0 118.018 -179.478 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 39.2 ttmt -133.98 76.67 1.67 Allowed 'General case' 0 CA--C 1.563 1.442 0 N-CA-C 103.373 -2.825 . . . . 2.0 103.373 179.584 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 24' ' ' MET . . . . . . . . . . . . 0.262 5.9 ttt -63.17 78.67 0.02 OUTLIER 'General case' 0 CA--C 1.567 1.609 0 C-N-CA 126.037 1.735 . . . . 2.0 113.968 -179.838 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 25' ' ' PHE . . . . . . . . . . . . . 13.9 m-85 -72.35 147.37 46.35 Favored 'General case' 0 N--CA 1.485 1.318 0 N-CA-C 113.784 1.031 . . . . 2.0 113.784 179.976 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 26' ' ' MET . . . . . . . . . . . . . 73.4 mtp -72.04 127.16 31.68 Favored 'General case' 0 N--CA 1.493 1.696 0 O-C-N 121.307 -0.871 . . . . 2.0 108.85 179.51 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 27' ' ' MET . . . . . . . . . . . . . 27.9 ttt -55.76 -36.45 67.32 Favored 'General case' 0 N--CA 1.513 2.708 0 CA-C-N 121.621 2.01 . . . . 2.0 111.717 179.365 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 73.2 m -76.85 -29.6 55.93 Favored 'General case' 0 CA--C 1.585 2.308 0 N-CA-C 114.163 1.172 . . . . 2.0 114.163 179.324 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 8.9 t70 -150.76 81.12 1.34 Allowed 'General case' 0 CA--C 1.57 1.748 0 O-C-N 120.174 -1.579 . . . . 2.0 108.558 179.695 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 1.8 mm? -45.79 -75.98 0.03 OUTLIER 'General case' 0 CA--C 1.575 1.927 0 N-CA-C 120.688 3.588 . . . . 2.0 120.688 -179.507 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 31' ' ' THR . . . . . . . . . . . . 0.259 43.4 p -6.71 -66.87 0.0 OUTLIER 'General case' 0 N--CA 1.506 2.341 1 N-CA-C 122.511 4.263 . . . . 2.0 122.511 -179.735 . . . . . . . . 3 2 . 1 . 001 nuclear orig full ' A' A ' 32' ' ' ILE . . . . . . . . . . . . . 2.0 mp -99.04 106.89 40.96 Favored Pre-proline 0 CA--C 1.584 2.265 0 N-CA-C 102.173 -3.269 . . . . 2.0 102.173 179.726 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 33' ' ' PRO . . . . . . . . . . . . . 21.5 Cg_exo -59.39 166.02 8.34 Favored 'Trans proline' 0 CA--C 1.559 1.753 1 N-CA-C 123.744 4.478 . . . . 2.0 123.744 -179.658 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 34' ' ' VAL . . . . . . . . . . . . . 78.7 t -76.14 -51.67 19.47 Favored 'Isoleucine or valine' 0 CA--C 1.592 2.57 0 N-CA-C 103.125 -2.917 . . . . 2.0 103.125 178.637 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 59.9 mttm -143.43 167.52 21.99 Favored 'General case' 0 CA--C 1.564 1.494 0 CA-C-O 125.574 2.606 . . . . 2.0 108.652 179.451 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 9.1 mtp180 -142.88 119.56 11.13 Favored 'General case' 0 CA--C 1.582 2.191 1 N-CA-C 98.184 -4.747 . . . . 2.0 98.184 179.7 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . -157.8 -134.84 1.8 Allowed Glycine 0 N--CA 1.488 2.107 0 O-C-N 118.942 -2.349 . . . . 2.0 118.891 -179.44 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 38' ' ' CYS . . . . . . . . . . . . . 26.9 p -123.23 138.92 54.52 Favored 'General case' 0 N--CA 1.489 1.51 0 N-CA-C 117.421 2.378 . . . . 2.0 117.421 -179.821 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 39' ' ' ILE . . . . . . . . . . . . . 2.2 tp -164.65 159.01 1.29 Allowed 'Isoleucine or valine' 0 CA--C 1.576 1.959 0 N-CA-C 115.312 1.597 . . . . 2.0 115.312 -179.909 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 40' ' ' ASP . . . . . . . . . . . . . 9.3 p-10 -78.69 -48.14 15.58 Favored 'General case' 0 N--CA 1.506 2.363 0 O-C-N 119.751 -1.843 . . . . 2.0 114.313 179.595 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 91.2 t -135.83 144.02 34.7 Favored 'Isoleucine or valine' 0 CA--C 1.56 1.346 0 N-CA-C 102.972 -2.973 . . . . 2.0 102.972 179.703 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 42' ' ' CYS . . . . . . . . . . . . . 0.8 OUTLIER -58.37 105.49 0.55 Allowed Pre-proline 0 CA--C 1.603 3.01 0 N-CA-C 101.401 -3.555 . . . . 2.0 101.401 179.578 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 43' ' ' PRO . . . . . . . . . . . . . 24.7 Cg_exo -50.18 177.92 0.03 OUTLIER 'Trans proline' 0 C--N 1.372 1.811 1 N-CA-C 125.105 5.002 . . . . 2.0 125.105 -178.571 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 9.7 mtmp? -70.14 92.22 0.74 Allowed 'General case' 0 CA--C 1.566 1.589 0 N-CA-C 105.511 -2.033 . . . . 2.0 105.511 179.534 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 45' ' ' ASN . . . . . . . . . . . . . 2.5 p-10 -60.06 114.05 2.65 Favored 'General case' 0 CA--C 1.567 1.601 0 N-CA-C 116.73 2.122 . . . . 2.0 116.73 -179.402 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 7.8 t -80.09 -178.03 6.33 Favored 'General case' 0 CA--C 1.567 1.608 0 N-CA-C 114.667 1.358 . . . . 2.0 114.667 179.968 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 47' ' ' LEU . . . . . . . . . . . . . 97.4 mt -51.74 -28.34 14.8 Favored 'General case' 0 N--CA 1.505 2.309 0 N-CA-C 115.955 1.835 . . . . 2.0 115.955 179.777 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 79.1 mt -101.84 7.44 41.64 Favored 'General case' 0 CA--C 1.581 2.14 0 N-CA-C 114.518 1.303 . . . . 2.0 114.518 179.735 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 49' ' ' VAL . . . . . . . . . . . . . 13.9 p -148.14 159.67 7.4 Favored 'Isoleucine or valine' 0 N--CA 1.5 2.067 0 CA-C-N 122.195 2.27 . . . . 2.0 117.127 -179.518 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 13.3 tmtt? -155.27 86.65 1.09 Allowed 'General case' 0 CA--C 1.573 1.84 0 N-CA-C 101.625 -3.472 . . . . 2.0 101.625 179.562 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 36.7 m-85 -69.56 127.32 32.58 Favored 'General case' 0 CA--C 1.57 1.735 0 N-CA-C 121.442 3.867 . . . . 2.0 121.442 -179.297 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 52' ' ' VAL . . . . . . . . . . . . 0.323 8.6 t -99.51 162.51 2.98 Favored 'Isoleucine or valine' 0 CA--C 1.586 2.349 0 N-CA-C 102.574 -3.121 . . . . 2.0 102.574 178.881 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 53' ' ' CYS . . . . . . . . . . . . 0.318 1.2 p -166.2 153.47 9.83 Favored 'General case' 0 N--CA 1.495 1.801 0 O-C-N 117.388 -3.32 . . . . 2.0 117.993 -179.046 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 54' ' ' CYS . . . . . . . . . . . . 0.389 23.2 p -151.13 117.61 5.71 Favored 'General case' 0 CA--C 1.583 2.25 0 CA-C-O 122.946 1.355 . . . . 2.0 111.694 179.412 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 9.7 m120 -30.27 -0.8 0.0 OUTLIER 'General case' 0 CA--C 1.582 2.19 1 N-CA-C 129.681 6.919 . . . . 2.0 129.681 -179.596 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 56' ' ' THR . . . . . 0.562 ' O ' ' SG ' ' A' ' 21' ' ' CYS . 7.2 t -143.46 160.85 39.83 Favored 'General case' 0 N--CA 1.515 2.782 0 CA-C-N 125.564 3.802 . . . . 2.0 116.225 -179.747 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 57' ' ' ASP . . . . . . . . . . . . . 44.1 m-20 -46.27 104.07 0.05 OUTLIER 'General case' 0 N--CA 1.503 2.203 0 N-CA-C 118.416 2.747 . . . . 2.0 118.416 -179.783 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 58' ' ' ARG . . . . . . . . . . . . 0.315 27.7 mtm180 82.27 16.8 0.39 Allowed 'General case' 0 N--CA 1.507 2.405 0 C-N-CA 125.481 1.512 . . . . 2.0 115.057 -179.695 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 59' ' ' CYS . . . . . . . . . . . . . 34.0 t -63.84 -26.34 68.57 Favored 'General case' 0 CA--C 1.58 2.11 0 N-CA-C 115.148 1.536 . . . . 2.0 115.148 179.689 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 60' ' ' ASN . . . . . . . . . . . . . 51.2 p30 . . . . . 0 CA--C 1.568 1.652 0 CA-C-O 124.309 2.004 . . . . 2.0 114.975 179.837 . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' A' A ' 1' ' ' LEU . . . . . 0.454 HD22 ' SG ' ' A' ' 3' ' ' CYS . 14.2 tp . . . . . 0 CA--C 1.567 1.597 0 N-CA-C 113.883 1.068 . . . . 2.0 113.883 . . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 27.5 mtpt -89.87 130.33 36.11 Favored 'General case' 0 CA--C 1.571 1.776 0 N-CA-C 106.118 -1.808 . . . . 2.0 106.118 179.399 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 3' ' ' CYS . . . . . 0.454 ' SG ' HD22 ' A' ' 1' ' ' LEU . 90.8 m -131.75 -171.44 2.62 Favored 'General case' 0 N--CA 1.499 2.012 0 O-C-N 119.374 -2.079 . . . . 2.0 113.935 -179.84 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 77.9 m-20 -135.83 118.92 16.46 Favored 'General case' 0 CA--C 1.558 1.262 0 C-N-CA 123.562 0.745 . . . . 2.0 112.789 179.943 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -71.14 177.12 3.96 Favored 'General case' 0 CA--C 1.594 2.65 0 CA-C-N 120.34 1.427 . . . . 2.0 110.438 179.209 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 32.1 mt -48.72 -43.45 37.31 Favored 'General case' 0 N--CA 1.514 2.758 0 N-CA-C 119.394 3.109 . . . . 2.0 119.394 -179.84 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 7' ' ' ILE . . . . . . . . . . . . . 46.4 mm -35.62 139.11 0.39 Allowed Pre-proline 0 CA--C 1.583 2.214 0 N-CA-C 116.636 2.088 . . . . 2.0 116.636 -179.87 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 49.4 Cg_exo -37.39 -51.94 1.56 Allowed 'Trans proline' 0 CA--C 1.565 2.055 0 C-N-CA 123.673 2.916 . . . . 2.0 118.729 -179.961 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 9' ' ' ILE . . . . . . . . . . . . 0.31 17.4 tt -84.63 -71.69 0.41 Allowed 'Isoleucine or valine' 0 N--CA 1.496 1.852 0 N-CA-C 107.745 -1.206 . . . . 2.0 107.745 179.471 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . 58.76 137.55 0.01 OUTLIER 'General case' 0 CA--C 1.574 1.887 0 N-CA-C 119.447 3.128 . . . . 2.0 119.447 179.639 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 38.8 t -147.99 -143.61 0.14 Allowed 'General case' 0 CA--C 1.581 2.158 0 O-C-N 120.32 -1.487 . . . . 2.0 111.644 -179.943 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . 0.369 3.9 ttmt 92.14 174.98 0.02 OUTLIER 'General case' 0 N--CA 1.503 2.188 0 C-N-CA 126.061 1.745 . . . . 2.0 115.172 -179.915 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 13' ' ' THR . . . . . . . . . . . . . 84.9 m -152.66 149.59 28.58 Favored 'General case' 0 N--CA 1.495 1.807 0 N-CA-C 114.007 1.114 . . . . 2.0 114.007 -179.689 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 14' ' ' CYS . . . . . . . . . . . . 0.295 0.1 OUTLIER -134.16 176.97 2.48 Favored Pre-proline 0 CA--C 1.599 2.85 0 C-N-CA 124.545 1.138 . . . . 2.0 109.625 179.398 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 15' ' ' PRO . . . . . . . . . . . . . 88.0 Cg_exo -52.99 172.2 0.2 Allowed 'Trans proline' 0 CA--C 1.572 2.422 1 N-CA-C 126.232 5.435 . . . . 2.0 126.232 -179.64 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -78.56 169.97 17.4 Favored 'General case' 0 N--CA 1.498 1.938 0 N-CA-C 107.965 -1.124 . . . . 2.0 107.965 179.247 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . 83.79 -50.41 4.4 Favored Glycine 1 N--CA 1.519 4.201 0 O-C-N 118.295 -2.753 . . . . 2.0 106.942 -178.953 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 73.9 mmtt -78.76 71.62 5.23 Favored 'General case' 0 CA--C 1.581 2.168 0 N-CA-C 104.259 -2.497 . . . . 2.0 104.259 179.105 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 8.5 p30 -82.15 -21.48 36.56 Favored 'General case' 0 N--CA 1.49 1.571 1 N-CA-C 121.928 4.047 . . . . 2.0 121.928 -179.513 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 86.0 mt -88.16 119.54 28.65 Favored 'General case' 0 CA--C 1.553 1.087 0 N-CA-C 113.298 0.851 . . . . 2.0 113.298 -179.934 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 4.5 m -83.96 100.82 11.28 Favored 'General case' 0 CA--C 1.58 2.131 1 N-CA-C 99.664 -4.198 . . . . 2.0 99.664 179.198 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 22' ' ' TYR . . . . . . . . . . . . . 4.7 p90 -75.45 159.58 31.19 Favored 'General case' 0 CA--C 1.556 1.181 0 N-CA-C 119.505 3.15 . . . . 2.0 119.505 -179.349 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 29.4 ttpt -139.03 98.65 3.58 Favored 'General case' 0 CA--C 1.565 1.556 0 N-CA-C 103.219 -2.882 . . . . 2.0 103.219 179.567 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 24' ' ' MET . . . . . 0.531 ' SD ' ' HB2' ' A' ' 35' ' ' LYS . 13.6 ttm -69.73 74.93 0.43 Allowed 'General case' 0 CA--C 1.57 1.737 0 N-CA-C 114.805 1.409 . . . . 2.0 114.805 -179.76 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 25' ' ' PHE . . . . . . . . . . . . . 4.5 m-30 -62.48 128.09 34.36 Favored 'General case' 0 N--CA 1.497 1.917 0 O-C-N 120.431 -1.418 . . . . 2.0 112.121 179.821 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 26' ' ' MET . . . . . . . . . . . . . 76.5 mtp -57.31 129.32 41.25 Favored 'General case' 0 N--CA 1.497 1.886 0 N-CA-C 114.305 1.224 . . . . 2.0 114.305 179.895 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 27' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -59.09 -39.42 82.12 Favored 'General case' 0 N--CA 1.512 2.644 0 CA-C-N 120.985 1.72 . . . . 2.0 110.742 179.381 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 48.9 m -68.75 -34.35 75.44 Favored 'General case' 0 CA--C 1.584 2.281 0 N-CA-C 113.647 0.981 . . . . 2.0 113.647 179.368 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 8.9 t70 -155.47 84.49 1.05 Allowed 'General case' 0 CA--C 1.572 1.794 0 O-C-N 120.631 -1.293 . . . . 2.0 109.343 179.671 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 2.3 mm? -44.43 -41.51 6.3 Favored 'General case' 0 CA--C 1.574 1.887 0 N-CA-C 120.76 3.615 . . . . 2.0 120.76 -179.776 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 31' ' ' THR . . . . . . . . . . . . . 43.3 p -41.06 -54.82 2.73 Favored 'General case' 0 N--CA 1.502 2.138 0 N-CA-C 119.587 3.18 . . . . 2.0 119.587 -179.784 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 32' ' ' ILE . . . . . . . . . . . . . 2.1 mp -96.61 114.63 64.81 Favored Pre-proline 0 CA--C 1.586 2.34 0 N-CA-C 106.7 -1.593 . . . . 2.0 106.7 179.914 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 33' ' ' PRO . . . . . . . . . . . . . 13.3 Cg_exo -70.29 151.0 65.84 Favored 'Trans proline' 0 CA--C 1.572 2.422 0 N-CA-C 119.261 2.754 . . . . 2.0 119.261 -179.871 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 34' ' ' VAL . . . . . . . . . . . . . 60.9 t -79.14 -38.75 20.63 Favored 'Isoleucine or valine' 0 N--CA 1.509 2.489 0 C-N-CA 124.397 1.079 . . . . 2.0 111.119 179.445 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 35' ' ' LYS . . . . . 0.531 ' HB2' ' SD ' ' A' ' 24' ' ' MET . 18.1 tptt -147.93 170.32 17.95 Favored 'General case' 0 CA--C 1.559 1.295 0 CA-C-O 123.986 1.85 . . . . 2.0 110.151 179.817 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 36' ' ' ARG . . . . . . . . . . . . 0.269 7.2 ttp180 -148.21 114.27 5.81 Favored 'General case' 0 CA--C 1.575 1.939 0 N-CA-C 101.423 -3.547 . . . . 2.0 101.423 -179.906 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . -145.65 -148.99 4.91 Favored Glycine 0 N--CA 1.496 2.694 0 N-CA-C 119.793 2.677 . . . . 2.0 119.793 -179.561 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 38' ' ' CYS . . . . . . . . . . . . . 13.6 p -126.42 137.27 53.4 Favored 'General case' 0 CA--C 1.571 1.752 0 C-N-CA 123.89 0.876 . . . . 2.0 112.064 179.933 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 39' ' ' ILE . . . . . . . . . . . . . 10.5 tp -165.03 165.77 0.55 Allowed 'Isoleucine or valine' 0 N--CA 1.509 2.494 0 O-C-N 120.595 -1.316 . . . . 2.0 113.997 -179.703 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 40' ' ' ASP . . . . . . . . . . . . . 7.9 p-10 -79.31 -46.95 16.7 Favored 'General case' 0 N--CA 1.505 2.29 0 O-C-N 119.283 -2.136 . . . . 2.0 114.471 179.493 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 80.5 t -130.75 152.03 36.87 Favored 'Isoleucine or valine' 0 CA--C 1.576 1.965 0 C-N-CA 127.134 2.174 . . . . 2.0 105.275 179.644 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 42' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -52.59 111.01 2.23 Favored Pre-proline 0 N--CA 1.526 3.332 0 N-CA-C 102.745 -3.057 . . . . 2.0 102.745 179.359 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 43' ' ' PRO . . . . . . . . . . . . 0.548 71.7 Cg_exo -11.94 -109.4 0.0 OUTLIER 'Trans proline' 0 C--N 1.378 2.079 2 C-N-CA 125.799 4.332 . . . . 2.0 123.02 -178.408 . . . . . . . . 3 2 . 1 . 002 nuclear orig full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 6.0 mtmp? -159.8 95.28 1.18 Allowed 'General case' 0 CA--C 1.556 1.183 1 N-CA-C 96.68 -5.304 . . . . 2.0 96.68 179.691 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 45' ' ' ASN . . . . . . . . . . . . . 2.8 p-10 -62.66 97.47 0.1 Allowed 'General case' 0 CA--C 1.575 1.912 0 N-CA-C 116.404 2.001 . . . . 2.0 116.404 -179.522 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 13.7 t -79.64 -179.18 6.74 Favored 'General case' 0 CA--C 1.567 1.615 0 N-CA-C 114.35 1.241 . . . . 2.0 114.35 179.981 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 47' ' ' LEU . . . . . . . . . . . . 0.385 1.3 pp -54.52 -15.66 1.88 Allowed 'General case' 0 N--CA 1.509 2.521 0 N-CA-C 117.938 2.57 . . . . 2.0 117.938 179.819 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 84.5 mt -104.29 3.49 32.64 Favored 'General case' 0 CA--C 1.59 2.501 0 C-N-CA 125.463 1.505 . . . . 2.0 111.471 179.133 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 49' ' ' VAL . . . . . . . . . . . . . 6.7 p -157.7 156.09 4.43 Favored 'Isoleucine or valine' 0 CA--C 1.579 2.082 0 N-CA-C 118.439 2.755 . . . . 2.0 118.439 -179.584 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -145.81 72.37 1.3 Allowed 'General case' 0 CA--C 1.584 2.258 0 N-CA-C 103.143 -2.91 . . . . 2.0 103.143 179.097 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 97.2 m-85 -44.88 133.72 6.09 Favored 'General case' 0 CA--C 1.574 1.896 0 N-CA-C 120.402 3.482 . . . . 2.0 120.402 -179.498 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 52' ' ' VAL . . . . . . . . . . . . . 40.6 t -115.9 103.02 14.55 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.897 0 N-CA-C 103.081 -2.933 . . . . 2.0 103.081 179.726 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 53' ' ' CYS . . . . . . . . . . . . 0.255 4.2 m -121.11 153.65 37.19 Favored 'General case' 0 CA--C 1.569 1.695 0 N-CA-C 117.881 2.548 . . . . 2.0 117.881 -179.6 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 54' ' ' CYS . . . . . . . . . . . . 0.351 8.6 p -141.73 127.69 19.46 Favored 'General case' 0 CA--C 1.577 2.019 0 CA-C-O 122.427 1.108 . . . . 2.0 111.065 179.703 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 4.7 p-10 -53.15 36.24 0.0 OUTLIER 'General case' 0 N--CA 1.5 2.062 1 N-CA-C 125.8 5.481 . . . . 2.0 125.8 -179.56 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 56' ' ' THR . . . . . . . . . . . . 0.253 7.2 t -153.8 170.88 19.9 Favored 'General case' 0 N--CA 1.499 2.022 0 O-C-N 119.443 -2.035 . . . . 2.0 114.424 179.968 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 57' ' ' ASP . . . . . . . . . . . . . 73.3 m-20 -60.98 117.96 6.13 Favored 'General case' 0 CA--C 1.563 1.444 0 N-CA-C 114.487 1.291 . . . . 2.0 114.487 -179.807 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 58' ' ' ARG . . . . . . . . . . . . . 78.0 mtt85 64.09 20.51 12.22 Favored 'General case' 0 N--CA 1.5 2.075 0 N-CA-C 116.222 1.934 . . . . 2.0 116.222 -179.834 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 59' ' ' CYS . . . . . . . . . . . . . 49.3 t -62.84 -28.82 70.28 Favored 'General case' 0 CA--C 1.575 1.94 0 N-CA-C 116.7 2.111 . . . . 2.0 116.7 179.912 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 60' ' ' ASN . . . . . . . . . . . . . 41.3 p-10 . . . . . 0 CA--C 1.572 1.793 0 CA-C-O 124.252 1.977 . . . . 2.0 115.46 179.846 . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' A' A ' 1' ' ' LEU . . . . . 0.533 HD11 ' SG ' ' A' ' 3' ' ' CYS . 0.5 OUTLIER . . . . . 0 CA--C 1.579 2.058 0 CA-C-O 123.065 1.412 . . . . 2.0 112.51 . . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 53.9 mttp -145.2 111.28 5.56 Favored 'General case' 0 CA--C 1.566 1.559 0 N-CA-C 100.801 -3.777 . . . . 2.0 100.801 179.427 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 3' ' ' CYS . . . . . 0.533 ' SG ' HD11 ' A' ' 1' ' ' LEU . 90.7 m -133.02 156.85 46.6 Favored 'General case' 0 N--CA 1.491 1.588 0 O-C-N 120.335 -1.478 . . . . 2.0 113.909 -179.722 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 29.6 m-20 -105.63 117.18 33.35 Favored 'General case' 0 N--CA 1.487 1.415 0 N-CA-C 114.259 1.207 . . . . 2.0 114.259 -179.768 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . 0.301 1.1 pttt -64.63 -179.9 0.55 Allowed 'General case' 0 CA--C 1.58 2.133 0 O-C-N 120.518 -1.364 . . . . 2.0 112.686 179.634 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -41.75 -43.82 3.03 Favored 'General case' 0 N--CA 1.502 2.171 1 N-CA-C 121.94 4.052 . . . . 2.0 121.94 -179.691 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 7' ' ' ILE . . . . . . . . . . . . . 35.8 mt -55.39 142.15 60.67 Favored Pre-proline 0 CA--C 1.588 2.416 0 CA-C-O 116.882 -1.532 . . . . 2.0 113.227 179.878 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 65.3 Cg_exo -35.54 -54.04 0.77 Allowed 'Trans proline' 0 CA--C 1.57 2.321 0 C-N-CA 123.914 3.076 . . . . 2.0 118.78 179.977 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 9' ' ' ILE . . . . . . . . . . . . . 1.6 pp -126.44 75.27 0.51 Allowed 'Isoleucine or valine' 0 CA--C 1.575 1.924 0 N-CA-C 107.253 -1.388 . . . . 2.0 107.253 179.658 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -80.23 -163.32 0.54 Allowed 'General case' 0 CA--C 1.579 2.087 0 N-CA-C 119.19 3.033 . . . . 2.0 119.19 -179.749 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 8.8 t -57.12 -178.94 0.03 OUTLIER 'General case' 0 CA--C 1.582 2.201 0 N-CA-C 118.091 2.626 . . . . 2.0 118.091 -179.845 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . 0.25 37.1 ttpt -120.97 -93.5 0.52 Allowed 'General case' 0 CA--C 1.578 2.021 0 N-CA-C 118.324 2.712 . . . . 2.0 118.324 -179.64 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 13' ' ' THR . . . . . . . . . . . . . 32.6 m -46.59 134.56 9.36 Favored 'General case' 0 N--CA 1.501 2.087 0 N-CA-C 120.259 3.429 . . . . 2.0 120.259 -179.454 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 3.9 t -149.47 154.57 38.51 Favored Pre-proline 0 CA--C 1.598 2.823 0 C-N-CA 124.616 1.166 . . . . 2.0 111.174 -179.932 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 15' ' ' PRO . . . . . . . . . . . . . 58.4 Cg_exo -43.25 157.63 0.1 Allowed 'Trans proline' 0 CA--C 1.575 2.535 1 N-CA-C 126.659 5.6 . . . . 2.0 126.659 -179.66 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -79.76 168.92 18.68 Favored 'General case' 0 N--CA 1.499 1.981 0 C-N-CA 124.87 1.268 . . . . 2.0 111.385 179.642 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . 83.75 -51.59 4.59 Favored Glycine 1 N--CA 1.519 4.197 0 O-C-N 119.381 -2.074 . . . . 2.0 108.215 -179.049 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 21.1 mmtm -71.87 101.44 2.64 Favored 'General case' 0 CA--C 1.572 1.803 0 C-N-CA 129.048 2.939 . . . . 2.0 106.764 179.386 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 19' ' ' ASN . . . . . . . . . . . . 0.34 0.2 OUTLIER -106.94 -8.11 16.76 Favored 'General case' 0 N--CA 1.499 2.012 0 N-CA-C 117.406 2.372 . . . . 2.0 117.406 179.862 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 89.0 mt -100.2 113.97 27.04 Favored 'General case' 0 CA--C 1.563 1.471 0 C-N-CA 126.141 1.776 . . . . 2.0 109.593 179.605 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 1.3 m -80.23 101.05 8.63 Favored 'General case' 0 CA--C 1.577 1.996 0 N-CA-C 101.457 -3.535 . . . . 2.0 101.457 179.226 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 22' ' ' TYR . . . . . . . . . . . . 0.37 13.2 p90 -75.91 160.29 30.06 Favored 'General case' 0 N--CA 1.484 1.23 0 N-CA-C 119.145 3.016 . . . . 2.0 119.145 -179.509 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 60.2 tttt -135.98 87.31 2.3 Favored 'General case' 0 CA--C 1.565 1.527 0 N-CA-C 103.125 -2.917 . . . . 2.0 103.125 179.846 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 24' ' ' MET . . . . . 0.496 ' HB3' ' H ' ' A' ' 35' ' ' LYS . 24.2 ttt -61.89 76.75 0.02 OUTLIER 'General case' 0 N--CA 1.492 1.659 0 N-CA-C 118.242 2.682 . . . . 2.0 118.242 -179.58 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 25' ' ' PHE . . . . . . . . . . . . . 12.5 m-30 -69.53 128.0 34.96 Favored 'General case' 0 CA--C 1.568 1.656 0 O-C-N 120.598 -1.313 . . . . 2.0 112.328 179.839 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 26' ' ' MET . . . . . . . . . . . . . 32.2 mtm -64.16 132.02 49.17 Favored 'General case' 0 N--CA 1.501 2.087 0 O-C-N 120.308 -1.495 . . . . 2.0 108.524 179.619 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 27' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -53.48 -31.12 44.45 Favored 'General case' 0 N--CA 1.511 2.58 0 CA-C-N 121.772 2.078 . . . . 2.0 114.045 179.775 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 50.3 m -83.73 -39.77 19.7 Favored 'General case' 0 CA--C 1.587 2.371 0 C-N-CA 124.634 1.174 . . . . 2.0 112.004 179.218 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 38.6 t70 -131.66 88.32 2.56 Favored 'General case' 0 CA--C 1.572 1.789 0 N-CA-C 107.08 -1.452 . . . . 2.0 107.08 179.773 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 2.2 mm? -60.57 -82.66 0.02 OUTLIER 'General case' 0 CA--C 1.578 2.022 0 N-CA-C 121.078 3.733 . . . . 2.0 121.078 -179.413 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 31' ' ' THR . . . . . . . . . . . . 0.344 13.9 t -19.13 -52.22 0.01 OUTLIER 'General case' 0 N--CA 1.51 2.543 1 N-CA-C 123.257 4.54 . . . . 2.0 123.257 -179.643 . . . . . . . . 3 2 . 1 . 003 nuclear orig full ' A' A ' 32' ' ' ILE . . . . . . . . . . . . . 1.7 mp -97.28 105.93 28.5 Favored Pre-proline 0 CA--C 1.59 2.518 1 N-CA-C 99.314 -4.328 . . . . 2.0 99.314 179.432 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 33' ' ' PRO . . . . . . . . . . . . . 5.5 Cg_endo -73.14 178.23 6.81 Favored 'Trans proline' 0 CA--C 1.568 2.19 0 N-CA-C 120.323 3.163 . . . . 2.0 120.323 -179.446 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 34' ' ' VAL . . . . . . . . . . . . . 56.0 t -85.79 -63.05 1.33 Allowed 'Isoleucine or valine' 0 CA--C 1.585 2.292 0 N-CA-C 106.865 -1.531 . . . . 2.0 106.865 179.309 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 35' ' ' LYS . . . . . 0.496 ' H ' ' HB3' ' A' ' 24' ' ' MET . 38.9 ttmt -139.34 113.62 8.92 Favored 'General case' 0 CA--C 1.558 1.281 0 C-N-CA 124.419 1.088 . . . . 2.0 113.609 -179.9 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 36' ' ' ARG . . . . . . . . . . . . 0.345 51.8 ttp180 -85.69 73.27 10.45 Favored 'General case' 0 CA--C 1.59 2.485 0 O-C-N 120.257 -1.527 . . . . 2.0 110.319 179.971 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . -98.44 -145.84 19.48 Favored Glycine 0 N--CA 1.501 2.976 1 N-CA-C 123.535 4.174 . . . . 2.0 123.535 -179.507 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 38' ' ' CYS . . . . . . . . . . . . . 14.6 p -126.64 132.99 51.1 Favored 'General case' 0 N--CA 1.498 1.955 0 N-CA-C 114.887 1.44 . . . . 2.0 114.887 179.921 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 39' ' ' ILE . . . . . 0.518 HG13 ' H ' ' A' ' 40' ' ' ASP . 6.2 tp -152.81 -174.8 0.18 Allowed 'Isoleucine or valine' 0 N--CA 1.502 2.174 0 C-N-CA 124.7 1.2 . . . . 2.0 111.598 -179.93 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 40' ' ' ASP . . . . . 0.518 ' H ' HG13 ' A' ' 39' ' ' ILE . 4.0 p30 -119.55 -25.94 5.87 Favored 'General case' 0 N--CA 1.5 2.046 0 O-C-N 119.339 -2.101 . . . . 2.0 113.075 179.212 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 54.9 t -137.14 16.53 0.84 Allowed 'Isoleucine or valine' 0 N--CA 1.504 2.235 0 CA-C-N 120.546 1.521 . . . . 2.0 113.001 179.853 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 42' ' ' CYS . . . . . . . . . . . . 0.314 3.1 m 81.59 111.91 0.03 OUTLIER Pre-proline 0 CA--C 1.61 3.271 1 N-CA-C 95.454 -5.758 . . . . 2.0 95.454 -178.972 . . . . . . . . 3 2 . 1 . 003 nuclear orig full ' A' A ' 43' ' ' PRO . . . . . . . . . . . . 0.498 41.5 Cg_exo -22.03 -75.27 0.02 OUTLIER 'Trans proline' 0 C--N 1.376 1.998 1 N-CA-C 125.061 4.985 . . . . 2.0 125.061 -178.635 . . . . . . . . 3 2 . 1 . 003 nuclear orig full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 3.4 mtpp -179.74 101.64 0.03 OUTLIER 'General case' 0 CA--C 1.564 1.489 1 N-CA-C 99.881 -4.118 . . . . 2.0 99.881 179.832 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 45' ' ' ASN . . . . . . . . . . . . . 2.5 p-10 -73.82 139.69 45.29 Favored 'General case' 0 N--CA 1.492 1.661 0 O-C-N 120.268 -1.52 . . . . 2.0 114.573 -179.811 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 12.3 t -148.34 -173.48 4.33 Favored 'General case' 0 N--CA 1.49 1.551 0 N-CA-C 112.896 0.702 . . . . 2.0 112.896 179.936 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 47' ' ' LEU . . . . . . . . . . . . . 2.6 pp -57.76 -15.34 7.78 Favored 'General case' 0 N--CA 1.508 2.439 0 N-CA-C 116.578 2.066 . . . . 2.0 116.578 179.572 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 10.0 tp -96.78 -27.0 14.93 Favored 'General case' 0 CA--C 1.579 2.064 0 C-N-CA 126.513 1.925 . . . . 2.0 112.049 179.374 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 49' ' ' VAL . . . . . . . . . . . . . 10.9 p -154.15 146.9 13.87 Favored 'Isoleucine or valine' 0 CA--C 1.579 2.059 0 N-CA-C 119.021 2.971 . . . . 2.0 119.021 -179.522 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 18.9 ttpt -132.18 120.64 22.52 Favored 'General case' 0 CA--C 1.572 1.819 0 N-CA-C 101.7 -3.444 . . . . 2.0 101.7 179.526 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -103.05 135.27 45.04 Favored 'General case' 0 N--CA 1.506 2.34 0 O-C-N 118.393 -2.692 . . . . 2.0 117.635 -179.293 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 52' ' ' VAL . . . . . . . . . . . . . 25.4 t -102.22 97.39 5.59 Favored 'Isoleucine or valine' 0 CA--C 1.575 1.91 0 N-CA-C 104.012 -2.588 . . . . 2.0 104.012 179.588 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 53' ' ' CYS . . . . . . . . . . . . . 0.8 OUTLIER -100.22 132.56 45.51 Favored 'General case' 0 CA--C 1.576 1.966 0 N-CA-C 119.975 3.324 . . . . 2.0 119.975 -179.331 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 54' ' ' CYS . . . . . . . . . . . . . 51.4 t -117.14 124.76 49.97 Favored 'General case' 0 N--CA 1.495 1.82 0 C-N-CA 124.401 1.081 . . . . 2.0 110.305 179.909 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 2.6 t30 -67.54 49.03 0.05 OUTLIER 'General case' 0 N--CA 1.503 2.204 1 N-CA-C 124.22 4.896 . . . . 2.0 124.22 -179.368 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 56' ' ' THR . . . . . . . . . . . . 0.332 5.9 t -163.17 171.12 16.77 Favored 'General case' 0 N--CA 1.503 2.208 0 O-C-N 119.673 -1.892 . . . . 2.0 113.346 179.663 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 57' ' ' ASP . . . . . . . . . . . . . 20.0 m-20 -70.32 107.47 3.78 Favored 'General case' 0 CA--C 1.57 1.722 0 N-CA-C 115.661 1.726 . . . . 2.0 115.661 -179.8 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 58' ' ' ARG . . . . . . . . . . . . 0.278 74.7 mtm180 78.2 13.14 1.61 Allowed 'General case' 0 N--CA 1.502 2.162 0 N-CA-C 116.52 2.044 . . . . 2.0 116.52 179.833 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 59' ' ' CYS . . . . . . . . . . . . . 44.3 t -69.33 -10.79 59.51 Favored 'General case' 0 CA--C 1.577 2.019 0 N-CA-C 117.253 2.316 . . . . 2.0 117.253 179.742 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 60' ' ' ASN . . . . . . . . . . . . . 45.4 p30 . . . . . 0 CA--C 1.561 1.403 0 CA-C-O 125.537 2.589 . . . . 2.0 113.737 179.953 . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' A' A ' 1' ' ' LEU . . . . . . . . . . . . 0.313 0.3 OUTLIER . . . . . 0 CA--C 1.57 1.734 0 N-CA-C 113.798 1.036 . . . . 2.0 113.798 . . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 4.1 mmmm -69.09 130.24 42.17 Favored 'General case' 0 N--CA 1.494 1.748 0 O-C-N 120.736 -1.227 . . . . 2.0 110.626 179.833 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 70.7 m -135.1 -169.95 2.48 Favored 'General case' 0 CA--C 1.572 1.792 0 O-C-N 120.493 -1.379 . . . . 2.0 114.364 -179.855 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER -129.8 132.9 46.66 Favored 'General case' 0 N--CA 1.49 1.567 0 C-N-CA 124.98 1.312 . . . . 2.0 110.23 179.909 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 11.9 ptmt -83.84 172.57 12.02 Favored 'General case' 0 CA--C 1.591 2.534 0 CA-C-N 120.183 1.356 . . . . 2.0 107.671 179.088 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 52.1 mt -42.49 -43.69 3.78 Favored 'General case' 0 N--CA 1.514 2.726 0 N-CA-C 119.336 3.087 . . . . 2.0 119.336 -179.758 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 7' ' ' ILE . . . . . . . . . . . . . 43.8 mm -48.02 131.44 12.09 Favored Pre-proline 0 CA--C 1.583 2.213 0 CA-C-O 115.975 -1.964 . . . . 2.0 112.088 179.968 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . 0.323 13.9 Cg_exo -16.01 -68.75 0.01 OUTLIER 'Trans proline' 0 CA--C 1.563 1.965 0 C-N-CA 124.758 3.639 . . . . 2.0 121.547 -179.751 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 9' ' ' ILE . . . . . . . . . . . . 0.298 15.1 tt -88.18 -72.01 0.46 Allowed 'Isoleucine or valine' 0 CA--C 1.573 1.862 0 CA-C-O 118.824 -0.608 . . . . 2.0 109.517 179.72 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . 52.77 152.02 0.0 OUTLIER 'General case' 0 CA--C 1.576 1.949 1 N-CA-C 121.972 4.064 . . . . 2.0 121.972 179.711 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 20.2 t -148.46 135.27 19.92 Favored 'General case' 0 N--CA 1.492 1.64 0 O-C-N 120.469 -1.394 . . . . 2.0 114.133 -179.97 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 78.1 tttt -135.75 135.16 39.74 Favored 'General case' 0 N--CA 1.493 1.709 0 C-N-CA 125.201 1.4 . . . . 2.0 107.759 179.782 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 13' ' ' THR . . . . . . . . . . . . . 14.3 t -117.12 104.4 11.19 Favored 'General case' 0 N--CA 1.504 2.235 0 CA-C-N 120.845 1.657 . . . . 2.0 111.108 179.962 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 14' ' ' CYS . . . . . . . . . . . . 0.294 0.0 OUTLIER -123.64 168.24 13.02 Favored Pre-proline 0 CA--C 1.588 2.435 0 O-C-N 121.077 -1.014 . . . . 2.0 113.376 179.925 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 15' ' ' PRO . . . . . . . . . . . . . 53.5 Cg_exo -62.78 166.99 12.65 Favored 'Trans proline' 0 N--CA 1.505 2.152 1 N-CA-C 124.989 4.957 . . . . 2.0 124.989 -179.631 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -69.45 173.69 5.65 Favored 'General case' 0 N--CA 1.498 1.958 0 C-N-CA 123.661 0.784 . . . . 2.0 109.14 179.382 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . 84.55 -52.58 4.72 Favored Glycine 0 N--CA 1.516 3.978 0 O-C-N 118.36 -2.712 . . . . 2.0 106.669 -178.963 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 39.4 mmtt -78.74 61.01 2.92 Favored 'General case' 0 CA--C 1.598 2.79 0 N-CA-C 105.224 -2.139 . . . . 2.0 105.224 179.08 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 7.4 p30 -60.96 -41.92 97.27 Favored 'General case' 0 N--CA 1.481 1.123 0 N-CA-C 119.627 3.195 . . . . 2.0 119.627 -179.582 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 97.4 mt -71.93 112.24 7.86 Favored 'General case' 0 CA--C 1.554 1.113 0 N-CA-C 115.44 1.644 . . . . 2.0 115.44 -179.87 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 1.4 m -82.62 97.85 8.71 Favored 'General case' 0 CA--C 1.577 1.994 0 N-CA-C 100.323 -3.954 . . . . 2.0 100.323 179.255 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 22' ' ' TYR . . . . . . . . . . . . 0.381 1.2 p90 -64.87 161.12 18.97 Favored 'General case' 0 CA--C 1.562 1.43 0 N-CA-C 120.65 3.574 . . . . 2.0 120.65 -179.347 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 7.3 tppt? -138.3 98.32 3.58 Favored 'General case' 0 CA--C 1.568 1.665 0 N-CA-C 102.546 -3.131 . . . . 2.0 102.546 179.86 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 24' ' ' MET . . . . . . . . . . . . . 10.0 ttt -72.59 85.86 1.18 Allowed 'General case' 0 CA--C 1.565 1.525 0 O-C-N 120.498 -1.377 . . . . 2.0 112.17 -179.892 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 25' ' ' PHE . . . . . . . . . . . . . 2.4 m-30 -76.91 117.68 18.75 Favored 'General case' 0 CA--C 1.569 1.69 0 N-CA-C 106.675 -1.602 . . . . 2.0 106.675 179.632 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 26' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -56.52 129.05 39.17 Favored 'General case' 0 N--CA 1.497 1.912 0 O-C-N 121.047 -1.033 . . . . 2.0 113.668 -179.781 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 27' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -42.83 -44.01 4.28 Favored 'General case' 0 N--CA 1.506 2.331 0 N-CA-C 117.326 2.343 . . . . 2.0 117.326 -179.787 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 53.1 m -76.13 -42.29 47.35 Favored 'General case' 0 CA--C 1.581 2.161 0 N-CA-C 113.287 0.847 . . . . 2.0 113.287 179.566 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 64.4 t0 -133.34 96.28 3.69 Favored 'General case' 0 CA--C 1.568 1.663 0 N-CA-C 105.705 -1.961 . . . . 2.0 105.705 179.712 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 2.8 mm? -64.95 -63.41 1.12 Allowed 'General case' 0 CA--C 1.568 1.669 0 N-CA-C 118.602 2.815 . . . . 2.0 118.602 -179.601 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 31' ' ' THR . . . . . . . . . . . . . 81.3 p -33.41 -46.68 0.19 Allowed 'General case' 0 N--CA 1.508 2.44 0 N-CA-C 120.426 3.491 . . . . 2.0 120.426 -179.673 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 32' ' ' ILE . . . . . . . . . . . . . 2.2 mp -87.39 111.35 40.8 Favored Pre-proline 0 CA--C 1.589 2.444 0 N-CA-C 103.756 -2.683 . . . . 2.0 103.756 179.649 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 33' ' ' PRO . . . . . . . . . . . . . 6.1 Cg_exo -71.42 144.68 46.06 Favored 'Trans proline' 0 CA--C 1.565 2.06 0 N-CA-C 118.214 2.351 . . . . 2.0 118.214 -179.764 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 34' ' ' VAL . . . . . . . . . . . . 0.314 14.3 m -98.0 -14.65 7.69 Favored 'Isoleucine or valine' 0 N--CA 1.508 2.459 0 N-CA-C 113.762 1.023 . . . . 2.0 113.762 179.456 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . 0.276 3.1 tmtt? -161.93 155.45 21.14 Favored 'General case' 0 CA--C 1.568 1.658 0 C-N-CA 126.332 1.853 . . . . 2.0 108.623 179.472 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 36' ' ' ARG . . . . . . . . . . . . 0.305 13.1 ttp180 -140.64 105.52 4.95 Favored 'General case' 0 CA--C 1.581 2.154 0 N-CA-C 103.024 -2.954 . . . . 2.0 103.024 -180.0 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . -134.14 -139.96 4.22 Favored Glycine 0 N--CA 1.502 3.066 0 N-CA-C 121.622 3.409 . . . . 2.0 121.622 -179.502 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 38' ' ' CYS . . . . . . . . . . . . . 0.8 OUTLIER -135.24 142.4 45.96 Favored 'General case' 0 N--CA 1.498 1.967 0 N-CA-C 113.645 0.98 . . . . 2.0 113.645 -179.971 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 39' ' ' ILE . . . . . 0.404 HG23 ' HD3' ' A' ' 43' ' ' PRO . 8.2 tp -166.57 171.36 0.21 Allowed 'Isoleucine or valine' 0 N--CA 1.507 2.4 0 O-C-N 120.777 -1.202 . . . . 2.0 114.085 -179.623 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 40' ' ' ASP . . . . . . . . . . . . . 20.6 m-20 -87.46 -52.67 5.23 Favored 'General case' 0 CA--C 1.577 1.992 0 O-C-N 120.131 -1.606 . . . . 2.0 112.163 179.364 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 95.7 t -132.8 39.58 0.7 Allowed 'Isoleucine or valine' 0 N--CA 1.51 2.537 0 N-CA-C 114.131 1.16 . . . . 2.0 114.131 -179.624 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 42' ' ' CYS . . . . . . . . . . . . 0.257 2.5 m 73.28 114.89 0.03 OUTLIER Pre-proline 0 N--CA 1.515 2.818 0 N-CA-C 103.278 -2.86 . . . . 2.0 103.278 -179.579 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 43' ' ' PRO . . . . . 0.404 ' HD3' HG23 ' A' ' 39' ' ' ILE . 12.7 Cg_exo -58.7 170.58 2.5 Favored 'Trans proline' 0 C--N 1.373 1.844 0 CA-C-N 127.039 3.549 . . . . 2.0 118.796 -179.318 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 56.4 mtmt -64.45 99.11 0.28 Allowed 'General case' 0 CA--C 1.574 1.887 0 CA-C-O 123.558 1.647 . . . . 2.0 108.023 179.719 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 45' ' ' ASN . . . . . . . . . . . . 0.276 4.0 p-10 -71.89 -157.87 0.04 OUTLIER 'General case' 0 CA--C 1.569 1.702 0 N-CA-C 118.215 2.672 . . . . 2.0 118.215 -179.555 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 46' ' ' SER . . . . . . . . . . . . 0.315 6.3 t 78.11 -43.46 0.38 Allowed 'General case' 0 N--CA 1.489 1.48 0 N-CA-C 117.519 2.414 . . . . 2.0 117.519 179.945 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 47' ' ' LEU . . . . . . . . . . . . . 2.6 pp -47.6 -49.83 25.84 Favored 'General case' 0 N--CA 1.507 2.417 0 CA-C-N 120.348 1.431 . . . . 2.0 113.264 179.643 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 90.3 mt -156.34 25.68 0.35 Allowed 'General case' 0 CA--C 1.586 2.335 0 C-N-CA 126.947 2.099 . . . . 2.0 109.031 179.434 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 49' ' ' VAL . . . . . . . . . . . . . 3.7 p -168.07 171.24 0.18 Allowed 'Isoleucine or valine' 0 CA--C 1.587 2.38 0 N-CA-C 119.425 3.12 . . . . 2.0 119.425 -178.902 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 23.1 ttpt -151.62 75.1 1.15 Allowed 'General case' 0 CA--C 1.583 2.245 0 N-CA-C 101.501 -3.518 . . . . 2.0 101.501 178.954 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 99.0 m-85 -51.37 131.85 28.9 Favored 'General case' 0 CA--C 1.565 1.531 1 N-CA-C 123.17 4.507 . . . . 2.0 123.17 -179.241 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 52' ' ' VAL . . . . . . . . . . . . . 7.0 t -100.46 139.92 20.72 Favored 'Isoleucine or valine' 0 CA--C 1.577 2.018 1 N-CA-C 99.297 -4.334 . . . . 2.0 99.297 179.023 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 53' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -145.45 143.68 30.17 Favored 'General case' 0 CA--C 1.568 1.643 0 O-C-N 118.509 -2.619 . . . . 2.0 115.683 -179.148 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 54' ' ' CYS . . . . . . . . . . . . . 25.7 p -126.78 120.46 29.39 Favored 'General case' 0 CA--C 1.572 1.821 0 C-N-CA 123.448 0.699 . . . . 2.0 110.314 179.905 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 9.0 m120 -51.27 6.81 0.0 OUTLIER 'General case' 0 N--CA 1.506 2.367 1 N-CA-C 125.471 5.36 . . . . 2.0 125.471 -179.506 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 56' ' ' THR . . . . . . . . . . . . 0.252 5.5 t -137.6 175.98 9.12 Favored 'General case' 0 N--CA 1.504 2.233 0 CA-C-N 123.31 2.777 . . . . 2.0 117.315 -179.758 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 57' ' ' ASP . . . . . . . . . . . . . 38.1 m-20 -61.4 116.2 4.47 Favored 'General case' 0 N--CA 1.487 1.415 0 N-CA-C 115.366 1.617 . . . . 2.0 115.366 -179.931 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 58' ' ' ARG . . . . . . . . . . . . 0.315 38.2 mtp180 62.37 21.26 12.43 Favored 'General case' 0 CA--C 1.578 2.046 0 N-CA-C 117.999 2.592 . . . . 2.0 117.999 -179.969 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 59' ' ' CYS . . . . . . . . . . . . . 29.1 p -72.96 -24.7 60.82 Favored 'General case' 0 CA--C 1.573 1.862 0 N-CA-C 116.816 2.154 . . . . 2.0 116.816 179.829 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 60' ' ' ASN . . . . . . . . . . . . . 41.2 p-10 . . . . . 0 CA--C 1.56 1.334 0 CA-C-O 124.161 1.934 . . . . 2.0 112.229 179.849 . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' A' A ' 1' ' ' LEU . . . . . 0.479 HD22 ' SG ' ' A' ' 3' ' ' CYS . 6.0 tp . . . . . 0 CA--C 1.57 1.721 0 N-CA-C 113.497 0.925 . . . . 2.0 113.497 . . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -85.66 137.36 32.89 Favored 'General case' 0 CA--C 1.571 1.779 0 N-CA-C 107.886 -1.153 . . . . 2.0 107.886 179.711 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 3' ' ' CYS . . . . . 0.479 ' SG ' HD22 ' A' ' 1' ' ' LEU . 88.2 m -139.59 167.38 22.23 Favored 'General case' 0 N--CA 1.494 1.772 0 O-C-N 119.653 -1.904 . . . . 2.0 114.216 -179.89 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 69.4 m-80 -111.36 138.28 48.04 Favored 'General case' 0 CA--C 1.563 1.48 0 N-CA-C 116.969 2.211 . . . . 2.0 116.969 -179.858 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 5' ' ' LYS . . . . . 0.456 ' H ' ' HB2' ' A' ' 10' ' ' ALA 0.26 14.8 ptpt -87.56 172.17 9.95 Favored 'General case' 0 CA--C 1.587 2.396 0 CA-C-N 120.223 1.374 . . . . 2.0 107.481 178.912 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 1.5 mm? -39.98 -49.34 2.48 Favored 'General case' 0 N--CA 1.506 2.369 0 N-CA-C 120.897 3.665 . . . . 2.0 120.897 -179.835 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 7' ' ' ILE . . . . . . . . . . . . . 21.5 mt -73.7 147.11 86.5 Favored Pre-proline 0 CA--C 1.585 2.325 0 N-CA-C 114.2 1.185 . . . . 2.0 114.2 -179.79 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 70.6 Cg_exo -44.79 -45.54 13.53 Favored 'Trans proline' 0 CA--C 1.567 2.164 0 N-CA-C 119.864 2.986 . . . . 2.0 119.864 179.827 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 9' ' ' ILE . . . . . . . . . . . . 0.297 0.2 OUTLIER -59.37 -46.96 92.15 Favored 'Isoleucine or valine' 0 N--CA 1.514 2.726 0 CA-C-N 120.571 1.532 . . . . 2.0 112.356 179.611 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 10' ' ' ALA . . . . . 0.456 ' HB2' ' H ' ' A' ' 5' ' ' LYS . . . 55.97 159.2 0.01 OUTLIER 'General case' 0 CA--C 1.578 2.032 1 N-CA-C 123.918 4.784 . . . . 2.0 123.918 179.345 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 8.2 t -66.3 -174.31 0.26 Allowed 'General case' 0 CA--C 1.58 2.103 0 N-CA-C 117.763 2.505 . . . . 2.0 117.763 -179.902 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . 0.309 50.4 tptt -98.23 -90.56 0.28 Allowed 'General case' 0 CA--C 1.572 1.801 1 N-CA-C 123.304 4.557 . . . . 2.0 123.304 -179.485 . . . . . . . . 3 2 . 1 . 005 nuclear orig full ' A' A ' 13' ' ' THR . . . . . . . . . . . . . 8.4 t -156.92 170.81 21.64 Favored 'General case' 0 N--CA 1.506 2.351 0 N-CA-C 120.108 3.373 . . . . 2.0 120.108 -179.143 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 14' ' ' CYS . . . . . . . . . . . . 0.419 0.5 OUTLIER -146.4 168.44 11.59 Favored Pre-proline 0 CA--C 1.6 2.902 0 C-N-CA 126.104 1.761 . . . . 2.0 108.713 179.215 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 15' ' ' PRO . . . . . . . . . . . . . 92.2 Cg_exo -45.07 171.37 0.02 OUTLIER 'Trans proline' 0 CA--C 1.571 2.347 1 N-CA-C 128.673 6.374 . . . . 2.0 128.673 -179.488 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -78.72 165.36 23.69 Favored 'General case' 0 N--CA 1.499 1.986 0 N-CA-C 104.506 -2.405 . . . . 2.0 104.506 178.944 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . 85.34 -47.94 3.93 Favored Glycine 1 N--CA 1.524 4.512 0 O-C-N 117.082 -3.511 . . . . 2.0 105.37 -178.642 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 39.9 mmtm -83.3 63.78 7.42 Favored 'General case' 0 CA--C 1.604 3.031 1 N-CA-C 99.939 -4.097 . . . . 2.0 99.939 178.493 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 37.3 p-10 -80.85 -20.49 42.23 Favored 'General case' 0 N--CA 1.483 1.18 0 N-CA-C 121.527 3.899 . . . . 2.0 121.527 -179.261 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 70.7 mt -88.59 112.95 23.64 Favored 'General case' 0 CA--C 1.555 1.136 0 CA-C-N 119.284 0.947 . . . . 2.0 110.586 179.771 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 21' ' ' CYS . . . . . 0.404 ' HB2' ' SG ' ' A' ' 59' ' ' CYS . 1.7 m -79.91 95.4 6.08 Favored 'General case' 0 CA--C 1.576 1.947 0 N-CA-C 100.389 -3.93 . . . . 2.0 100.389 179.257 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 22' ' ' TYR . . . . . . . . . . . . 0.266 0.0 OUTLIER -76.14 154.72 35.24 Favored 'General case' 0 CA--C 1.552 1.054 0 N-CA-C 121.008 3.707 . . . . 2.0 121.008 -179.35 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 31.8 mtmt -117.73 92.2 3.77 Favored 'General case' 0 CA--C 1.559 1.317 1 N-CA-C 99.626 -4.212 . . . . 2.0 99.626 179.311 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 24' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -71.13 72.97 0.63 Allowed 'General case' 0 CA--C 1.578 2.027 0 C-N-CA 124.374 1.07 . . . . 2.0 108.719 179.912 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 25' ' ' PHE . . . . . . . . . . . . . 9.6 m-30 -62.1 133.23 54.99 Favored 'General case' 0 N--CA 1.486 1.367 0 O-C-N 120.709 -1.245 . . . . 2.0 113.152 -179.856 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 26' ' ' MET . . . . . . . . . . . . . 34.4 mtp -64.48 131.2 46.44 Favored 'General case' 0 N--CA 1.489 1.503 0 N-CA-C 113.131 0.789 . . . . 2.0 113.131 -179.995 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 27' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -54.22 -38.83 66.15 Favored 'General case' 0 N--CA 1.514 2.731 0 CA-C-N 120.779 1.627 . . . . 2.0 112.164 179.461 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 50.4 m -79.73 -32.52 41.15 Favored 'General case' 0 CA--C 1.586 2.337 0 N-CA-C 114.062 1.134 . . . . 2.0 114.062 179.418 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 52.7 t0 -146.86 84.31 1.6 Allowed 'General case' 0 CA--C 1.573 1.85 0 O-C-N 120.599 -1.313 . . . . 2.0 109.723 179.871 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 1.6 mm? -51.18 -67.52 0.24 Allowed 'General case' 0 CA--C 1.576 1.972 0 N-CA-C 120.763 3.616 . . . . 2.0 120.763 -179.496 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 31' ' ' THR . . . . . . . . . . . . 0.337 15.3 t -19.22 -61.97 0.02 OUTLIER 'General case' 0 N--CA 1.51 2.538 1 N-CA-C 121.825 4.009 . . . . 2.0 121.825 -179.793 . . . . . . . . 3 2 . 1 . 005 nuclear orig full ' A' A ' 32' ' ' ILE . . . . . . . . . . . . . 1.8 mp -100.71 103.68 26.02 Favored Pre-proline 0 CA--C 1.589 2.468 1 N-CA-C 99.661 -4.2 . . . . 2.0 99.661 179.577 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 33' ' ' PRO . . . . . . . . . . . . . 14.5 Cg_endo -62.8 171.1 6.28 Favored 'Trans proline' 0 CA--C 1.561 1.862 1 N-CA-C 123.372 4.335 . . . . 2.0 123.372 -179.512 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 34' ' ' VAL . . . . . . . . . . . . . 97.8 t -73.66 -55.57 12.05 Favored 'Isoleucine or valine' 0 CA--C 1.59 2.49 0 N-CA-C 104.467 -2.42 . . . . 2.0 104.467 178.963 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 36.7 tttm -136.35 162.17 33.75 Favored 'General case' 0 CA--C 1.564 1.496 0 CA-C-O 124.449 2.071 . . . . 2.0 108.963 179.601 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 36' ' ' ARG . . . . . . . . . . . . 0.346 40.2 ttp180 -138.26 108.61 6.49 Favored 'General case' 0 CA--C 1.574 1.866 1 N-CA-C 98.495 -4.631 . . . . 2.0 98.495 179.533 . . . . . . . . 3 2 . 1 . 005 nuclear orig full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . -145.04 -147.77 4.7 Favored Glycine 0 N--CA 1.489 2.21 0 O-C-N 119.053 -2.279 . . . . 2.0 118.387 -179.56 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 38' ' ' CYS . . . . . . . . . . . . . 19.1 p -115.47 137.51 51.98 Favored 'General case' 0 CA--C 1.562 1.421 0 C-N-CA 123.723 0.809 . . . . 2.0 111.587 179.959 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 39' ' ' ILE . . . . . . . . . . . . . 3.4 tp -160.23 166.12 0.73 Allowed 'Isoleucine or valine' 0 N--CA 1.495 1.809 0 O-C-N 120.879 -1.138 . . . . 2.0 113.838 -179.906 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 40' ' ' ASP . . . . . . . . . . . . . 9.6 p30 -80.87 -102.05 0.03 OUTLIER 'General case' 0 N--CA 1.507 2.406 0 N-CA-C 103.736 -2.69 . . . . 2.0 103.736 179.435 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 87.7 t -85.98 162.12 2.87 Favored 'Isoleucine or valine' 0 CA--C 1.58 2.126 0 N-CA-C 104.595 -2.372 . . . . 2.0 104.595 178.982 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 42' ' ' CYS . . . . . . . . . . . . . 1.7 m -63.78 107.24 1.19 Allowed Pre-proline 0 CA--C 1.605 3.068 1 N-CA-C 100.007 -4.071 . . . . 2.0 100.007 179.554 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 43' ' ' PRO . . . . . . . . . . . . . 26.4 Cg_exo -50.37 -178.02 0.01 OUTLIER 'Trans proline' 0 C--N 1.372 1.791 1 N-CA-C 125.088 4.996 . . . . 2.0 125.088 -178.709 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 96.7 mttt -73.08 103.15 3.74 Favored 'General case' 0 CA--C 1.568 1.639 0 N-CA-C 104.187 -2.523 . . . . 2.0 104.187 179.386 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 45' ' ' ASN . . . . . . . . . . . . 0.25 2.0 p-10 -67.6 117.45 9.56 Favored 'General case' 0 CA--C 1.563 1.466 0 N-CA-C 117.174 2.287 . . . . 2.0 117.174 -179.358 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 14.9 t -82.73 179.27 7.83 Favored 'General case' 0 CA--C 1.565 1.54 0 N-CA-C 113.776 1.028 . . . . 2.0 113.776 179.962 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 47' ' ' LEU . . . . . . . . . . . . . 88.8 mt -51.55 -25.01 5.97 Favored 'General case' 0 N--CA 1.507 2.391 0 N-CA-C 116.424 2.009 . . . . 2.0 116.424 179.768 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 78.7 mt -102.51 7.33 40.2 Favored 'General case' 0 CA--C 1.579 2.093 0 C-N-CA 125.131 1.372 . . . . 2.0 114.636 179.591 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 49' ' ' VAL . . . . . . . . . . . . . 9.0 p -153.93 159.24 3.37 Favored 'Isoleucine or valine' 0 N--CA 1.502 2.13 0 N-CA-C 117.505 2.409 . . . . 2.0 117.505 -179.644 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER -153.78 78.47 1.13 Allowed 'General case' 0 CA--C 1.576 1.967 0 N-CA-C 102.752 -3.055 . . . . 2.0 102.752 179.343 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER -58.69 128.81 39.05 Favored 'General case' 0 CA--C 1.569 1.697 1 N-CA-C 122.7 4.333 . . . . 2.0 122.7 -179.341 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 52' ' ' VAL . . . . . . . . . . . . 0.284 14.1 t -103.13 151.88 6.11 Favored 'Isoleucine or valine' 0 CA--C 1.578 2.047 0 N-CA-C 102.107 -3.294 . . . . 2.0 102.107 179.047 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 53' ' ' CYS . . . . . . . . . . . . 0.261 0.8 OUTLIER -147.5 160.82 42.17 Favored 'General case' 0 CA--C 1.568 1.65 0 N-CA-C 119.178 3.029 . . . . 2.0 119.178 -179.026 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 54' ' ' CYS . . . . . . . . . . . . . 29.0 p -143.34 120.69 11.61 Favored 'General case' 0 CA--C 1.574 1.895 0 C-N-CA 123.928 0.891 . . . . 2.0 110.342 179.78 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 14.8 m120 -55.45 12.01 0.0 OUTLIER 'General case' 0 N--CA 1.508 2.467 1 N-CA-C 124.518 5.007 . . . . 2.0 124.518 -179.674 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 56' ' ' THR . . . . . . . . . . . . 0.274 4.9 t -138.26 177.82 7.59 Favored 'General case' 0 N--CA 1.502 2.134 0 CA-C-N 123.077 2.671 . . . . 2.0 116.794 -179.839 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 57' ' ' ASP . . . . . . . . . . . . . 69.9 m-20 -65.11 120.76 13.27 Favored 'General case' 0 CA--C 1.565 1.541 0 N-CA-C 115.779 1.77 . . . . 2.0 115.779 -179.755 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 58' ' ' ARG . . . . . . . . . . . . . 10.7 mmm180 56.45 31.19 18.39 Favored 'General case' 0 CA--C 1.586 2.348 0 N-CA-C 115.193 1.553 . . . . 2.0 115.193 -179.919 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 59' ' ' CYS . . . . . 0.404 ' SG ' ' HB2' ' A' ' 21' ' ' CYS . 29.7 p -83.77 -21.13 32.3 Favored 'General case' 0 N--CA 1.495 1.813 0 N-CA-C 116.432 2.012 . . . . 2.0 116.432 179.848 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 60' ' ' ASN . . . . . . . . . . . . . 25.3 p-10 . . . . . 0 CA--C 1.56 1.34 0 CA-C-O 124.967 2.318 . . . . 2.0 113.079 179.886 . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' A' A ' 1' ' ' LEU . . . . . 0.563 HD11 ' SG ' ' A' ' 3' ' ' CYS . 0.7 OUTLIER . . . . . 0 CA--C 1.576 1.944 0 CA-C-O 123.257 1.503 . . . . 2.0 113.785 . . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 1.6 mptp? -151.87 108.41 3.47 Favored 'General case' 0 CA--C 1.565 1.523 0 N-CA-C 101.15 -3.648 . . . . 2.0 101.15 179.631 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 3' ' ' CYS . . . . . 0.563 ' SG ' HD11 ' A' ' 1' ' ' LEU . 90.7 m -114.01 -168.38 1.35 Allowed 'General case' 0 N--CA 1.499 1.979 0 CA-C-N 122.131 2.241 . . . . 2.0 115.941 -179.926 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 80.4 m-20 -139.4 113.35 8.68 Favored 'General case' 0 CA--C 1.56 1.329 0 C-N-CA 123.843 0.857 . . . . 2.0 110.547 179.911 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -66.74 -179.03 0.8 Allowed 'General case' 0 CA--C 1.583 2.243 0 CA-C-N 121.202 1.819 . . . . 2.0 111.44 179.416 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -45.03 -41.87 7.9 Favored 'General case' 0 N--CA 1.509 2.493 0 N-CA-C 120.86 3.652 . . . . 2.0 120.86 -179.704 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 7' ' ' ILE . . . . . . . . . . . . . 38.5 mt -57.03 144.13 69.74 Favored Pre-proline 0 CA--C 1.586 2.348 0 C-N-CA 124.602 1.161 . . . . 2.0 113.53 179.861 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 90.1 Cg_exo -46.48 -42.6 22.99 Favored 'Trans proline' 0 CA--C 1.572 2.382 0 N-CA-C 118.901 2.616 . . . . 2.0 118.901 179.828 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 9' ' ' ILE . . . . . . . . . . . . 0.264 9.5 pt -88.37 -67.49 0.73 Allowed 'Isoleucine or valine' 0 N--CA 1.499 2.018 0 C-N-CA 123.799 0.84 . . . . 2.0 112.125 179.669 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . 0.259 . . 63.61 166.45 0.14 Allowed 'General case' 0 CA--C 1.581 2.166 0 N-CA-C 120.149 3.388 . . . . 2.0 120.149 179.818 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 15.8 t -87.01 149.86 24.46 Favored 'General case' 0 N--CA 1.495 1.819 0 O-C-N 121.099 -1.0 . . . . 2.0 113.437 179.984 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . 0.388 9.0 ptpp? -84.21 -98.03 0.06 Allowed 'General case' 0 CA--C 1.584 2.287 1 N-CA-C 123.523 4.638 . . . . 2.0 123.523 -179.431 . . . . . . . . 3 2 . 1 . 006 nuclear orig full ' A' A ' 13' ' ' THR . . . . . . . . . . . . . 35.7 m -22.58 129.56 0.02 OUTLIER 'General case' 0 N--CA 1.505 2.285 1 N-CA-C 123.494 4.627 . . . . 2.0 123.494 -179.558 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 52.9 t -156.34 146.05 15.47 Favored Pre-proline 0 CA--C 1.594 2.665 0 C-N-CA 125.525 1.53 . . . . 2.0 110.095 179.72 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 15' ' ' PRO . . . . . . . . . . . . . 44.2 Cg_exo -47.76 169.91 0.06 OUTLIER 'Trans proline' 0 CA--C 1.576 2.606 1 N-CA-C 126.042 5.362 . . . . 2.0 126.042 -179.836 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -78.02 165.77 23.64 Favored 'General case' 0 N--CA 1.496 1.865 0 C-N-CA 124.8 1.24 . . . . 2.0 110.236 179.532 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . 82.86 -48.37 4.0 Favored Glycine 1 N--CA 1.517 4.039 0 O-C-N 119.049 -2.282 . . . . 2.0 109.256 -179.106 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 35.7 mmtm -77.34 91.99 3.88 Favored 'General case' 0 CA--C 1.573 1.858 0 N-CA-C 101.953 -3.351 . . . . 2.0 101.953 179.262 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 9.9 p30 -98.38 -27.23 14.19 Favored 'General case' 0 N--CA 1.491 1.612 0 N-CA-C 117.369 2.359 . . . . 2.0 117.369 -179.85 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 76.6 mt -83.7 114.12 21.35 Favored 'General case' 0 CA--C 1.557 1.233 0 N-CA-C 116.148 1.907 . . . . 2.0 116.148 -179.849 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 21' ' ' CYS . . . . . 0.417 ' SG ' HD21 ' A' ' 1' ' ' LEU . 5.2 m -84.45 91.44 7.83 Favored 'General case' 0 CA--C 1.578 2.031 1 N-CA-C 99.989 -4.078 . . . . 2.0 99.989 179.152 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 22' ' ' TYR . . . . . . . . . . . . . 8.1 p90 -75.47 158.89 31.98 Favored 'General case' 0 CA--C 1.552 1.036 0 N-CA-C 120.461 3.504 . . . . 2.0 120.461 -179.311 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 19.0 ptpt -133.21 101.55 5.24 Favored 'General case' 0 CA--C 1.562 1.406 0 N-CA-C 104.952 -2.24 . . . . 2.0 104.952 179.491 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 24' ' ' MET . . . . . . . . . . . . . 0.1 OUTLIER -68.81 86.92 0.34 Allowed 'General case' 0 N--CA 1.485 1.285 0 C-N-CA 125.438 1.495 . . . . 2.0 112.542 179.949 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 25' ' ' PHE . . . . . . . . . . . . . 8.2 m-30 -78.28 108.33 11.54 Favored 'General case' 0 CA--C 1.563 1.444 0 N-CA-C 104.601 -2.37 . . . . 2.0 104.601 179.568 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 26' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -58.27 128.5 37.43 Favored 'General case' 0 CA--C 1.57 1.712 0 CA-C-O 117.869 -1.062 . . . . 2.0 110.806 179.999 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 27' ' ' MET . . . . . . . . . . . . . 31.0 mtp -41.59 -36.73 0.98 Allowed 'General case' 0 N--CA 1.51 2.54 0 N-CA-C 117.949 2.574 . . . . 2.0 117.949 -179.891 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 67.3 m -89.23 -32.57 17.36 Favored 'General case' 0 CA--C 1.588 2.424 0 C-N-CA 124.189 0.996 . . . . 2.0 112.151 179.293 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 15.9 m-20 -130.44 87.61 2.53 Favored 'General case' 0 CA--C 1.576 1.945 0 O-C-N 119.424 -2.047 . . . . 2.0 105.592 179.748 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 1.5 mm? -74.26 -75.22 0.16 Allowed 'General case' 0 CA--C 1.578 2.022 0 N-CA-C 119.652 3.205 . . . . 2.0 119.652 -179.528 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 31' ' ' THR . . . . . . . . . . . . 0.257 80.7 p -17.92 -68.27 0.02 OUTLIER 'General case' 0 N--CA 1.508 2.47 0 N-CA-C 121.065 3.728 . . . . 2.0 121.065 -179.588 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 32' ' ' ILE . . . . . . . . . . . . . 1.9 mp -90.79 108.02 24.68 Favored Pre-proline 0 CA--C 1.585 2.315 1 N-CA-C 99.714 -4.18 . . . . 2.0 99.714 179.503 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 33' ' ' PRO . . . . . . . . . . . . . 43.1 Cg_endo -61.7 162.85 20.19 Favored 'Trans proline' 0 CA--C 1.56 1.787 0 N-CA-C 119.012 2.659 . . . . 2.0 119.012 -179.659 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 34' ' ' VAL . . . . . . . . . . . . . 14.2 t -88.19 -47.74 15.35 Favored 'Isoleucine or valine' 0 N--CA 1.503 2.2 0 N-CA-C 107.011 -1.477 . . . . 2.0 107.011 179.148 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 4.6 tptp -124.78 155.27 39.63 Favored 'General case' 0 CA--C 1.564 1.505 0 CA-C-O 124.159 1.933 . . . . 2.0 108.559 179.605 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 2.9 mtp180 -141.74 110.85 6.29 Favored 'General case' 0 CA--C 1.566 1.576 0 N-CA-C 100.495 -3.891 . . . . 2.0 100.495 179.782 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . -141.94 -152.74 5.77 Favored Glycine 0 N--CA 1.487 2.035 0 N-CA-C 118.8 2.28 . . . . 2.0 118.8 -179.7 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 38' ' ' CYS . . . . . 0.421 ' HB3' ' SG ' ' A' ' 3' ' ' CYS . 25.7 p -127.66 126.69 42.43 Favored 'General case' 0 CA--C 1.562 1.441 0 C-N-CA 123.581 0.752 . . . . 2.0 112.401 179.902 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 39' ' ' ILE . . . . . . . . . . . . . 8.2 tp -147.81 179.22 0.8 Allowed 'Isoleucine or valine' 0 N--CA 1.497 1.878 0 C-N-CA 124.007 0.923 . . . . 2.0 112.858 -179.702 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 40' ' ' ASP . . . . . . . . . . . . . 18.0 p-10 -102.91 -43.86 5.41 Favored 'General case' 0 CA--C 1.569 1.702 0 O-C-N 120.267 -1.521 . . . . 2.0 113.539 179.707 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 4.3 t -137.2 35.94 0.56 Allowed 'Isoleucine or valine' 0 N--CA 1.509 2.496 0 CA-C-N 120.086 1.312 . . . . 2.0 112.459 179.975 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 42' ' ' CYS . . . . . . . . . . . . 0.349 2.7 m 75.31 122.03 0.03 OUTLIER Pre-proline 0 CA--C 1.614 3.415 1 N-CA-C 99.919 -4.104 . . . . 2.0 99.919 -179.26 . . . . . . . . 3 2 . 1 . 006 nuclear orig full ' A' A ' 43' ' ' PRO . . . . . . . . . . . . . 27.4 Cg_exo -55.01 -4.08 0.34 Allowed 'Trans proline' 0 N--CA 1.503 2.077 1 N-CA-C 129.512 6.697 . . . . 2.0 129.512 -178.851 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . 0.331 69.3 mttt 110.1 104.66 0.0 OUTLIER 'General case' 0 N--CA 1.494 1.738 0 N-CA-C 100.685 -3.82 . . . . 2.0 100.685 -179.446 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 45' ' ' ASN . . . . . . . . . . . . . 4.0 p-10 -72.77 101.34 3.08 Favored 'General case' 0 CA--C 1.566 1.592 0 N-CA-C 116.449 2.018 . . . . 2.0 116.449 -179.393 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 14.1 t -81.64 178.43 8.34 Favored 'General case' 0 CA--C 1.567 1.625 0 N-CA-C 113.245 0.832 . . . . 2.0 113.245 179.888 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 47' ' ' LEU . . . . . . . . . . . . 0.392 3.4 pp -57.3 -12.78 2.64 Favored 'General case' 0 N--CA 1.508 2.466 0 N-CA-C 117.072 2.249 . . . . 2.0 117.072 179.729 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 77.3 mt -106.61 4.22 27.75 Favored 'General case' 0 CA--C 1.584 2.253 0 C-N-CA 125.549 1.54 . . . . 2.0 111.867 179.209 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 49' ' ' VAL . . . . . . . . . . . . . 14.4 p -157.44 149.33 9.78 Favored 'Isoleucine or valine' 0 N--CA 1.501 2.11 0 CA-C-N 123.378 2.808 . . . . 2.0 116.988 -179.604 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 17.3 ttpt -141.51 73.18 1.41 Allowed 'General case' 0 CA--C 1.58 2.112 0 N-CA-C 104.173 -2.529 . . . . 2.0 104.173 179.539 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER -59.85 130.15 45.35 Favored 'General case' 0 N--CA 1.494 1.755 0 N-CA-C 120.819 3.637 . . . . 2.0 120.819 -179.367 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 52' ' ' VAL . . . . . . . . . . . . . 18.7 t -99.69 121.17 50.04 Favored 'Isoleucine or valine' 0 CA--C 1.574 1.891 1 N-CA-C 100.091 -4.04 . . . . 2.0 100.091 179.244 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 53' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -121.42 135.57 55.05 Favored 'General case' 0 CA--C 1.574 1.896 0 N-CA-C 117.715 2.487 . . . . 2.0 117.715 -179.198 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 54' ' ' CYS . . . . . . . . . . . . . 31.2 p -118.17 120.14 36.81 Favored 'General case' 0 N--CA 1.495 1.788 0 C-N-CA 124.112 0.965 . . . . 2.0 111.96 179.835 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 25.0 p-10 -63.06 40.5 0.01 OUTLIER 'General case' 0 N--CA 1.506 2.36 1 N-CA-C 123.028 4.455 . . . . 2.0 123.028 -179.509 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 5.9 t -155.16 172.57 17.92 Favored 'General case' 0 N--CA 1.497 1.911 0 O-C-N 119.656 -1.902 . . . . 2.0 113.999 179.946 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 57' ' ' ASP . . . . . . . . . . . . . 85.5 m-20 -67.46 122.44 17.97 Favored 'General case' 0 CA--C 1.568 1.648 0 N-CA-C 116.538 2.051 . . . . 2.0 116.538 -179.851 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 58' ' ' ARG . . . . . . . . . . . . 0.254 37.5 mtm105 56.35 28.81 14.03 Favored 'General case' 0 CA--C 1.574 1.901 0 N-CA-C 117.935 2.568 . . . . 2.0 117.935 179.802 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 59' ' ' CYS . . . . . . . . . . . . . 30.2 p -86.14 14.63 6.07 Favored 'General case' 0 CA--C 1.579 2.074 0 N-CA-C 117.191 2.293 . . . . 2.0 117.191 179.893 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 60' ' ' ASN . . . . . . . . . . . . . 35.7 p-10 . . . . . 0 CA--C 1.561 1.369 0 CA-C-O 124.012 1.863 . . . . 2.0 112.541 -179.948 . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' A' A ' 1' ' ' LEU . . . . . 0.496 ' O ' ' SG ' ' A' ' 14' ' ' CYS . 6.7 tt . . . . . 0 N--CA 1.502 2.175 0 CA-C-O 116.779 -1.581 . . . . 2.0 110.926 . . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 2' ' ' LYS . . . . . 0.45 ' CD ' ' HG ' ' A' ' 11' ' ' SER . 26.3 tttp -111.62 -47.31 3.17 Favored 'General case' 0 N--CA 1.521 3.08 0 CA-C-N 122.72 2.509 . . . . 2.0 113.798 -179.831 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 3' ' ' CYS . . . . . 0.415 ' SG ' HD23 ' A' ' 1' ' ' LEU 0.454 1.9 m 83.09 -136.65 0.01 OUTLIER 'General case' 0 CA--C 1.564 1.518 0 N-CA-C 119.483 3.142 . . . . 2.0 119.483 179.786 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 35.7 m-20 -131.67 131.54 43.21 Favored 'General case' 0 N--CA 1.484 1.242 0 N-CA-C 116.363 1.986 . . . . 2.0 116.363 -179.448 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 5' ' ' LYS . . . . . 0.458 ' H ' ' HB2' ' A' ' 10' ' ' ALA . 19.8 ptmt -76.11 -164.35 0.37 Allowed 'General case' 0 N--CA 1.501 2.077 0 CA-C-N 119.746 1.157 . . . . 2.0 108.398 179.193 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 4.5 mm? -52.65 -30.54 32.25 Favored 'General case' 0 N--CA 1.514 2.753 0 O-C-N 117.617 -3.177 . . . . 2.0 114.586 179.666 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 7' ' ' ILE . . . . . . . . . . . . . 51.2 mm -66.72 132.76 94.05 Favored Pre-proline 0 CA--C 1.587 2.365 0 C-N-CA 125.356 1.462 . . . . 2.0 109.784 179.562 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . 0.314 20.5 Cg_exo -18.61 -71.76 0.02 OUTLIER 'Trans proline' 0 CA--C 1.568 2.225 1 N-CA-C 123.136 4.244 . . . . 2.0 123.136 -179.859 . . . . . . . . 3 2 . 1 . 007 nuclear orig full ' A' A ' 9' ' ' ILE . . . . . . . . . . . . . 17.2 tt -135.37 73.12 0.36 Allowed 'Isoleucine or valine' 0 N--CA 1.503 2.191 0 CA-C-O 122.183 0.992 . . . . 2.0 109.15 179.966 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 10' ' ' ALA . . . . . 0.458 ' HB2' ' H ' ' A' ' 5' ' ' LYS 0.359 . . -71.46 -101.11 0.01 OUTLIER 'General case' 0 CA--C 1.583 2.223 1 N-CA-C 125.576 5.399 . . . . 2.0 125.576 -179.433 . . . . . . . . 4 3 . 1 . 007 nuclear orig full ' A' A ' 11' ' ' SER . . . . . 0.45 ' HG ' ' CD ' ' A' ' 2' ' ' LYS 0.253 4.9 t -63.21 -169.76 0.03 OUTLIER 'General case' 0 CA--C 1.581 2.154 1 N-CA-C 123.356 4.576 . . . . 2.0 123.356 -179.255 . . . . . . . . 4 3 . 1 . 007 nuclear orig full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 6.7 tptp -132.19 -79.55 0.5 Allowed 'General case' 0 CA--C 1.582 2.191 0 N-CA-C 118.921 2.934 . . . . 2.0 118.921 -179.788 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 13' ' ' THR . . . . . . . . . . . . . 8.1 t -134.15 118.5 17.75 Favored 'General case' 0 N--CA 1.511 2.583 0 N-CA-C 120.286 3.439 . . . . 2.0 120.286 -179.615 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 14' ' ' CYS . . . . . 0.56 ' SG ' ' HD2' ' A' ' 18' ' ' LYS . 0.5 OUTLIER -101.56 179.86 0.93 Allowed Pre-proline 0 CA--C 1.596 2.74 0 C-N-CA 125.663 1.585 . . . . 2.0 110.555 179.604 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 15' ' ' PRO . . . . . . . . . . . . . 87.8 Cg_exo -51.26 177.05 0.04 OUTLIER 'Trans proline' 0 CA--C 1.572 2.406 1 N-CA-C 123.606 4.426 . . . . 2.0 123.606 -179.876 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 16' ' ' ALA . . . . . . . . . . . . 0.253 . . 19.06 -164.96 0.0 OUTLIER 'General case' 0 N--CA 1.5 2.075 1 N-CA-C 124.009 4.818 . . . . 2.0 124.009 179.768 . . . . . . . . 3 2 . 1 . 007 nuclear orig full ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . -81.95 37.03 2.51 Favored Glycine 0 N--CA 1.502 3.059 0 O-C-N 119.886 -1.758 . . . . 2.0 113.636 179.503 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 18' ' ' LYS . . . . . 0.56 ' HD2' ' SG ' ' A' ' 14' ' ' CYS . 0.1 OUTLIER -83.51 82.26 8.37 Favored 'General case' 0 CA--C 1.563 1.469 0 C-N-CA 125.613 1.565 . . . . 2.0 106.886 179.937 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 8.5 p30 -69.34 -34.15 74.19 Favored 'General case' 0 CA--C 1.558 1.278 1 N-CA-C 122.715 4.339 . . . . 2.0 122.715 -179.542 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 49.4 mt -68.91 118.36 11.75 Favored 'General case' 0 CA--C 1.56 1.344 0 N-CA-C 115.951 1.834 . . . . 2.0 115.951 -179.844 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 21' ' ' CYS . . . . . 0.535 ' SG ' ' O ' ' A' ' 56' ' ' THR . 34.4 m -81.88 96.39 7.63 Favored 'General case' 0 CA--C 1.572 1.808 0 N-CA-C 103.143 -2.91 . . . . 2.0 103.143 179.304 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 22' ' ' TYR . . . . . . . . . . . . 0.4 0.0 OUTLIER -68.45 158.21 34.2 Favored 'General case' 0 CA--C 1.56 1.34 0 N-CA-C 119.716 3.228 . . . . 2.0 119.716 -179.515 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 29.4 mtmt -131.36 89.36 2.71 Favored 'General case' 0 CA--C 1.557 1.246 1 N-CA-C 99.664 -4.198 . . . . 2.0 99.664 179.466 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 24' ' ' MET . . . . . 0.41 ' HB3' ' H ' ' A' ' 35' ' ' LYS . 20.4 ttt -71.24 68.31 0.5 Allowed 'General case' 0 CA--C 1.571 1.755 0 O-C-N 121.171 -0.956 . . . . 2.0 111.688 -179.842 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 25' ' ' PHE . . . . . . . . . . . . . 11.3 m-30 -59.0 127.18 30.93 Favored 'General case' 0 N--CA 1.486 1.339 0 O-C-N 120.798 -1.189 . . . . 2.0 113.292 -179.932 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 26' ' ' MET . . . . . . . . . . . . . 84.5 mtp -59.95 128.77 38.51 Favored 'General case' 0 N--CA 1.493 1.689 0 CA-C-O 118.048 -0.977 . . . . 2.0 111.577 179.877 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 27' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -54.44 -35.99 63.56 Favored 'General case' 0 N--CA 1.511 2.604 0 CA-C-N 121.474 1.943 . . . . 2.0 112.529 179.62 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 75.6 m -83.96 -14.05 51.84 Favored 'General case' 0 CA--C 1.591 2.54 0 N-CA-C 114.525 1.305 . . . . 2.0 114.525 179.268 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -161.49 77.92 0.55 Allowed 'General case' 0 N--CA 1.499 2.023 0 O-C-N 119.408 -2.058 . . . . 2.0 108.302 179.855 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 2.4 mm? -46.32 -79.99 0.01 OUTLIER 'General case' 0 CA--C 1.576 1.944 1 N-CA-C 123.532 4.642 . . . . 2.0 123.532 -179.399 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 31' ' ' THR . . . . . . . . . . . . 0.337 14.6 t -19.75 -52.44 0.01 OUTLIER 'General case' 0 N--CA 1.508 2.453 1 N-CA-C 122.941 4.423 . . . . 2.0 122.941 -179.689 . . . . . . . . 3 2 . 1 . 007 nuclear orig full ' A' A ' 32' ' ' ILE . . . . . . . . . . . . . 1.8 mp -97.86 106.94 37.36 Favored Pre-proline 0 CA--C 1.591 2.523 0 N-CA-C 101.617 -3.475 . . . . 2.0 101.617 179.545 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 33' ' ' PRO . . . . . . . . . . . . . 3.1 Cg_endo -65.3 167.47 16.47 Favored 'Trans proline' 0 CA--C 1.559 1.772 1 N-CA-C 122.63 4.05 . . . . 2.0 122.63 -179.659 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 34' ' ' VAL . . . . . . . . . . . . . 96.5 t -75.38 -53.37 16.26 Favored 'Isoleucine or valine' 0 CA--C 1.591 2.531 0 N-CA-C 104.546 -2.39 . . . . 2.0 104.546 178.965 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 35' ' ' LYS . . . . . 0.41 ' H ' ' HB3' ' A' ' 24' ' ' MET . 97.6 mttt -149.13 117.82 6.61 Favored 'General case' 0 CA--C 1.552 1.055 0 C-N-CA 125.494 1.518 . . . . 2.0 110.795 179.63 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 36' ' ' ARG . . . . . . . . . . . . 0.358 28.1 ttp180 -88.63 109.59 20.23 Favored 'General case' 0 CA--C 1.594 2.653 0 N-CA-C 101.715 -3.439 . . . . 2.0 101.715 179.689 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . -141.04 -135.81 3.22 Favored Glycine 0 N--CA 1.497 2.764 0 N-CA-C 121.264 3.266 . . . . 2.0 121.264 -179.28 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 38' ' ' CYS . . . . . . . . . . . . . 29.7 p -125.73 141.8 51.83 Favored 'General case' 0 N--CA 1.491 1.598 0 N-CA-C 116.116 1.895 . . . . 2.0 116.116 -179.826 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 39' ' ' ILE . . . . . . . . . . . . . 2.4 tp -164.73 166.69 0.51 Allowed 'Isoleucine or valine' 0 CA--C 1.574 1.881 0 N-CA-C 114.465 1.283 . . . . 2.0 114.465 -179.906 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 40' ' ' ASP . . . . . . . . . . . . . 8.0 p-10 -82.74 -51.51 7.62 Favored 'General case' 0 N--CA 1.505 2.289 0 O-C-N 119.868 -1.77 . . . . 2.0 113.402 179.536 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 87.7 t -133.72 143.28 39.16 Favored 'Isoleucine or valine' 0 CA--C 1.563 1.474 0 N-CA-C 102.271 -3.233 . . . . 2.0 102.271 179.677 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 42' ' ' CYS . . . . . . . . . . . . . 1.0 OUTLIER -57.69 105.41 0.53 Allowed Pre-proline 0 CA--C 1.602 2.967 0 N-CA-C 101.872 -3.381 . . . . 2.0 101.872 179.638 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 43' ' ' PRO . . . . . . . . . . . . . 39.8 Cg_exo -48.41 174.17 0.03 OUTLIER 'Trans proline' 0 C--N 1.371 1.755 1 N-CA-C 126.201 5.423 . . . . 2.0 126.201 -178.638 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 57.2 mttp -72.81 89.22 1.36 Allowed 'General case' 0 CA--C 1.568 1.648 0 CA-C-N 112.889 -1.96 . . . . 2.0 105.927 179.597 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 45' ' ' ASN . . . . . . . . . . . . . 4.1 p-10 -63.62 154.54 32.49 Favored 'General case' 0 CA--C 1.567 1.601 0 N-CA-C 117.301 2.334 . . . . 2.0 117.301 -179.614 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 22.5 t -123.33 -173.18 2.67 Favored 'General case' 0 N--CA 1.485 1.286 0 N-CA-C 113.802 1.038 . . . . 2.0 113.802 179.993 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 47' ' ' LEU . . . . . . . . . . . . 0.35 1.0 OUTLIER -56.7 -15.54 4.75 Favored 'General case' 0 N--CA 1.508 2.463 0 N-CA-C 116.338 1.977 . . . . 2.0 116.338 179.63 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 88.8 mt -101.95 -2.43 29.77 Favored 'General case' 0 CA--C 1.588 2.436 0 C-N-CA 125.986 1.714 . . . . 2.0 111.809 179.138 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 49' ' ' VAL . . . . . . . . . . . . . 11.2 p -154.23 165.37 1.37 Allowed 'Isoleucine or valine' 0 CA--C 1.583 2.236 0 N-CA-C 117.254 2.316 . . . . 2.0 117.254 -179.522 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 61.7 tttp -159.14 93.55 1.15 Allowed 'General case' 0 CA--C 1.573 1.829 1 N-CA-C 99.759 -4.163 . . . . 2.0 99.759 179.394 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 83.8 m-85 -72.41 124.01 24.25 Favored 'General case' 0 CA--C 1.568 1.673 0 N-CA-C 121.363 3.838 . . . . 2.0 121.363 -179.309 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 52' ' ' VAL . . . . . . . . . . . . 0.283 78.9 t -100.01 156.7 4.04 Favored 'Isoleucine or valine' 0 CA--C 1.585 2.307 0 N-CA-C 102.816 -3.031 . . . . 2.0 102.816 179.101 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 53' ' ' CYS . . . . . . . . . . . . 0.324 1.4 p -164.86 160.63 19.63 Favored 'General case' 0 N--CA 1.5 2.04 0 O-C-N 117.33 -3.356 . . . . 2.0 119.329 -179.034 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 54' ' ' CYS . . . . . . . . . . . . 0.395 25.4 p -152.35 119.7 5.95 Favored 'General case' 0 CA--C 1.584 2.258 0 CA-C-O 122.85 1.31 . . . . 2.0 111.866 179.471 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 10.6 m120 -34.01 -9.55 0.0 OUTLIER 'General case' 0 N--CA 1.504 2.234 1 N-CA-C 129.839 6.977 . . . . 2.0 129.839 -179.54 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 56' ' ' THR . . . . . 0.535 ' O ' ' SG ' ' A' ' 21' ' ' CYS . 7.9 t -130.79 161.43 31.77 Favored 'General case' 0 N--CA 1.513 2.687 0 CA-C-N 124.861 3.482 . . . . 2.0 115.727 -179.81 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 57' ' ' ASP . . . . . . . . . . . . . 5.5 m-20 -48.22 120.89 3.86 Favored 'General case' 0 N--CA 1.497 1.902 0 N-CA-C 114.796 1.406 . . . . 2.0 114.796 -179.835 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 58' ' ' ARG . . . . . . . . . . . . 0.281 63.4 mtt180 70.92 9.92 6.87 Favored 'General case' 0 N--CA 1.502 2.141 0 N-CA-C 115.699 1.741 . . . . 2.0 115.699 -179.76 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 59' ' ' CYS . . . . . . . . . . . . . 35.7 t -61.57 -32.22 72.3 Favored 'General case' 0 CA--C 1.574 1.867 0 N-CA-C 115.632 1.716 . . . . 2.0 115.632 179.775 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 60' ' ' ASN . . . . . . . . . . . . . 47.9 p30 . . . . . 0 CA--C 1.567 1.602 0 CA-C-O 124.652 2.168 . . . . 2.0 112.848 179.813 . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' A' A ' 1' ' ' LEU . . . . . 0.503 HD11 ' SG ' ' A' ' 3' ' ' CYS . 0.5 OUTLIER . . . . . 0 CA--C 1.582 2.203 0 CA-C-O 122.467 1.127 . . . . 2.0 112.823 . . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 6.3 tmtt? -145.76 108.3 4.46 Favored 'General case' 0 N--CA 1.494 1.766 0 N-CA-C 101.076 -3.675 . . . . 2.0 101.076 179.855 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 3' ' ' CYS . . . . . 0.503 ' SG ' HD11 ' A' ' 1' ' ' LEU . 71.7 m -123.13 174.75 7.04 Favored 'General case' 0 N--CA 1.495 1.781 0 N-CA-C 119.126 3.01 . . . . 2.0 119.126 -179.474 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 18.0 m-20 -102.84 137.62 40.81 Favored 'General case' 0 CA--C 1.56 1.362 0 C-N-CA 124.193 0.997 . . . . 2.0 110.852 179.778 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 22.0 ptmt -84.84 -160.93 0.52 Allowed 'General case' 0 CA--C 1.593 2.631 0 CA-C-N 120.376 1.444 . . . . 2.0 108.113 179.224 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -46.0 -42.75 13.58 Favored 'General case' 0 N--CA 1.509 2.483 0 N-CA-C 119.136 3.013 . . . . 2.0 119.136 -179.996 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 7' ' ' ILE . . . . . . . . . . . . . 42.6 mm -65.88 138.77 96.54 Favored Pre-proline 0 CA--C 1.585 2.295 0 N-CA-C 115.542 1.682 . . . . 2.0 115.542 -179.74 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 80.0 Cg_exo -48.16 -40.55 34.55 Favored 'Trans proline' 0 CA--C 1.569 2.256 0 N-CA-C 121.063 3.447 . . . . 2.0 121.063 179.844 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 9' ' ' ILE . . . . . . . . . . . . . 34.4 mm -106.39 30.25 0.96 Allowed 'Isoleucine or valine' 0 CA--C 1.589 2.473 0 N-CA-C 114.169 1.174 . . . . 2.0 114.169 -179.817 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -74.52 160.63 30.66 Favored 'General case' 0 CA--C 1.574 1.9 0 O-C-N 118.108 -2.87 . . . . 2.0 117.205 -179.91 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 96.4 p -153.41 119.99 5.59 Favored 'General case' 0 N--CA 1.501 2.115 0 O-C-N 120.448 -1.407 . . . . 2.0 112.27 -179.919 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -148.49 138.69 22.5 Favored 'General case' 0 N--CA 1.497 1.888 0 O-C-N 120.801 -1.187 . . . . 2.0 113.41 -179.804 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 13' ' ' THR . . . . . . . . . . . . . 50.9 m -74.2 130.26 39.4 Favored 'General case' 0 N--CA 1.505 2.32 0 O-C-N 120.574 -1.329 . . . . 2.0 110.897 179.829 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 14' ' ' CYS . . . . . 0.451 ' SG ' ' HD2' ' A' ' 15' ' ' PRO 0.256 12.7 t -135.27 162.51 57.02 Favored Pre-proline 0 CA--C 1.594 2.641 0 N-CA-C 113.99 1.108 . . . . 2.0 113.99 -179.625 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 15' ' ' PRO . . . . . 0.451 ' HD2' ' SG ' ' A' ' 14' ' ' CYS . 68.4 Cg_exo -50.49 161.81 1.12 Allowed 'Trans proline' 0 CA--C 1.575 2.551 1 N-CA-C 125.538 5.169 . . . . 2.0 125.538 -179.822 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 16' ' ' ALA . . . . . 0.434 ' C ' ' H ' ' A' ' 18' ' ' LYS . . . -84.36 171.83 12.31 Favored 'General case' 0 N--CA 1.498 1.954 0 C-N-CA 124.94 1.296 . . . . 2.0 111.757 179.581 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . 81.76 -46.93 3.56 Favored Glycine 1 N--CA 1.523 4.461 0 O-C-N 119.245 -2.159 . . . . 2.0 108.618 -178.938 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 18' ' ' LYS . . . . . 0.434 ' H ' ' C ' ' A' ' 16' ' ' ALA . 72.8 mmtt -78.64 85.44 4.68 Favored 'General case' 0 CA--C 1.575 1.934 0 C-N-CA 129.017 2.927 . . . . 2.0 104.446 179.336 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 8.1 p30 -82.96 -23.97 33.19 Favored 'General case' 0 N--CA 1.496 1.832 0 N-CA-C 119.642 3.201 . . . . 2.0 119.642 -179.775 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 61.9 mt -88.66 121.71 31.32 Favored 'General case' 0 CA--C 1.551 0.998 0 C-N-CA 123.96 0.904 . . . . 2.0 113.11 -179.966 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 1.3 m -82.26 97.42 8.27 Favored 'General case' 0 CA--C 1.577 1.999 1 N-CA-C 99.001 -4.444 . . . . 2.0 99.001 179.064 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 22' ' ' TYR . . . . . . . . . . . . 0.263 0.0 OUTLIER -82.69 153.55 25.29 Favored 'General case' 0 N--CA 1.482 1.163 0 N-CA-C 118.795 2.887 . . . . 2.0 118.795 -179.429 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 13.4 ptmt -126.32 96.65 4.77 Favored 'General case' 0 CA--C 1.561 1.381 0 N-CA-C 103.938 -2.616 . . . . 2.0 103.938 179.629 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 24' ' ' MET . . . . . . . . . . . . 0.28 42.0 ttm -65.1 70.98 0.04 OUTLIER 'General case' 0 CA--C 1.57 1.742 0 C-N-CA 126.301 1.84 . . . . 2.0 113.911 -179.856 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 25' ' ' PHE . . . . . . . . . . . . . 4.0 m-30 -58.09 133.65 55.75 Favored 'General case' 0 N--CA 1.493 1.715 0 O-C-N 120.55 -1.344 . . . . 2.0 114.014 179.939 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 26' ' ' MET . . . . . . . . . . . . . 58.1 mtp -66.62 131.61 46.37 Favored 'General case' 0 N--CA 1.492 1.632 0 CA-C-O 118.609 -0.71 . . . . 2.0 111.948 179.941 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 27' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -54.06 -41.21 67.88 Favored 'General case' 0 N--CA 1.513 2.716 0 CA-C-N 120.702 1.592 . . . . 2.0 112.542 179.562 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 50.5 m -77.89 -35.26 50.99 Favored 'General case' 0 CA--C 1.585 2.299 0 N-CA-C 113.892 1.071 . . . . 2.0 113.892 179.475 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 11.8 t70 -141.19 82.17 1.82 Allowed 'General case' 0 CA--C 1.574 1.88 0 O-C-N 120.635 -1.29 . . . . 2.0 109.383 179.871 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 2.3 mm? -47.73 -71.42 0.07 Allowed 'General case' 0 CA--C 1.579 2.078 0 N-CA-C 119.876 3.287 . . . . 2.0 119.876 -179.671 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 31' ' ' THR . . . . . . . . . . . . . 56.2 p -15.18 -64.32 0.01 OUTLIER 'General case' 0 N--CA 1.511 2.587 0 N-CA-C 121.787 3.995 . . . . 2.0 121.787 -179.814 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 32' ' ' ILE . . . . . . . . . . . . . 1.8 mp -94.78 110.98 52.52 Favored Pre-proline 0 CA--C 1.587 2.392 0 N-CA-C 101.948 -3.353 . . . . 2.0 101.948 179.609 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 33' ' ' PRO . . . . . . . . . . . . . 5.2 Cg_exo -67.03 164.33 30.43 Favored 'Trans proline' 0 CA--C 1.557 1.665 0 N-CA-C 122.201 3.885 . . . . 2.0 122.201 -179.557 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 34' ' ' VAL . . . . . . . . . . . . . 58.7 t -70.74 -45.6 72.99 Favored 'Isoleucine or valine' 0 CA--C 1.595 2.679 0 N-CA-C 106.462 -1.681 . . . . 2.0 106.462 178.883 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 5.3 tptm -152.42 167.78 27.61 Favored 'General case' 0 CA--C 1.567 1.623 0 C-N-CA 126.626 1.97 . . . . 2.0 109.797 179.773 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 12.5 mtt180 -144.3 110.26 5.38 Favored 'General case' 0 CA--C 1.574 1.868 0 N-CA-C 104.196 -2.52 . . . . 2.0 104.196 179.495 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . -141.83 -135.53 3.13 Favored Glycine 0 N--CA 1.494 2.5 0 O-C-N 120.699 -1.25 . . . . 2.0 115.116 -179.872 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 38' ' ' CYS . . . . . . . . . . . . . 16.1 p -129.33 136.23 49.75 Favored 'General case' 0 N--CA 1.491 1.614 0 CA-C-N 118.174 0.987 . . . . 2.0 112.45 179.713 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 39' ' ' ILE . . . . . . . . . . . . . 3.3 tp -150.38 162.08 3.82 Favored 'Isoleucine or valine' 0 CA--C 1.577 2.003 0 N-CA-C 113.78 1.03 . . . . 2.0 113.78 -179.866 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 40' ' ' ASP . . . . . . . . . . . . . 8.1 p-10 -79.64 -49.84 11.53 Favored 'General case' 0 N--CA 1.513 2.713 0 O-C-N 119.139 -2.226 . . . . 2.0 114.504 179.753 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 70.3 t -134.47 143.72 37.1 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.415 0 N-CA-C 102.537 -3.135 . . . . 2.0 102.537 179.645 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 42' ' ' CYS . . . . . . . . . . . . 0.258 1.9 m -57.55 104.95 0.46 Allowed Pre-proline 0 CA--C 1.599 2.836 0 N-CA-C 102.032 -3.321 . . . . 2.0 102.032 179.67 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 43' ' ' PRO . . . . . . . . . . . . . 25.2 Cg_exo -50.75 179.87 0.02 OUTLIER 'Trans proline' 0 C--N 1.371 1.757 1 N-CA-C 125.466 5.141 . . . . 2.0 125.466 -178.693 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 29.9 mtpp -69.79 96.31 0.97 Allowed 'General case' 0 CA--C 1.565 1.522 0 N-CA-C 105.506 -2.035 . . . . 2.0 105.506 179.535 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 45' ' ' ASN . . . . . . . . . . . . 0.252 2.1 p-10 -62.62 112.91 2.69 Favored 'General case' 0 CA--C 1.567 1.604 0 N-CA-C 116.763 2.134 . . . . 2.0 116.763 -179.456 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 12.4 t -80.17 -179.8 7.25 Favored 'General case' 0 CA--C 1.567 1.604 0 N-CA-C 114.511 1.301 . . . . 2.0 114.511 179.943 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 47' ' ' LEU . . . . . . . . . . . . . 93.3 mt -49.77 -28.55 6.38 Favored 'General case' 0 N--CA 1.507 2.39 0 N-CA-C 116.708 2.114 . . . . 2.0 116.708 179.822 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 78.6 mt -102.54 12.73 36.01 Favored 'General case' 0 CA--C 1.579 2.082 0 C-N-CA 124.849 1.259 . . . . 2.0 114.06 179.655 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 49' ' ' VAL . . . . . . . . . . . . . 9.4 p -155.85 158.62 3.29 Favored 'Isoleucine or valine' 0 N--CA 1.502 2.168 0 N-CA-C 118.114 2.635 . . . . 2.0 118.114 -179.699 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 59.9 tttp -153.57 75.51 1.05 Allowed 'General case' 0 CA--C 1.581 2.135 0 N-CA-C 103.011 -2.959 . . . . 2.0 103.011 179.296 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 18.2 m-85 -50.38 120.79 4.88 Favored 'General case' 0 CA--C 1.572 1.806 0 N-CA-C 121.58 3.918 . . . . 2.0 121.58 -179.53 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 52' ' ' VAL . . . . . . . . . . . . 0.256 25.2 t -101.76 140.79 19.46 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.958 0 N-CA-C 101.968 -3.345 . . . . 2.0 101.968 179.294 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 53' ' ' CYS . . . . . . . . . . . . 0.425 6.8 p -155.71 158.95 39.08 Favored 'General case' 0 N--CA 1.493 1.702 0 N-CA-C 118.821 2.897 . . . . 2.0 118.821 -178.866 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 54' ' ' CYS . . . . . . . . . . . . 0.408 21.6 p -148.57 127.57 12.75 Favored 'General case' 0 CA--C 1.579 2.087 0 CA-C-O 122.606 1.193 . . . . 2.0 110.971 179.505 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 12.3 m120 -42.65 16.31 0.0 OUTLIER 'General case' 0 N--CA 1.504 2.262 1 N-CA-C 127.338 6.051 . . . . 2.0 127.338 -179.481 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 6.9 t -148.14 177.27 9.53 Favored 'General case' 0 N--CA 1.501 2.104 0 CA-C-N 123.179 2.718 . . . . 2.0 115.012 -179.935 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 57' ' ' ASP . . . . . . . . . . . . . 43.4 m-20 -62.86 124.03 19.99 Favored 'General case' 0 CA--C 1.56 1.362 0 C-N-CA 124.126 0.971 . . . . 2.0 112.792 -180.0 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 58' ' ' ARG . . . . . . . . . . . . . 71.3 mtp180 64.66 18.73 11.55 Favored 'General case' 0 N--CA 1.499 1.981 0 N-CA-C 117.01 2.226 . . . . 2.0 117.01 -179.962 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 59' ' ' CYS . . . . . . . . . . . . . 36.8 t -71.18 -19.56 62.39 Favored 'General case' 0 CA--C 1.579 2.078 0 N-CA-C 117.081 2.252 . . . . 2.0 117.081 179.902 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 60' ' ' ASN . . . . . . . . . . . . . 10.2 p30 . . . . . 0 CA--C 1.567 1.615 0 CA-C-O 125.21 2.433 . . . . 2.0 112.823 179.803 . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' A' A ' 1' ' ' LEU . . . . . . . . . . . . 0.301 0.3 OUTLIER . . . . . 0 CA--C 1.571 1.788 0 N-CA-C 114.117 1.154 . . . . 2.0 114.117 . . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 28.2 mttp -70.66 128.74 37.11 Favored 'General case' 0 N--CA 1.494 1.748 0 O-C-N 120.735 -1.228 . . . . 2.0 110.451 179.764 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 71.8 m -137.84 -176.52 4.45 Favored 'General case' 0 CA--C 1.566 1.562 0 CA-C-O 122.619 1.2 . . . . 2.0 113.323 -179.816 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 91.8 m-20 -122.86 97.42 5.44 Favored 'General case' 0 CA--C 1.554 1.102 0 C-N-CA 123.583 0.753 . . . . 2.0 111.739 179.957 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . 0.315 22.4 ptmt -56.15 164.14 1.37 Allowed 'General case' 0 CA--C 1.589 2.476 0 CA-C-N 120.396 1.453 . . . . 2.0 112.475 179.465 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 6' ' ' LEU . . . . . . . . . . . . 0.358 2.4 tm? -30.66 -49.52 0.12 Allowed 'General case' 0 N--CA 1.511 2.625 1 N-CA-C 122.648 4.314 . . . . 2.0 122.648 -179.139 . . . . . . . . 3 2 . 1 . 009 nuclear orig full ' A' A ' 7' ' ' ILE . . . . . . . . . . . . . 49.0 mm -55.08 149.16 25.89 Favored Pre-proline 0 CA--C 1.594 2.649 0 N-CA-C 114.425 1.268 . . . . 2.0 114.425 179.889 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 97.3 Cg_exo -47.21 -54.16 5.42 Favored 'Trans proline' 0 CA--C 1.575 2.549 0 C-N-CA 123.059 2.506 . . . . 2.0 118.282 179.881 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 9' ' ' ILE . . . . . . . . . . . . 0.256 10.8 tp -74.65 -48.31 35.05 Favored 'Isoleucine or valine' 0 N--CA 1.507 2.42 0 N-CA-C 114.459 1.281 . . . . 2.0 114.459 179.684 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . 24.52 120.1 0.0 OUTLIER 'General case' 0 CA--C 1.58 2.114 1 N-CA-C 124.202 4.89 . . . . 2.0 124.202 179.739 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 94.1 p -112.18 100.59 8.95 Favored 'General case' 0 CA--C 1.568 1.668 0 N-CA-C 117.116 2.265 . . . . 2.0 117.116 -179.754 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 16.6 tppt? -117.35 127.3 53.92 Favored 'General case' 0 N--CA 1.495 1.805 0 N-CA-C 108.05 -1.092 . . . . 2.0 108.05 179.715 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 13' ' ' THR . . . . . . . . . . . . . 9.8 t -135.99 78.47 1.72 Allowed 'General case' 0 N--CA 1.503 2.185 0 O-C-N 120.782 -1.199 . . . . 2.0 111.398 -179.973 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 14' ' ' CYS . . . . . . . . . . . . 0.272 0.1 OUTLIER -103.88 170.87 5.64 Favored Pre-proline 0 CA--C 1.587 2.398 0 N-CA-C 115.364 1.616 . . . . 2.0 115.364 -179.939 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 15' ' ' PRO . . . . . . . . . . . . . 86.2 Cg_exo -55.72 164.82 4.08 Favored 'Trans proline' 0 N--CA 1.501 1.954 1 N-CA-C 126.197 5.422 . . . . 2.0 126.197 -179.617 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -70.19 175.91 4.24 Favored 'General case' 0 N--CA 1.498 1.946 0 C-N-CA 123.935 0.894 . . . . 2.0 109.437 179.398 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . 83.65 -53.2 4.83 Favored Glycine 1 N--CA 1.518 4.141 0 O-C-N 118.341 -2.724 . . . . 2.0 106.558 -179.101 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 18' ' ' LYS . . . . . 0.465 ' NZ ' ' HD2' ' A' ' 40' ' ' ASP . 18.3 mmtm -80.3 65.83 5.59 Favored 'General case' 0 CA--C 1.602 2.977 0 N-CA-C 103.113 -2.921 . . . . 2.0 103.113 178.926 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 9.8 p30 -64.67 -38.84 92.38 Favored 'General case' 0 N--CA 1.482 1.156 0 N-CA-C 120.69 3.589 . . . . 2.0 120.69 -179.475 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 89.4 mt -72.36 117.02 13.5 Favored 'General case' 0 CA--C 1.55 0.959 0 N-CA-C 115.704 1.742 . . . . 2.0 115.704 -179.764 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 1.5 m -84.79 91.9 8.1 Favored 'General case' 0 CA--C 1.576 1.978 1 N-CA-C 98.902 -4.481 . . . . 2.0 98.902 179.084 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 22' ' ' TYR . . . . . . . . . . . . 0.321 4.4 p90 -65.56 153.69 40.81 Favored 'General case' 0 N--CA 1.481 1.08 0 N-CA-C 119.674 3.212 . . . . 2.0 119.674 -179.368 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 29.5 ttpt -132.21 96.14 3.82 Favored 'General case' 0 CA--C 1.562 1.422 0 N-CA-C 104.171 -2.529 . . . . 2.0 104.171 179.857 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 24' ' ' MET . . . . . 0.518 ' SD ' ' HB3' ' A' ' 35' ' ' LYS . 15.0 ttt -68.12 86.05 0.25 Allowed 'General case' 0 CA--C 1.567 1.609 0 N-CA-C 114.356 1.243 . . . . 2.0 114.356 -179.722 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 25' ' ' PHE . . . . . . . . . . . . . 3.0 m-30 -81.76 108.51 15.35 Favored 'General case' 0 CA--C 1.569 1.696 0 N-CA-C 105.153 -2.166 . . . . 2.0 105.153 179.649 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 26' ' ' MET . . . . . . . . . . . . . 22.3 ttt -58.11 137.99 56.47 Favored 'General case' 0 N--CA 1.496 1.841 0 O-C-N 120.885 -1.134 . . . . 2.0 113.864 -179.864 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 27' ' ' MET . . . . . . . . . . . . . 2.2 mmt -48.21 -39.69 21.94 Favored 'General case' 0 N--CA 1.508 2.456 0 N-CA-C 115.359 1.614 . . . . 2.0 115.359 179.929 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 59.4 m -80.76 -38.91 27.79 Favored 'General case' 0 CA--C 1.584 2.275 0 C-N-CA 123.611 0.765 . . . . 2.0 112.932 179.538 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 59.0 t0 -132.63 99.44 4.64 Favored 'General case' 0 CA--C 1.572 1.825 0 N-CA-C 106.573 -1.64 . . . . 2.0 106.573 179.733 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 2.4 mm? -76.55 -77.35 0.14 Allowed 'General case' 0 CA--C 1.578 2.046 0 N-CA-C 117.59 2.441 . . . . 2.0 117.59 -179.658 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 31' ' ' THR . . . . . . . . . . . . . 56.5 p -14.24 -69.81 0.01 OUTLIER 'General case' 0 N--CA 1.511 2.58 0 N-CA-C 121.15 3.759 . . . . 2.0 121.15 -179.804 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 32' ' ' ILE . . . . . . . . . . . . . 2.0 mp -89.44 112.47 51.73 Favored Pre-proline 0 CA--C 1.589 2.451 1 N-CA-C 99.562 -4.236 . . . . 2.0 99.562 179.552 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 33' ' ' PRO . . . . . . . . . . . . . 6.0 Cg_exo -66.87 158.19 57.73 Favored 'Trans proline' 0 CA--C 1.554 1.512 0 N-CA-C 119.706 2.925 . . . . 2.0 119.706 -179.41 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 34' ' ' VAL . . . . . . . . . . . . 0.255 13.2 m -85.16 -37.18 12.0 Favored 'Isoleucine or valine' 0 CA--C 1.585 2.315 0 CA-C-O 121.627 0.727 . . . . 2.0 109.82 179.078 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 35' ' ' LYS . . . . . 0.518 ' HB3' ' SD ' ' A' ' 24' ' ' MET . 34.8 ttmt -145.66 163.87 33.53 Favored 'General case' 0 CA--C 1.569 1.706 0 CA-C-O 123.72 1.724 . . . . 2.0 109.293 179.59 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 14.4 mtp180 -145.39 132.22 20.11 Favored 'General case' 0 CA--C 1.576 1.964 0 N-CA-C 102.815 -3.031 . . . . 2.0 102.815 179.585 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . -153.21 -146.35 4.35 Favored Glycine 0 N--CA 1.488 2.162 0 O-C-N 119.797 -1.815 . . . . 2.0 117.61 -179.775 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 38' ' ' CYS . . . . . . . . . . . . . 10.5 p -129.33 132.5 47.12 Favored 'General case' 0 CA--C 1.571 1.765 0 C-N-CA 123.668 0.787 . . . . 2.0 111.481 179.944 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 39' ' ' ILE . . . . . . . . . . . . . 9.9 tp -158.98 172.66 0.39 Allowed 'Isoleucine or valine' 0 N--CA 1.503 2.198 0 O-C-N 120.692 -1.255 . . . . 2.0 113.08 -179.773 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 40' ' ' ASP . . . . . 0.465 ' HD2' ' NZ ' ' A' ' 18' ' ' LYS . 0.0 OUTLIER -95.3 -46.39 6.75 Favored 'General case' 0 N--CA 1.498 1.945 0 O-C-N 119.858 -1.776 . . . . 2.0 114.173 179.724 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 69.0 t -130.87 25.82 1.63 Allowed 'Isoleucine or valine' 0 N--CA 1.512 2.631 0 N-CA-C 114.934 1.457 . . . . 2.0 114.934 -179.584 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 42' ' ' CYS . . . . . . . . . . . . 0.283 2.8 m 81.21 114.07 0.03 OUTLIER Pre-proline 0 N--CA 1.526 3.339 1 N-CA-C 96.337 -5.431 . . . . 2.0 96.337 -179.15 . . . . . . . . 3 2 . 1 . 009 nuclear orig full ' A' A ' 43' ' ' PRO . . . . . . . . . . . . 0.472 31.5 Cg_exo -34.46 -96.52 0.0 OUTLIER 'Trans proline' 0 CA--C 1.565 2.027 1 N-CA-C 123.617 4.43 . . . . 2.0 123.617 -178.832 . . . . . . . . 3 2 . 1 . 009 nuclear orig full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 44.7 mttm -159.28 95.86 1.27 Allowed 'General case' 0 CA--C 1.562 1.426 1 N-CA-C 98.706 -4.553 . . . . 2.0 98.706 179.696 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 45' ' ' ASN . . . . . . . . . . . . . 5.2 p-10 -72.91 -168.3 0.46 Allowed 'General case' 0 CA--C 1.572 1.812 0 N-CA-C 117.793 2.516 . . . . 2.0 117.793 -179.594 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 46' ' ' SER . . . . . . . . . . . . 0.349 5.5 t 80.79 -41.6 0.18 Allowed 'General case' 0 N--CA 1.491 1.605 0 N-CA-C 118.236 2.68 . . . . 2.0 118.236 179.907 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 47' ' ' LEU . . . . . . . . . . . . 0.252 2.7 pp -49.36 -51.1 36.83 Favored 'General case' 0 N--CA 1.508 2.473 0 CA-C-N 120.724 1.602 . . . . 2.0 113.07 179.696 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 92.3 mt -155.37 27.44 0.4 Allowed 'General case' 0 CA--C 1.589 2.444 0 C-N-CA 126.688 1.995 . . . . 2.0 108.269 179.428 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 49' ' ' VAL . . . . . . . . . . . . . 14.5 p -169.33 168.24 0.27 Allowed 'Isoleucine or valine' 0 CA--C 1.582 2.201 0 N-CA-C 118.932 2.938 . . . . 2.0 118.932 -179.139 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 28.4 ttpt -146.92 74.26 1.34 Allowed 'General case' 0 CA--C 1.581 2.141 0 N-CA-C 102.251 -3.24 . . . . 2.0 102.251 178.977 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 54.3 m-85 -53.04 126.45 20.64 Favored 'General case' 0 CA--C 1.572 1.816 0 N-CA-C 120.187 3.403 . . . . 2.0 120.187 -179.41 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 52' ' ' VAL . . . . . . . . . . . . . 55.9 t -100.43 110.86 28.43 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.853 0 N-CA-C 101.176 -3.639 . . . . 2.0 101.176 179.371 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 53' ' ' CYS . . . . . . . . . . . . 0.312 1.4 p -123.68 136.61 54.57 Favored 'General case' 0 CA--C 1.569 1.709 0 N-CA-C 118.406 2.743 . . . . 2.0 118.406 -179.211 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 54' ' ' CYS . . . . . . . . . . . . 0.307 19.6 p -128.41 124.92 37.48 Favored 'General case' 0 CA--C 1.578 2.026 0 CA-C-O 122.722 1.248 . . . . 2.0 110.533 179.75 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 12.4 p-10 -52.9 32.36 0.0 OUTLIER 'General case' 0 N--CA 1.498 1.964 1 N-CA-C 127.675 6.176 . . . . 2.0 127.675 -179.544 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 56' ' ' THR . . . . . . . . . . . . 0.256 9.4 t -150.24 170.01 20.0 Favored 'General case' 0 N--CA 1.501 2.114 0 O-C-N 119.342 -2.098 . . . . 2.0 114.238 179.95 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 57' ' ' ASP . . . . . . . . . . . . . 39.5 m-20 -62.0 118.96 7.97 Favored 'General case' 0 N--CA 1.488 1.427 0 N-CA-C 113.894 1.072 . . . . 2.0 113.894 -179.925 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 58' ' ' ARG . . . . . . . . . . . . 0.277 21.5 mtt85 65.84 18.69 11.19 Favored 'General case' 0 N--CA 1.498 1.941 0 N-CA-C 117.403 2.372 . . . . 2.0 117.403 -179.881 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 59' ' ' CYS . . . . . . . . . . . . . 48.4 t -63.78 -32.47 73.98 Favored 'General case' 0 CA--C 1.577 1.999 0 N-CA-C 116.567 2.062 . . . . 2.0 116.567 179.899 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 60' ' ' ASN . . . . . . . . . . . . . 19.6 p30 . . . . . 0 CA--C 1.566 1.566 0 CA-C-O 124.993 2.33 . . . . 2.0 114.58 179.859 . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' A' A ' 1' ' ' LEU . . . . . 0.444 HD22 ' SG ' ' A' ' 3' ' ' CYS . 6.2 tp . . . . . 0 CA--C 1.572 1.824 0 N-CA-C 114.727 1.381 . . . . 2.0 114.727 . . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 15.8 mtmm -86.77 140.96 29.21 Favored 'General case' 0 CA--C 1.576 1.946 0 O-C-N 120.993 -1.067 . . . . 2.0 108.314 179.549 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 3' ' ' CYS . . . . . 0.444 ' SG ' HD22 ' A' ' 1' ' ' LEU . 85.7 m -137.39 174.41 10.63 Favored 'General case' 0 N--CA 1.499 1.988 0 O-C-N 119.339 -2.101 . . . . 2.0 115.251 -179.906 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 60.8 m-20 -123.65 103.41 8.4 Favored 'General case' 0 CA--C 1.574 1.868 0 N-CA-C 119.119 3.007 . . . . 2.0 119.119 -179.839 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 19.2 ptmt -59.23 170.62 0.9 Allowed 'General case' 0 CA--C 1.6 2.875 0 O-C-N 119.67 -1.893 . . . . 2.0 111.934 179.264 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 4.2 mm? -31.37 -49.99 0.16 Allowed 'General case' 0 N--CA 1.511 2.58 1 N-CA-C 122.234 4.161 . . . . 2.0 122.234 -179.758 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 7' ' ' ILE . . . . . . . . . . . . . 20.9 mt -69.57 148.11 96.81 Favored Pre-proline 0 CA--C 1.584 2.258 0 N-CA-C 115.256 1.576 . . . . 2.0 115.256 -179.816 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 82.6 Cg_exo -51.47 -48.3 21.97 Favored 'Trans proline' 0 CA--C 1.574 2.475 0 C-N-CA 123.154 2.57 . . . . 2.0 117.167 179.681 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 9' ' ' ILE . . . . . . . . . . . . 0.283 11.3 tp -61.85 -46.49 96.41 Favored 'Isoleucine or valine' 0 N--CA 1.511 2.593 0 CA-C-N 119.712 1.142 . . . . 2.0 112.444 179.521 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . 54.51 175.77 0.03 OUTLIER 'General case' 0 CA--C 1.579 2.091 1 N-CA-C 126.484 5.735 . . . . 2.0 126.484 179.336 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 8.7 t -68.68 -169.99 0.19 Allowed 'General case' 0 CA--C 1.58 2.099 0 N-CA-C 118.548 2.796 . . . . 2.0 118.548 -179.833 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . 0.297 2.5 tppp? -106.01 -90.66 0.41 Allowed 'General case' 0 CA--C 1.572 1.819 1 N-CA-C 122.967 4.432 . . . . 2.0 122.967 -179.545 . . . . . . . . 3 2 . 1 . 010 nuclear orig full ' A' A ' 13' ' ' THR . . . . . . . . . . . . . 7.8 t -154.39 165.15 37.3 Favored 'General case' 0 N--CA 1.51 2.543 1 N-CA-C 121.903 4.038 . . . . 2.0 121.903 -179.116 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -132.62 170.15 12.12 Favored Pre-proline 0 CA--C 1.599 2.854 0 C-N-CA 126.119 1.767 . . . . 2.0 108.717 179.331 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 15' ' ' PRO . . . . . . . . . . . . . 61.0 Cg_exo -59.3 -179.11 0.16 Allowed 'Trans proline' 0 CA--C 1.574 2.488 1 N-CA-C 124.941 4.939 . . . . 2.0 124.941 -179.784 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -78.83 164.12 24.76 Favored 'General case' 0 N--CA 1.5 2.04 0 N-CA-C 106.174 -1.787 . . . . 2.0 106.174 179.278 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . 84.45 -48.58 4.08 Favored Glycine 1 N--CA 1.523 4.437 0 N-CA-C 105.714 -2.954 . . . . 2.0 105.714 -178.769 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 28.4 mmtm -81.69 63.9 6.16 Favored 'General case' 0 CA--C 1.596 2.731 0 N-CA-C 102.052 -3.314 . . . . 2.0 102.052 178.698 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 45.5 p-10 -84.09 -13.59 52.64 Favored 'General case' 0 N--CA 1.487 1.397 0 N-CA-C 121.034 3.716 . . . . 2.0 121.034 -179.451 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 76.8 mt -91.14 113.84 26.21 Favored 'General case' 0 CA--C 1.553 1.087 0 CA-C-N 119.083 0.856 . . . . 2.0 111.166 179.862 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 1.8 m -80.32 94.12 6.06 Favored 'General case' 0 CA--C 1.574 1.9 0 N-CA-C 101.303 -3.592 . . . . 2.0 101.303 179.235 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 22' ' ' TYR . . . . . . . . . . . . 0.302 0.0 OUTLIER -72.26 148.13 45.77 Favored 'General case' 0 CA--C 1.551 0.993 0 N-CA-C 121.446 3.869 . . . . 2.0 121.446 -179.313 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 58.5 mttp -111.29 92.2 3.95 Favored 'General case' 0 CA--C 1.561 1.38 1 N-CA-C 99.233 -4.358 . . . . 2.0 99.233 179.249 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 24' ' ' MET . . . . . . . . . . . . . 27.9 ttt -72.24 67.99 0.72 Allowed 'General case' 0 CA--C 1.573 1.852 0 O-C-N 120.811 -1.181 . . . . 2.0 111.55 -179.873 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 25' ' ' PHE . . . . . . . . . . . . . 10.8 m-30 -57.64 131.19 49.48 Favored 'General case' 0 N--CA 1.486 1.362 0 N-CA-C 114.804 1.409 . . . . 2.0 114.804 -179.861 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 26' ' ' MET . . . . . . . . . . . . . 42.3 mtt -65.58 130.81 44.61 Favored 'General case' 0 N--CA 1.493 1.698 0 CA-C-O 118.536 -0.745 . . . . 2.0 110.74 179.778 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 27' ' ' MET . . . . . . . . . . . . . 8.6 tmm? -56.47 -35.24 67.72 Favored 'General case' 0 N--CA 1.51 2.543 0 CA-C-N 121.106 1.775 . . . . 2.0 112.131 179.561 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 49.2 m -76.32 -36.49 58.26 Favored 'General case' 0 CA--C 1.586 2.364 0 C-N-CA 124.276 1.031 . . . . 2.0 113.14 179.315 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 10.3 t0 -144.21 84.2 1.76 Allowed 'General case' 0 CA--C 1.577 1.992 0 O-C-N 120.692 -1.255 . . . . 2.0 107.766 179.794 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 1.9 mm? -48.46 -74.63 0.03 OUTLIER 'General case' 0 CA--C 1.574 1.887 0 N-CA-C 121.002 3.704 . . . . 2.0 121.002 -179.482 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 31' ' ' THR . . . . . . . . . . . . 0.283 12.2 t -18.41 -60.2 0.02 OUTLIER 'General case' 0 N--CA 1.508 2.44 0 N-CA-C 121.366 3.839 . . . . 2.0 121.366 -179.942 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 32' ' ' ILE . . . . . . . . . . . . . 1.8 mp -95.9 103.76 14.34 Favored Pre-proline 0 CA--C 1.59 2.491 0 N-CA-C 101.414 -3.551 . . . . 2.0 101.414 179.641 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 33' ' ' PRO . . . . . . . . . . . . . 55.6 Cg_endo -65.69 170.3 11.49 Favored 'Trans proline' 0 CA--C 1.56 1.791 1 N-CA-C 123.571 4.412 . . . . 2.0 123.571 -179.521 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 34' ' ' VAL . . . . . . . . . . . . . 54.9 t -73.04 -50.64 30.75 Favored 'Isoleucine or valine' 0 CA--C 1.594 2.642 0 N-CA-C 105.303 -2.11 . . . . 2.0 105.303 178.889 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 2.0 tptm -141.5 157.68 44.82 Favored 'General case' 0 CA--C 1.562 1.43 0 C-N-CA 126.618 1.967 . . . . 2.0 109.007 179.654 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 36' ' ' ARG . . . . . . . . . . . . 0.333 45.2 ttp180 -132.61 67.54 1.53 Allowed 'General case' 0 N--CA 1.498 1.937 0 N-CA-C 104.069 -2.567 . . . . 2.0 104.069 179.484 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . -94.23 -142.75 12.66 Favored Glycine 0 CA--C 1.545 1.924 1 N-CA-C 124.788 4.675 . . . . 2.0 124.788 -179.439 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 38' ' ' CYS . . . . . 0.415 ' HB2' ' SG ' ' A' ' 3' ' ' CYS 0.275 40.3 t -129.86 131.65 46.17 Favored 'General case' 0 CA--C 1.567 1.6 0 C-N-CA 125.23 1.412 . . . . 2.0 113.588 -179.575 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 39' ' ' ILE . . . . . . . . . . . . . 4.4 tp -153.75 172.95 0.68 Allowed 'Isoleucine or valine' 0 N--CA 1.504 2.23 0 N-CA-C 115.079 1.511 . . . . 2.0 115.079 -179.72 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 40' ' ' ASP . . . . . . . . . . . . . 10.1 p-10 -84.67 -54.98 4.35 Favored 'General case' 0 N--CA 1.513 2.677 0 O-C-N 119.315 -2.116 . . . . 2.0 113.683 179.694 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 73.5 t -128.34 148.39 32.83 Favored 'Isoleucine or valine' 0 CA--C 1.564 1.51 0 N-CA-C 103.16 -2.904 . . . . 2.0 103.16 179.522 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 42' ' ' CYS . . . . . . . . . . . . . 1.0 OUTLIER -61.42 105.22 0.56 Allowed Pre-proline 0 CA--C 1.603 2.988 1 N-CA-C 99.936 -4.098 . . . . 2.0 99.936 179.456 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 43' ' ' PRO . . . . . . . . . . . . 0.257 25.9 Cg_exo -49.6 175.93 0.03 OUTLIER 'Trans proline' 0 C--N 1.372 1.77 1 N-CA-C 125.23 5.05 . . . . 2.0 125.23 -178.555 . . . . . . . . 3 2 . 1 . 010 nuclear orig full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 97.3 mttt -72.72 92.5 1.56 Allowed 'General case' 0 CA--C 1.569 1.684 0 N-CA-C 106.388 -1.708 . . . . 2.0 106.388 179.579 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 45' ' ' ASN . . . . . . . . . . . . . 2.6 p-10 -65.53 156.89 31.19 Favored 'General case' 0 CA--C 1.565 1.531 0 N-CA-C 116.429 2.011 . . . . 2.0 116.429 -179.607 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 11.3 t -132.44 -170.45 2.43 Favored 'General case' 0 N--CA 1.487 1.394 0 N-CA-C 113.614 0.968 . . . . 2.0 113.614 179.896 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 47' ' ' LEU . . . . . . . . . . . . 0.285 3.9 pp -58.41 -10.99 2.41 Favored 'General case' 0 N--CA 1.507 2.388 0 N-CA-C 117.125 2.268 . . . . 2.0 117.125 179.836 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 85.3 mt -104.57 -7.64 19.57 Favored 'General case' 0 CA--C 1.584 2.253 0 C-N-CA 126.281 1.833 . . . . 2.0 112.418 179.437 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 49' ' ' VAL . . . . . . . . . . . . . 8.1 p -156.17 164.33 1.27 Allowed 'Isoleucine or valine' 0 CA--C 1.579 2.085 0 N-CA-C 116.906 2.187 . . . . 2.0 116.906 -179.615 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 58.0 tttp -159.04 76.09 0.7 Allowed 'General case' 0 CA--C 1.577 2.015 0 N-CA-C 104.585 -2.376 . . . . 2.0 104.585 179.32 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 33.4 m-85 -51.76 126.04 16.73 Favored 'General case' 0 CA--C 1.571 1.755 1 N-CA-C 123.162 4.504 . . . . 2.0 123.162 -179.509 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 52' ' ' VAL . . . . . . . . . . . . 0.294 14.7 t -104.86 154.58 6.36 Favored 'Isoleucine or valine' 0 CA--C 1.581 2.143 0 N-CA-C 102.642 -3.095 . . . . 2.0 102.642 179.016 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 53' ' ' CYS . . . . . . . . . . . . . 1.3 p -153.0 159.94 42.96 Favored 'General case' 0 N--CA 1.496 1.857 0 O-C-N 117.851 -3.031 . . . . 2.0 118.277 -179.16 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 54' ' ' CYS . . . . . . . . . . . . . 27.6 p -145.23 120.66 10.32 Favored 'General case' 0 CA--C 1.574 1.879 0 C-N-CA 123.801 0.84 . . . . 2.0 110.358 179.784 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 16.0 m120 -55.18 12.26 0.0 OUTLIER 'General case' 0 N--CA 1.508 2.46 1 N-CA-C 124.719 5.081 . . . . 2.0 124.719 -179.618 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 56' ' ' THR . . . . . . . . . . . . 0.253 5.5 t -137.88 176.93 8.27 Favored 'General case' 0 N--CA 1.505 2.29 0 CA-C-N 123.078 2.672 . . . . 2.0 116.071 -179.91 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 57' ' ' ASP . . . . . . . . . . . . . 72.1 m-20 -63.68 121.11 13.16 Favored 'General case' 0 CA--C 1.567 1.633 0 N-CA-C 115.528 1.677 . . . . 2.0 115.528 -179.788 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 58' ' ' ARG . . . . . . . . . . . . 0.29 23.4 mtt180 59.65 14.76 4.21 Favored 'General case' 0 N--CA 1.503 2.203 0 N-CA-C 117.959 2.577 . . . . 2.0 117.959 -179.901 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 59' ' ' CYS . . . . . . . . . . . . . 29.3 p -68.0 -14.22 62.8 Favored 'General case' 0 N--CA 1.496 1.864 0 N-CA-C 118.349 2.722 . . . . 2.0 118.349 179.947 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 60' ' ' ASN . . . . . . . . . . . . . 32.5 p-10 . . . . . 0 CA--C 1.56 1.346 0 CA-C-O 125.216 2.436 . . . . 2.0 111.598 179.848 . . . . . . . . 0 0 . 1 . 011 nuclear orig full ' A' A ' 1' ' ' LEU . . . . . 0.56 HD11 ' SG ' ' A' ' 3' ' ' CYS . 0.4 OUTLIER . . . . . 0 CA--C 1.576 1.953 0 CA-C-O 122.51 1.148 . . . . 2.0 111.639 . . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 2.7 mppt? -145.0 97.74 3.06 Favored 'General case' 0 N--CA 1.486 1.371 0 N-CA-C 101.855 -3.387 . . . . 2.0 101.855 179.533 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 3' ' ' CYS . . . . . 0.56 ' SG ' HD11 ' A' ' 1' ' ' LEU . 72.6 m -105.48 -166.48 1.22 Allowed 'General case' 0 N--CA 1.49 1.562 0 N-CA-C 115.416 1.636 . . . . 2.0 115.416 -179.691 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 78.3 m-20 -126.68 121.42 32.05 Favored 'General case' 0 CA--C 1.559 1.3 0 CA-C-O 116.751 -1.595 . . . . 2.0 108.951 179.778 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 5' ' ' LYS . . . . . 0.448 ' HG2' ' H ' ' A' ' 11' ' ' SER . 0.0 OUTLIER -71.61 178.64 3.44 Favored 'General case' 0 CA--C 1.588 2.427 0 CA-C-N 123.579 2.9 . . . . 2.0 110.756 179.452 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 68.1 tp -58.41 -54.14 50.38 Favored 'General case' 0 N--CA 1.506 2.344 0 O-C-N 118.944 -2.347 . . . . 2.0 116.614 -179.768 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 7' ' ' ILE . . . . . . . . . . . . . 53.9 mt -52.21 141.71 30.31 Favored Pre-proline 0 CA--C 1.586 2.357 0 CA-C-O 117.175 -1.393 . . . . 2.0 114.515 -179.838 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 63.1 Cg_exo -39.03 -47.26 2.9 Favored 'Trans proline' 0 C--N 1.378 2.094 0 N-CA-C 120.271 3.143 . . . . 2.0 120.271 179.901 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 9' ' ' ILE . . . . . . . . . . . . . 11.3 tp -60.74 -39.55 82.08 Favored 'Isoleucine or valine' 0 N--CA 1.507 2.402 0 N-CA-C 113.932 1.086 . . . . 2.0 113.932 179.617 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . 48.55 111.34 0.0 OUTLIER 'General case' 0 CA--C 1.579 2.06 1 N-CA-C 123.97 4.804 . . . . 2.0 123.97 179.384 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 11' ' ' SER . . . . . 0.448 ' H ' ' HG2' ' A' ' 5' ' ' LYS . 98.2 p -58.05 153.45 14.57 Favored 'General case' 0 N--CA 1.501 2.082 0 C-N-CA 124.605 1.162 . . . . 2.0 114.117 179.689 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . 0.279 81.4 tttt -90.93 -93.32 0.13 Allowed 'General case' 0 CA--C 1.581 2.165 0 N-CA-C 121.493 3.886 . . . . 2.0 121.493 -179.544 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 13' ' ' THR . . . . . . . . . . . . . 33.4 m -41.91 136.81 1.95 Allowed 'General case' 0 N--CA 1.498 1.974 0 N-CA-C 120.47 3.507 . . . . 2.0 120.47 -179.567 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 4.1 t -153.19 153.75 29.92 Favored Pre-proline 0 CA--C 1.601 2.934 0 C-N-CA 124.793 1.237 . . . . 2.0 111.226 -179.959 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 15' ' ' PRO . . . . . . . . . . . . . 65.7 Cg_exo -45.27 160.36 0.14 Allowed 'Trans proline' 0 CA--C 1.579 2.741 1 N-CA-C 126.083 5.378 . . . . 2.0 126.083 -179.819 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 16' ' ' ALA . . . . . 0.419 ' C ' ' H ' ' A' ' 18' ' ' LYS . . . -82.27 168.22 17.82 Favored 'General case' 0 N--CA 1.5 2.064 0 C-N-CA 125.177 1.391 . . . . 2.0 112.944 179.731 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . 82.96 -49.65 4.26 Favored Glycine 1 N--CA 1.522 4.374 0 N-CA-C 108.162 -1.975 . . . . 2.0 108.162 -179.01 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 18' ' ' LYS . . . . . 0.419 ' H ' ' C ' ' A' ' 16' ' ' ALA . 30.1 mmtm -72.41 94.8 1.68 Allowed 'General case' 0 CA--C 1.575 1.915 0 C-N-CA 129.32 3.048 . . . . 2.0 105.898 179.354 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 10.2 p30 -94.11 -25.03 17.33 Favored 'General case' 0 N--CA 1.498 1.932 0 N-CA-C 117.212 2.301 . . . . 2.0 117.212 179.913 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 70.2 mt -84.05 111.22 19.11 Favored 'General case' 0 CA--C 1.558 1.28 0 C-N-CA 125.596 1.558 . . . . 2.0 113.617 179.968 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 2.0 m -81.25 101.31 9.64 Favored 'General case' 0 CA--C 1.578 2.026 1 N-CA-C 99.621 -4.214 . . . . 2.0 99.621 179.158 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 22' ' ' TYR . . . . . . . . . . . . . 5.8 p90 -83.66 164.26 19.78 Favored 'General case' 0 N--CA 1.48 1.074 0 N-CA-C 120.843 3.646 . . . . 2.0 120.843 -179.31 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . 0.303 10.6 ptpp? -137.66 101.87 4.59 Favored 'General case' 0 CA--C 1.566 1.577 0 N-CA-C 104.389 -2.448 . . . . 2.0 104.389 179.306 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 24' ' ' MET . . . . . . . . . . . . . 4.7 ttt -65.41 92.8 0.13 Allowed 'General case' 0 CA--C 1.563 1.442 0 C-N-CA 125.149 1.38 . . . . 2.0 114.07 -179.803 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 25' ' ' PHE . . . . . . . . . . . . . 5.3 m-30 -81.61 104.14 11.82 Favored 'General case' 0 CA--C 1.568 1.636 0 N-CA-C 103.853 -2.647 . . . . 2.0 103.853 179.491 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 26' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -57.09 127.72 33.37 Favored 'General case' 0 N--CA 1.494 1.753 0 O-C-N 120.797 -1.189 . . . . 2.0 112.279 -179.809 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 27' ' ' MET . . . . . . . . . . . . . 0.1 OUTLIER -48.82 -32.74 9.24 Favored 'General case' 0 N--CA 1.509 2.496 0 N-CA-C 116.613 2.079 . . . . 2.0 116.613 -179.944 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 50.5 m -75.03 -30.61 61.13 Favored 'General case' 0 CA--C 1.592 2.594 0 O-C-N 121.512 -0.743 . . . . 2.0 112.238 179.162 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 56.5 t0 -151.04 92.2 1.79 Allowed 'General case' 0 CA--C 1.571 1.769 0 N-CA-C 105.083 -2.191 . . . . 2.0 105.083 179.687 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 3.2 mm? -65.56 -66.7 0.51 Allowed 'General case' 0 CA--C 1.571 1.769 0 N-CA-C 118.837 2.903 . . . . 2.0 118.837 -179.526 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 31' ' ' THR . . . . . . . . . . . . . 72.1 p -33.83 -48.44 0.29 Allowed 'General case' 0 N--CA 1.506 2.355 0 N-CA-C 120.457 3.503 . . . . 2.0 120.457 -179.704 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 32' ' ' ILE . . . . . . . . . . . . . 2.1 mp -93.96 107.27 26.88 Favored Pre-proline 0 CA--C 1.586 2.356 0 N-CA-C 101.606 -3.479 . . . . 2.0 101.606 179.554 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 33' ' ' PRO . . . . . . . . . . . . . 12.6 Cg_exo -68.79 149.08 72.55 Favored 'Trans proline' 0 CA--C 1.561 1.842 0 N-CA-C 118.383 2.417 . . . . 2.0 118.383 -179.602 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 34' ' ' VAL . . . . . . . . . . . . 0.283 24.5 t -86.75 -29.77 5.88 Favored 'Isoleucine or valine' 0 CA--C 1.583 2.249 0 C-N-CA 123.579 0.751 . . . . 2.0 111.543 179.421 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER -144.81 167.02 23.58 Favored 'General case' 0 CA--C 1.559 1.317 0 CA-C-O 123.602 1.668 . . . . 2.0 110.067 179.453 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 6.6 mtp180 -150.69 108.89 3.75 Favored 'General case' 0 CA--C 1.571 1.773 0 N-CA-C 104.814 -2.291 . . . . 2.0 104.814 -179.867 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . -140.97 -144.58 4.46 Favored Glycine 0 N--CA 1.498 2.824 0 N-CA-C 118.393 2.117 . . . . 2.0 118.393 -179.697 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 38' ' ' CYS . . . . . . . . . . . . . 20.8 p -130.93 131.99 44.81 Favored 'General case' 0 N--CA 1.494 1.738 0 N-CA-C 113.653 0.983 . . . . 2.0 113.653 179.99 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 39' ' ' ILE . . . . . . . . . . . . . 9.6 tp -152.85 175.83 0.58 Allowed 'Isoleucine or valine' 0 N--CA 1.498 1.969 0 C-N-CA 124.182 0.993 . . . . 2.0 112.751 -179.839 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 40' ' ' ASP . . . . . . . . . . . . . 13.3 p-10 -108.02 -28.88 9.3 Favored 'General case' 0 N--CA 1.497 1.908 0 O-C-N 119.527 -1.983 . . . . 2.0 113.53 179.354 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 8.0 t -140.35 27.54 0.48 Allowed 'Isoleucine or valine' 0 N--CA 1.506 2.334 0 CA-C-N 120.134 1.334 . . . . 2.0 112.649 179.952 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 42' ' ' CYS . . . . . . . . . . . . 0.359 2.8 m 77.11 115.75 0.03 OUTLIER Pre-proline 0 CA--C 1.615 3.469 1 N-CA-C 97.03 -5.174 . . . . 2.0 97.03 -179.221 . . . . . . . . 3 2 . 1 . 011 nuclear orig full ' A' A ' 43' ' ' PRO . . . . . . . . . . . . 0.45 80.0 Cg_exo -30.06 -60.06 0.13 Allowed 'Trans proline' 0 C--N 1.371 1.745 1 N-CA-C 127.799 6.038 . . . . 2.0 127.799 -178.484 . . . . . . . . 3 2 . 1 . 011 nuclear orig full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 9.1 mtmm 160.78 91.14 0.0 OUTLIER 'General case' 0 CA--C 1.561 1.373 1 N-CA-C 98.512 -4.625 . . . . 2.0 98.512 -179.879 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 45' ' ' ASN . . . . . . . . . . . . . 4.6 p-10 -66.02 113.76 4.68 Favored 'General case' 0 CA--C 1.572 1.798 0 N-CA-C 114.759 1.392 . . . . 2.0 114.759 -179.713 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 10.8 t -113.02 -169.96 1.58 Allowed 'General case' 0 N--CA 1.492 1.669 0 N-CA-C 114.09 1.145 . . . . 2.0 114.09 -179.947 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 47' ' ' LEU . . . . . . . . . . . . . 6.7 mp -54.77 -16.33 2.5 Favored 'General case' 0 N--CA 1.509 2.492 0 N-CA-C 116.984 2.216 . . . . 2.0 116.984 179.803 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 74.6 mt -103.98 -3.49 24.59 Favored 'General case' 0 CA--C 1.578 2.046 0 C-N-CA 125.577 1.551 . . . . 2.0 112.366 179.456 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 49' ' ' VAL . . . . . . . . . . . . . 7.2 p -166.91 150.78 1.56 Allowed 'Isoleucine or valine' 0 N--CA 1.5 2.071 0 N-CA-C 118.114 2.635 . . . . 2.0 118.114 -179.645 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 55.7 tttp -134.1 111.06 10.03 Favored 'General case' 0 CA--C 1.571 1.781 1 N-CA-C 98.259 -4.719 . . . . 2.0 98.259 179.391 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 86.8 m-85 -92.3 122.31 34.65 Favored 'General case' 0 N--CA 1.497 1.917 0 N-CA-C 118.573 2.805 . . . . 2.0 118.573 -179.353 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 52' ' ' VAL . . . . . . . . . . . . . 53.3 t -92.6 106.25 17.64 Favored 'Isoleucine or valine' 0 N--CA 1.503 2.208 0 N-CA-C 102.982 -2.97 . . . . 2.0 102.982 179.522 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 53' ' ' CYS . . . . . . . . . . . . 0.261 0.7 OUTLIER -108.16 139.32 43.01 Favored 'General case' 0 CA--C 1.575 1.923 0 N-CA-C 118.988 2.958 . . . . 2.0 118.988 -179.323 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 54' ' ' CYS . . . . . . . . . . . . . 30.0 p -127.71 118.83 24.54 Favored 'General case' 0 CA--C 1.575 1.922 0 C-N-CA 124.035 0.934 . . . . 2.0 110.834 179.821 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 4.8 p-10 -57.11 37.61 0.0 OUTLIER 'General case' 0 N--CA 1.508 2.463 1 N-CA-C 124.981 5.178 . . . . 2.0 124.981 -179.584 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 6.3 t -158.55 174.33 15.24 Favored 'General case' 0 N--CA 1.503 2.21 0 O-C-N 119.326 -2.109 . . . . 2.0 114.168 179.939 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 57' ' ' ASP . . . . . . . . . . . . . 69.4 m-20 -66.94 129.56 40.28 Favored 'General case' 0 CA--C 1.571 1.782 0 O-C-N 120.325 -1.485 . . . . 2.0 114.82 179.932 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 58' ' ' ARG . . . . . . . . . . . . 0.332 40.1 mtp85 52.19 24.71 2.91 Favored 'General case' 0 N--CA 1.499 2.008 0 N-CA-C 118.726 2.862 . . . . 2.0 118.726 179.917 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 59' ' ' CYS . . . . . . . . . . . . . 29.2 p -77.37 -19.89 55.57 Favored 'General case' 0 CA--C 1.579 2.06 0 O-C-N 120.668 -1.27 . . . . 2.0 114.352 179.608 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 60' ' ' ASN . . . . . . . . . . . . . 34.9 p-10 . . . . . 0 CA--C 1.563 1.473 0 CA-C-O 124.392 2.044 . . . . 2.0 113.525 179.881 . . . . . . . . 0 0 . 1 . 001 nuclear build core ' A' A ' 1' ' ' LEU . . . . . 0.466 ' C ' ' H ' ' A' ' 14' ' ' CYS . 3.4 tm? . . . . . 0 N--CA 1.495 1.782 0 CA-C-O 117.023 -1.465 . . . . 2.0 111.804 . . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 54.7 tptt -119.84 -55.31 2.1 Favored 'General case' 0 N--CA 1.514 2.757 0 CA-C-N 121.886 2.13 . . . . 2.0 109.181 179.656 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 3' ' ' CYS . . . . . . . . . . . . 0.312 1.9 m 76.6 -172.87 0.09 Allowed 'General case' 0 CA--C 1.563 1.471 0 N-CA-C 114.38 1.252 . . . . 2.0 114.38 -179.9 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 79.5 m-20 -91.05 152.48 20.63 Favored 'General case' 0 CA--C 1.55 0.955 0 N-CA-C 115.312 1.597 . . . . 2.0 115.312 -179.803 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 18.3 ptpt -90.84 -156.91 0.46 Allowed 'General case' 0 CA--C 1.579 2.087 0 N-CA-C 104.913 -2.254 . . . . 2.0 104.913 179.103 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 3.8 mm? -54.9 -34.0 62.6 Favored 'General case' 0 N--CA 1.512 2.637 0 O-C-N 117.679 -3.138 . . . . 2.0 115.154 179.665 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 7' ' ' ILE . . . . . . . . . . . . . 35.1 mt -75.74 141.43 72.21 Favored Pre-proline 0 CA--C 1.586 2.329 0 C-N-CA 125.312 1.445 . . . . 2.0 112.426 179.871 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 77.4 Cg_exo -55.94 -40.13 86.92 Favored 'Trans proline' 0 CA--C 1.57 2.321 0 C-N-CA 122.836 2.357 . . . . 2.0 117.964 179.596 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 9' ' ' ILE . . . . . . . . . . . . . 10.7 tp -97.75 93.04 3.13 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.726 0 C-N-CA 124.144 0.977 . . . . 2.0 111.083 179.969 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 10' ' ' ALA . . . . . . . . . . . . 0.466 . . -133.71 -166.97 1.86 Allowed 'General case' 0 CA--C 1.583 2.223 0 N-CA-C 114.828 1.418 . . . . 2.0 114.828 179.991 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 11' ' ' SER . . . . . . . . . . . . 0.368 2.0 t -43.66 165.69 0.01 OUTLIER 'General case' 0 CA--C 1.586 2.34 1 N-CA-C 127.027 5.936 . . . . 2.0 127.027 -179.351 . . . . . . . . 3 2 . 1 . 001 nuclear build core ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 1.6 ttmp? -105.99 -74.96 0.64 Allowed 'General case' 0 CA--C 1.577 2.008 0 N-CA-C 121.475 3.88 . . . . 2.0 121.475 -179.545 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 13' ' ' THR . . . . . . . . . . . . . 14.9 t -135.22 124.32 24.37 Favored 'General case' 0 N--CA 1.506 2.33 0 N-CA-C 121.741 3.978 . . . . 2.0 121.741 -179.374 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 14' ' ' CYS . . . . . 0.554 ' SG ' ' HD2' ' A' ' 18' ' ' LYS . 0.5 OUTLIER -106.5 171.94 4.33 Favored Pre-proline 0 CA--C 1.599 2.863 0 C-N-CA 126.613 1.965 . . . . 2.0 108.938 179.493 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 15' ' ' PRO . . . . . . . . . . . . . 83.5 Cg_exo -49.04 174.63 0.03 OUTLIER 'Trans proline' 0 CA--C 1.57 2.288 1 N-CA-C 124.474 4.759 . . . . 2.0 124.474 -179.722 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . 32.82 -172.87 0.0 OUTLIER 'General case' 0 N--CA 1.5 2.065 1 N-CA-C 123.558 4.651 . . . . 2.0 123.558 179.734 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . -82.59 38.71 2.65 Favored Glycine 0 N--CA 1.502 3.092 0 O-C-N 120.296 -1.503 . . . . 2.0 113.861 179.459 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 18' ' ' LYS . . . . . 0.554 ' HD2' ' SG ' ' A' ' 14' ' ' CYS . 0.1 OUTLIER -82.91 74.63 9.85 Favored 'General case' 0 CA--C 1.566 1.573 0 C-N-CA 125.546 1.538 . . . . 2.0 109.059 179.902 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 7.8 p30 -57.18 -36.65 71.06 Favored 'General case' 0 N--CA 1.487 1.403 1 N-CA-C 122.821 4.378 . . . . 2.0 122.821 -179.626 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 88.2 mt -70.18 122.96 20.48 Favored 'General case' 0 CA--C 1.558 1.251 0 N-CA-C 117.209 2.3 . . . . 2.0 117.209 -179.801 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 21' ' ' CYS . . . . . 0.562 ' SG ' ' O ' ' A' ' 56' ' ' THR . 32.1 m -82.91 95.34 7.94 Favored 'General case' 0 CA--C 1.566 1.565 0 N-CA-C 102.516 -3.142 . . . . 2.0 102.516 179.314 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 22' ' ' TYR . . . . . . . . . . . . 0.442 0.0 OUTLIER -61.57 153.17 28.44 Favored 'General case' 0 CA--C 1.554 1.12 0 N-CA-C 118.018 2.599 . . . . 2.0 118.018 -179.478 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 39.2 ttmt -133.98 76.67 1.67 Allowed 'General case' 0 CA--C 1.563 1.442 0 N-CA-C 103.373 -2.825 . . . . 2.0 103.373 179.584 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 24' ' ' MET . . . . . . . . . . . . 0.262 5.9 ttt -63.17 78.67 0.02 OUTLIER 'General case' 0 CA--C 1.567 1.609 0 C-N-CA 126.037 1.735 . . . . 2.0 113.968 -179.838 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 25' ' ' PHE . . . . . . . . . . . . . 13.9 m-85 -72.35 147.37 46.35 Favored 'General case' 0 N--CA 1.485 1.318 0 N-CA-C 113.784 1.031 . . . . 2.0 113.784 179.976 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 26' ' ' MET . . . . . . . . . . . . . 73.4 mtp -72.04 127.16 31.68 Favored 'General case' 0 N--CA 1.493 1.696 0 O-C-N 121.307 -0.871 . . . . 2.0 108.85 179.51 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 27' ' ' MET . . . . . . . . . . . . . 27.9 ttt -55.76 -36.45 67.32 Favored 'General case' 0 N--CA 1.513 2.708 0 CA-C-N 121.621 2.01 . . . . 2.0 111.717 179.365 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 73.2 m -76.85 -29.6 55.93 Favored 'General case' 0 CA--C 1.585 2.308 0 N-CA-C 114.163 1.172 . . . . 2.0 114.163 179.324 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 8.9 t70 -150.76 81.12 1.34 Allowed 'General case' 0 CA--C 1.57 1.748 0 O-C-N 120.174 -1.579 . . . . 2.0 108.558 179.695 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 1.8 mm? -45.79 -75.98 0.03 OUTLIER 'General case' 0 CA--C 1.575 1.927 0 N-CA-C 120.688 3.588 . . . . 2.0 120.688 -179.507 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 31' ' ' THR . . . . . . . . . . . . 0.259 43.4 p -6.71 -66.87 0.0 OUTLIER 'General case' 0 N--CA 1.506 2.341 1 N-CA-C 122.511 4.263 . . . . 2.0 122.511 -179.735 . . . . . . . . 3 2 . 1 . 001 nuclear build core ' A' A ' 32' ' ' ILE . . . . . . . . . . . . . 2.0 mp -99.04 106.89 40.96 Favored Pre-proline 0 CA--C 1.584 2.265 0 N-CA-C 102.173 -3.269 . . . . 2.0 102.173 179.726 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 33' ' ' PRO . . . . . . . . . . . . . 21.5 Cg_exo -59.39 166.02 8.34 Favored 'Trans proline' 0 CA--C 1.559 1.753 1 N-CA-C 123.744 4.478 . . . . 2.0 123.744 -179.658 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 34' ' ' VAL . . . . . . . . . . . . . 78.7 t -76.14 -51.67 19.47 Favored 'Isoleucine or valine' 0 CA--C 1.592 2.57 0 N-CA-C 103.125 -2.917 . . . . 2.0 103.125 178.637 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 59.9 mttm -143.43 167.52 21.99 Favored 'General case' 0 CA--C 1.564 1.494 0 CA-C-O 125.574 2.606 . . . . 2.0 108.652 179.451 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 9.1 mtp180 -142.88 119.56 11.13 Favored 'General case' 0 CA--C 1.582 2.191 1 N-CA-C 98.184 -4.747 . . . . 2.0 98.184 179.7 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . -157.8 -134.84 1.8 Allowed Glycine 0 N--CA 1.488 2.107 0 O-C-N 118.942 -2.349 . . . . 2.0 118.891 -179.44 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 38' ' ' CYS . . . . . . . . . . . . . 26.9 p -123.23 138.92 54.52 Favored 'General case' 0 N--CA 1.489 1.51 0 N-CA-C 117.421 2.378 . . . . 2.0 117.421 -179.821 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 39' ' ' ILE . . . . . 0.443 HG12 ' CG ' ' A' ' 43' ' ' PRO . 2.2 tp -164.65 159.01 1.29 Allowed 'Isoleucine or valine' 0 CA--C 1.576 1.959 0 N-CA-C 115.312 1.597 . . . . 2.0 115.312 -179.909 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 40' ' ' ASP . . . . . . . . . . . . . 9.3 p-10 -78.69 -48.14 15.58 Favored 'General case' 0 N--CA 1.506 2.363 0 O-C-N 119.751 -1.843 . . . . 2.0 114.313 179.595 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 91.2 t -135.83 144.02 34.7 Favored 'Isoleucine or valine' 0 CA--C 1.56 1.346 0 N-CA-C 102.972 -2.973 . . . . 2.0 102.972 179.703 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 42' ' ' CYS . . . . . . . . . . . . . 0.8 OUTLIER -58.37 105.49 0.55 Allowed Pre-proline 0 CA--C 1.603 3.01 0 N-CA-C 101.401 -3.555 . . . . 2.0 101.401 179.578 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 43' ' ' PRO . . . . . 0.443 ' CG ' HG12 ' A' ' 39' ' ' ILE . 24.7 Cg_exo -50.18 177.92 0.03 OUTLIER 'Trans proline' 0 C--N 1.372 1.811 1 N-CA-C 125.105 5.002 . . . . 2.0 125.105 -178.571 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 9.7 mtmp? -70.14 92.22 0.74 Allowed 'General case' 0 CA--C 1.566 1.589 0 N-CA-C 105.511 -2.033 . . . . 2.0 105.511 179.534 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 45' ' ' ASN . . . . . . . . . . . . . 2.5 p-10 -60.06 114.05 2.65 Favored 'General case' 0 CA--C 1.567 1.601 0 N-CA-C 116.73 2.122 . . . . 2.0 116.73 -179.402 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 7.8 t -80.09 -178.03 6.33 Favored 'General case' 0 CA--C 1.567 1.608 0 N-CA-C 114.667 1.358 . . . . 2.0 114.667 179.968 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 47' ' ' LEU . . . . . . . . . . . . . 97.4 mt -51.74 -28.34 14.8 Favored 'General case' 0 N--CA 1.505 2.309 0 N-CA-C 115.955 1.835 . . . . 2.0 115.955 179.777 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 79.1 mt -101.84 7.44 41.64 Favored 'General case' 0 CA--C 1.581 2.14 0 N-CA-C 114.518 1.303 . . . . 2.0 114.518 179.735 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 49' ' ' VAL . . . . . . . . . . . . . 13.9 p -148.14 159.67 7.4 Favored 'Isoleucine or valine' 0 N--CA 1.5 2.067 0 CA-C-N 122.195 2.27 . . . . 2.0 117.127 -179.518 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 13.3 tmtt? -155.27 86.65 1.09 Allowed 'General case' 0 CA--C 1.573 1.84 0 N-CA-C 101.625 -3.472 . . . . 2.0 101.625 179.562 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 36.7 m-85 -69.56 127.32 32.58 Favored 'General case' 0 CA--C 1.57 1.735 0 N-CA-C 121.442 3.867 . . . . 2.0 121.442 -179.297 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 52' ' ' VAL . . . . . . . . . . . . 0.323 8.6 t -99.51 162.51 2.98 Favored 'Isoleucine or valine' 0 CA--C 1.586 2.349 0 N-CA-C 102.574 -3.121 . . . . 2.0 102.574 178.881 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 53' ' ' CYS . . . . . . . . . . . . 0.318 1.2 p -166.2 153.47 9.83 Favored 'General case' 0 N--CA 1.495 1.801 0 O-C-N 117.388 -3.32 . . . . 2.0 117.993 -179.046 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 54' ' ' CYS . . . . . . . . . . . . 0.389 23.2 p -151.13 117.61 5.71 Favored 'General case' 0 CA--C 1.583 2.25 0 CA-C-O 122.946 1.355 . . . . 2.0 111.694 179.412 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 9.7 m120 -30.27 -0.8 0.0 OUTLIER 'General case' 0 CA--C 1.582 2.19 1 N-CA-C 129.681 6.919 . . . . 2.0 129.681 -179.596 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 56' ' ' THR . . . . . 0.562 ' O ' ' SG ' ' A' ' 21' ' ' CYS . 7.2 t -143.46 160.85 39.83 Favored 'General case' 0 N--CA 1.515 2.782 0 CA-C-N 125.564 3.802 . . . . 2.0 116.225 -179.747 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 57' ' ' ASP . . . . . . . . . . . . . 44.1 m-20 -46.27 104.07 0.05 OUTLIER 'General case' 0 N--CA 1.503 2.203 0 N-CA-C 118.416 2.747 . . . . 2.0 118.416 -179.783 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 58' ' ' ARG . . . . . . . . . . . . 0.315 27.7 mtm180 82.27 16.8 0.39 Allowed 'General case' 0 N--CA 1.507 2.405 0 C-N-CA 125.481 1.512 . . . . 2.0 115.057 -179.695 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 59' ' ' CYS . . . . . . . . . . . . . 34.0 t -63.84 -26.34 68.57 Favored 'General case' 0 CA--C 1.58 2.11 0 N-CA-C 115.148 1.536 . . . . 2.0 115.148 179.689 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 60' ' ' ASN . . . . . . . . . . . . . 51.2 p30 . . . . . 0 CA--C 1.568 1.652 0 CA-C-O 124.309 2.004 . . . . 2.0 114.975 179.837 . . . . . . . . 0 0 . 1 . 002 nuclear build core ' A' A ' 1' ' ' LEU . . . . . 0.436 HD23 ' SG ' ' A' ' 3' ' ' CYS . 14.2 tp . . . . . 0 CA--C 1.567 1.597 0 N-CA-C 113.883 1.068 . . . . 2.0 113.883 . . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 27.5 mtpt -89.87 130.33 36.11 Favored 'General case' 0 CA--C 1.571 1.776 0 N-CA-C 106.118 -1.808 . . . . 2.0 106.118 179.399 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 3' ' ' CYS . . . . . 0.436 ' SG ' HD23 ' A' ' 1' ' ' LEU . 90.8 m -131.75 -171.44 2.62 Favored 'General case' 0 N--CA 1.499 2.012 0 O-C-N 119.374 -2.079 . . . . 2.0 113.935 -179.84 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 77.9 m-20 -135.83 118.92 16.46 Favored 'General case' 0 CA--C 1.558 1.262 0 C-N-CA 123.562 0.745 . . . . 2.0 112.789 179.943 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -71.14 177.12 3.96 Favored 'General case' 0 CA--C 1.594 2.65 0 CA-C-N 120.34 1.427 . . . . 2.0 110.438 179.209 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 32.1 mt -48.72 -43.45 37.31 Favored 'General case' 0 N--CA 1.514 2.758 0 N-CA-C 119.394 3.109 . . . . 2.0 119.394 -179.84 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 7' ' ' ILE . . . . . . . . . . . . . 46.4 mm -35.62 139.11 0.39 Allowed Pre-proline 0 CA--C 1.583 2.214 0 N-CA-C 116.636 2.088 . . . . 2.0 116.636 -179.87 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 49.4 Cg_exo -37.39 -51.94 1.56 Allowed 'Trans proline' 0 CA--C 1.565 2.055 0 C-N-CA 123.673 2.916 . . . . 2.0 118.729 -179.961 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 9' ' ' ILE . . . . . . . . . . . . 0.31 17.4 tt -84.63 -71.69 0.41 Allowed 'Isoleucine or valine' 0 N--CA 1.496 1.852 0 N-CA-C 107.745 -1.206 . . . . 2.0 107.745 179.471 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . 58.76 137.55 0.01 OUTLIER 'General case' 0 CA--C 1.574 1.887 0 N-CA-C 119.447 3.128 . . . . 2.0 119.447 179.639 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 38.8 t -147.99 -143.61 0.14 Allowed 'General case' 0 CA--C 1.581 2.158 0 O-C-N 120.32 -1.487 . . . . 2.0 111.644 -179.943 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 12' ' ' LYS . . . . . . . . . . . . 0.369 3.9 ttmt 92.14 174.98 0.02 OUTLIER 'General case' 0 N--CA 1.503 2.188 0 C-N-CA 126.061 1.745 . . . . 2.0 115.172 -179.915 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 13' ' ' THR . . . . . . . . . . . . . 84.9 m -152.66 149.59 28.58 Favored 'General case' 0 N--CA 1.495 1.807 0 N-CA-C 114.007 1.114 . . . . 2.0 114.007 -179.689 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 14' ' ' CYS . . . . . . . . . . . . 0.295 0.1 OUTLIER -134.16 176.97 2.48 Favored Pre-proline 0 CA--C 1.599 2.85 0 C-N-CA 124.545 1.138 . . . . 2.0 109.625 179.398 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 15' ' ' PRO . . . . . . . . . . . . . 88.0 Cg_exo -52.99 172.2 0.2 Allowed 'Trans proline' 0 CA--C 1.572 2.422 1 N-CA-C 126.232 5.435 . . . . 2.0 126.232 -179.64 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -78.56 169.97 17.4 Favored 'General case' 0 N--CA 1.498 1.938 0 N-CA-C 107.965 -1.124 . . . . 2.0 107.965 179.247 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . 83.79 -50.41 4.4 Favored Glycine 1 N--CA 1.519 4.201 0 O-C-N 118.295 -2.753 . . . . 2.0 106.942 -178.953 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 73.9 mmtt -78.76 71.62 5.23 Favored 'General case' 0 CA--C 1.581 2.168 0 N-CA-C 104.259 -2.497 . . . . 2.0 104.259 179.105 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 8.5 p30 -82.15 -21.48 36.56 Favored 'General case' 0 N--CA 1.49 1.571 1 N-CA-C 121.928 4.047 . . . . 2.0 121.928 -179.513 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 86.0 mt -88.16 119.54 28.65 Favored 'General case' 0 CA--C 1.553 1.087 0 N-CA-C 113.298 0.851 . . . . 2.0 113.298 -179.934 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 21' ' ' CYS . . . . . 0.407 ' SG ' HD21 ' A' ' 1' ' ' LEU . 4.5 m -83.96 100.82 11.28 Favored 'General case' 0 CA--C 1.58 2.131 1 N-CA-C 99.664 -4.198 . . . . 2.0 99.664 179.198 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 22' ' ' TYR . . . . . . . . . . . . . 4.7 p90 -75.45 159.58 31.19 Favored 'General case' 0 CA--C 1.556 1.181 0 N-CA-C 119.505 3.15 . . . . 2.0 119.505 -179.349 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 29.4 ttpt -139.03 98.65 3.58 Favored 'General case' 0 CA--C 1.565 1.556 0 N-CA-C 103.219 -2.882 . . . . 2.0 103.219 179.567 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 24' ' ' MET . . . . . 0.526 ' SD ' ' HB2' ' A' ' 35' ' ' LYS . 13.6 ttm -69.73 74.93 0.43 Allowed 'General case' 0 CA--C 1.57 1.737 0 N-CA-C 114.805 1.409 . . . . 2.0 114.805 -179.76 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 25' ' ' PHE . . . . . . . . . . . . . 4.5 m-30 -62.48 128.09 34.36 Favored 'General case' 0 N--CA 1.497 1.917 0 O-C-N 120.431 -1.418 . . . . 2.0 112.121 179.821 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 26' ' ' MET . . . . . . . . . . . . . 76.5 mtp -57.31 129.32 41.25 Favored 'General case' 0 N--CA 1.497 1.886 0 N-CA-C 114.305 1.224 . . . . 2.0 114.305 179.895 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 27' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -59.09 -39.42 82.12 Favored 'General case' 0 N--CA 1.512 2.644 0 CA-C-N 120.985 1.72 . . . . 2.0 110.742 179.381 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 48.9 m -68.75 -34.35 75.44 Favored 'General case' 0 CA--C 1.584 2.281 0 N-CA-C 113.647 0.981 . . . . 2.0 113.647 179.368 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 8.9 t70 -155.47 84.49 1.05 Allowed 'General case' 0 CA--C 1.572 1.794 0 O-C-N 120.631 -1.293 . . . . 2.0 109.343 179.671 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 30' ' ' LEU . . . . . 0.471 ' H ' HD22 ' A' ' 30' ' ' LEU . 2.3 mm? -44.43 -41.51 6.3 Favored 'General case' 0 CA--C 1.574 1.887 0 N-CA-C 120.76 3.615 . . . . 2.0 120.76 -179.776 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 31' ' ' THR . . . . . . . . . . . . . 43.3 p -41.06 -54.82 2.73 Favored 'General case' 0 N--CA 1.502 2.138 0 N-CA-C 119.587 3.18 . . . . 2.0 119.587 -179.784 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 32' ' ' ILE . . . . . . . . . . . . . 2.1 mp -96.61 114.63 64.81 Favored Pre-proline 0 CA--C 1.586 2.34 0 N-CA-C 106.7 -1.593 . . . . 2.0 106.7 179.914 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 33' ' ' PRO . . . . . . . . . . . . . 13.3 Cg_exo -70.29 151.0 65.84 Favored 'Trans proline' 0 CA--C 1.572 2.422 0 N-CA-C 119.261 2.754 . . . . 2.0 119.261 -179.871 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 34' ' ' VAL . . . . . . . . . . . . . 60.9 t -79.14 -38.75 20.63 Favored 'Isoleucine or valine' 0 N--CA 1.509 2.489 0 C-N-CA 124.397 1.079 . . . . 2.0 111.119 179.445 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 35' ' ' LYS . . . . . 0.526 ' HB2' ' SD ' ' A' ' 24' ' ' MET . 18.1 tptt -147.93 170.32 17.95 Favored 'General case' 0 CA--C 1.559 1.295 0 CA-C-O 123.986 1.85 . . . . 2.0 110.151 179.817 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 36' ' ' ARG . . . . . . . . . . . . 0.269 7.2 ttp180 -148.21 114.27 5.81 Favored 'General case' 0 CA--C 1.575 1.939 0 N-CA-C 101.423 -3.547 . . . . 2.0 101.423 -179.906 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . -145.65 -148.99 4.91 Favored Glycine 0 N--CA 1.496 2.694 0 N-CA-C 119.793 2.677 . . . . 2.0 119.793 -179.561 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 38' ' ' CYS . . . . . . . . . . . . . 13.6 p -126.42 137.27 53.4 Favored 'General case' 0 CA--C 1.571 1.752 0 C-N-CA 123.89 0.876 . . . . 2.0 112.064 179.933 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 39' ' ' ILE . . . . . 0.841 HG21 ' HD3' ' A' ' 43' ' ' PRO . 10.5 tp -165.03 165.77 0.55 Allowed 'Isoleucine or valine' 0 N--CA 1.509 2.494 0 O-C-N 120.595 -1.316 . . . . 2.0 113.997 -179.703 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 40' ' ' ASP . . . . . . . . . . . . . 7.9 p-10 -79.31 -46.95 16.7 Favored 'General case' 0 N--CA 1.505 2.29 0 O-C-N 119.283 -2.136 . . . . 2.0 114.471 179.493 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 80.5 t -130.75 152.03 36.87 Favored 'Isoleucine or valine' 0 CA--C 1.576 1.965 0 C-N-CA 127.134 2.174 . . . . 2.0 105.275 179.644 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 42' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -52.59 111.01 2.23 Favored Pre-proline 0 N--CA 1.526 3.332 0 N-CA-C 102.745 -3.057 . . . . 2.0 102.745 179.359 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 43' ' ' PRO . . . . . 0.841 ' HD3' HG21 ' A' ' 39' ' ' ILE 0.548 71.7 Cg_exo -11.94 -109.4 0.0 OUTLIER 'Trans proline' 0 C--N 1.378 2.079 2 C-N-CA 125.799 4.332 . . . . 2.0 123.02 -178.408 . . . . . . . . 4 3 . 1 . 002 nuclear build core ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 6.0 mtmp? -159.8 95.28 1.18 Allowed 'General case' 0 CA--C 1.556 1.183 1 N-CA-C 96.68 -5.304 . . . . 2.0 96.68 179.691 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 45' ' ' ASN . . . . . . . . . . . . . 2.8 p-10 -62.66 97.47 0.1 Allowed 'General case' 0 CA--C 1.575 1.912 0 N-CA-C 116.404 2.001 . . . . 2.0 116.404 -179.522 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 13.7 t -79.64 -179.18 6.74 Favored 'General case' 0 CA--C 1.567 1.615 0 N-CA-C 114.35 1.241 . . . . 2.0 114.35 179.981 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 47' ' ' LEU . . . . . . . . . . . . 0.385 1.3 pp -54.52 -15.66 1.88 Allowed 'General case' 0 N--CA 1.509 2.521 0 N-CA-C 117.938 2.57 . . . . 2.0 117.938 179.819 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 84.5 mt -104.29 3.49 32.64 Favored 'General case' 0 CA--C 1.59 2.501 0 C-N-CA 125.463 1.505 . . . . 2.0 111.471 179.133 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 49' ' ' VAL . . . . . . . . . . . . . 6.7 p -157.7 156.09 4.43 Favored 'Isoleucine or valine' 0 CA--C 1.579 2.082 0 N-CA-C 118.439 2.755 . . . . 2.0 118.439 -179.584 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -145.81 72.37 1.3 Allowed 'General case' 0 CA--C 1.584 2.258 0 N-CA-C 103.143 -2.91 . . . . 2.0 103.143 179.097 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 97.2 m-85 -44.88 133.72 6.09 Favored 'General case' 0 CA--C 1.574 1.896 0 N-CA-C 120.402 3.482 . . . . 2.0 120.402 -179.498 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 52' ' ' VAL . . . . . . . . . . . . . 40.6 t -115.9 103.02 14.55 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.897 0 N-CA-C 103.081 -2.933 . . . . 2.0 103.081 179.726 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 53' ' ' CYS . . . . . . . . . . . . 0.255 4.2 m -121.11 153.65 37.19 Favored 'General case' 0 CA--C 1.569 1.695 0 N-CA-C 117.881 2.548 . . . . 2.0 117.881 -179.6 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 54' ' ' CYS . . . . . . . . . . . . 0.351 8.6 p -141.73 127.69 19.46 Favored 'General case' 0 CA--C 1.577 2.019 0 CA-C-O 122.427 1.108 . . . . 2.0 111.065 179.703 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 4.7 p-10 -53.15 36.24 0.0 OUTLIER 'General case' 0 N--CA 1.5 2.062 1 N-CA-C 125.8 5.481 . . . . 2.0 125.8 -179.56 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 56' ' ' THR . . . . . . . . . . . . 0.253 7.2 t -153.8 170.88 19.9 Favored 'General case' 0 N--CA 1.499 2.022 0 O-C-N 119.443 -2.035 . . . . 2.0 114.424 179.968 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 57' ' ' ASP . . . . . . . . . . . . . 73.3 m-20 -60.98 117.96 6.13 Favored 'General case' 0 CA--C 1.563 1.444 0 N-CA-C 114.487 1.291 . . . . 2.0 114.487 -179.807 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 58' ' ' ARG . . . . . . . . . . . . . 78.0 mtt85 64.09 20.51 12.22 Favored 'General case' 0 N--CA 1.5 2.075 0 N-CA-C 116.222 1.934 . . . . 2.0 116.222 -179.834 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 59' ' ' CYS . . . . . . . . . . . . . 49.3 t -62.84 -28.82 70.28 Favored 'General case' 0 CA--C 1.575 1.94 0 N-CA-C 116.7 2.111 . . . . 2.0 116.7 179.912 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 60' ' ' ASN . . . . . . . . . . . . . 41.3 p-10 . . . . . 0 CA--C 1.572 1.793 0 CA-C-O 124.252 1.977 . . . . 2.0 115.46 179.846 . . . . . . . . 0 0 . 1 . 003 nuclear build core ' A' A ' 1' ' ' LEU . . . . . 0.548 HD13 ' SG ' ' A' ' 3' ' ' CYS . 0.5 OUTLIER . . . . . 0 CA--C 1.579 2.058 0 CA-C-O 123.065 1.412 . . . . 2.0 112.51 . . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 53.9 mttp -145.2 111.28 5.56 Favored 'General case' 0 CA--C 1.566 1.559 0 N-CA-C 100.801 -3.777 . . . . 2.0 100.801 179.427 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 3' ' ' CYS . . . . . 0.548 ' SG ' HD13 ' A' ' 1' ' ' LEU . 90.7 m -133.02 156.85 46.6 Favored 'General case' 0 N--CA 1.491 1.588 0 O-C-N 120.335 -1.478 . . . . 2.0 113.909 -179.722 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 29.6 m-20 -105.63 117.18 33.35 Favored 'General case' 0 N--CA 1.487 1.415 0 N-CA-C 114.259 1.207 . . . . 2.0 114.259 -179.768 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 5' ' ' LYS . . . . . . . . . . . . 0.301 1.1 pttt -64.63 -179.9 0.55 Allowed 'General case' 0 CA--C 1.58 2.133 0 O-C-N 120.518 -1.364 . . . . 2.0 112.686 179.634 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -41.75 -43.82 3.03 Favored 'General case' 0 N--CA 1.502 2.171 1 N-CA-C 121.94 4.052 . . . . 2.0 121.94 -179.691 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 7' ' ' ILE . . . . . . . . . . . . . 35.8 mt -55.39 142.15 60.67 Favored Pre-proline 0 CA--C 1.588 2.416 0 CA-C-O 116.882 -1.532 . . . . 2.0 113.227 179.878 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 65.3 Cg_exo -35.54 -54.04 0.77 Allowed 'Trans proline' 0 CA--C 1.57 2.321 0 C-N-CA 123.914 3.076 . . . . 2.0 118.78 179.977 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 9' ' ' ILE . . . . . . . . . . . . . 1.6 pp -126.44 75.27 0.51 Allowed 'Isoleucine or valine' 0 CA--C 1.575 1.924 0 N-CA-C 107.253 -1.388 . . . . 2.0 107.253 179.658 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -80.23 -163.32 0.54 Allowed 'General case' 0 CA--C 1.579 2.087 0 N-CA-C 119.19 3.033 . . . . 2.0 119.19 -179.749 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 8.8 t -57.12 -178.94 0.03 OUTLIER 'General case' 0 CA--C 1.582 2.201 0 N-CA-C 118.091 2.626 . . . . 2.0 118.091 -179.845 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 12' ' ' LYS . . . . . . . . . . . . 0.25 37.1 ttpt -120.97 -93.5 0.52 Allowed 'General case' 0 CA--C 1.578 2.021 0 N-CA-C 118.324 2.712 . . . . 2.0 118.324 -179.64 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 13' ' ' THR . . . . . . . . . . . . . 32.6 m -46.59 134.56 9.36 Favored 'General case' 0 N--CA 1.501 2.087 0 N-CA-C 120.259 3.429 . . . . 2.0 120.259 -179.454 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 3.9 t -149.47 154.57 38.51 Favored Pre-proline 0 CA--C 1.598 2.823 0 C-N-CA 124.616 1.166 . . . . 2.0 111.174 -179.932 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 15' ' ' PRO . . . . . . . . . . . . . 58.4 Cg_exo -43.25 157.63 0.1 Allowed 'Trans proline' 0 CA--C 1.575 2.535 1 N-CA-C 126.659 5.6 . . . . 2.0 126.659 -179.66 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -79.76 168.92 18.68 Favored 'General case' 0 N--CA 1.499 1.981 0 C-N-CA 124.87 1.268 . . . . 2.0 111.385 179.642 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . 83.75 -51.59 4.59 Favored Glycine 1 N--CA 1.519 4.197 0 O-C-N 119.381 -2.074 . . . . 2.0 108.215 -179.049 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 21.1 mmtm -71.87 101.44 2.64 Favored 'General case' 0 CA--C 1.572 1.803 0 C-N-CA 129.048 2.939 . . . . 2.0 106.764 179.386 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 19' ' ' ASN . . . . . . . . . . . . 0.34 0.2 OUTLIER -106.94 -8.11 16.76 Favored 'General case' 0 N--CA 1.499 2.012 0 N-CA-C 117.406 2.372 . . . . 2.0 117.406 179.862 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 89.0 mt -100.2 113.97 27.04 Favored 'General case' 0 CA--C 1.563 1.471 0 C-N-CA 126.141 1.776 . . . . 2.0 109.593 179.605 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 1.3 m -80.23 101.05 8.63 Favored 'General case' 0 CA--C 1.577 1.996 0 N-CA-C 101.457 -3.535 . . . . 2.0 101.457 179.226 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 22' ' ' TYR . . . . . . . . . . . . 0.37 13.2 p90 -75.91 160.29 30.06 Favored 'General case' 0 N--CA 1.484 1.23 0 N-CA-C 119.145 3.016 . . . . 2.0 119.145 -179.509 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 60.2 tttt -135.98 87.31 2.3 Favored 'General case' 0 CA--C 1.565 1.527 0 N-CA-C 103.125 -2.917 . . . . 2.0 103.125 179.846 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 24' ' ' MET . . . . . 0.575 ' HB3' ' H ' ' A' ' 35' ' ' LYS . 24.2 ttt -61.89 76.75 0.02 OUTLIER 'General case' 0 N--CA 1.492 1.659 0 N-CA-C 118.242 2.682 . . . . 2.0 118.242 -179.58 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 25' ' ' PHE . . . . . . . . . . . . . 12.5 m-30 -69.53 128.0 34.96 Favored 'General case' 0 CA--C 1.568 1.656 0 O-C-N 120.598 -1.313 . . . . 2.0 112.328 179.839 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 26' ' ' MET . . . . . . . . . . . . . 32.2 mtm -64.16 132.02 49.17 Favored 'General case' 0 N--CA 1.501 2.087 0 O-C-N 120.308 -1.495 . . . . 2.0 108.524 179.619 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 27' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -53.48 -31.12 44.45 Favored 'General case' 0 N--CA 1.511 2.58 0 CA-C-N 121.772 2.078 . . . . 2.0 114.045 179.775 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 50.3 m -83.73 -39.77 19.7 Favored 'General case' 0 CA--C 1.587 2.371 0 C-N-CA 124.634 1.174 . . . . 2.0 112.004 179.218 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 38.6 t70 -131.66 88.32 2.56 Favored 'General case' 0 CA--C 1.572 1.789 0 N-CA-C 107.08 -1.452 . . . . 2.0 107.08 179.773 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 2.2 mm? -60.57 -82.66 0.02 OUTLIER 'General case' 0 CA--C 1.578 2.022 0 N-CA-C 121.078 3.733 . . . . 2.0 121.078 -179.413 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 31' ' ' THR . . . . . . . . . . . . 0.344 13.9 t -19.13 -52.22 0.01 OUTLIER 'General case' 0 N--CA 1.51 2.543 1 N-CA-C 123.257 4.54 . . . . 2.0 123.257 -179.643 . . . . . . . . 3 2 . 1 . 003 nuclear build core ' A' A ' 32' ' ' ILE . . . . . . . . . . . . . 1.7 mp -97.28 105.93 28.5 Favored Pre-proline 0 CA--C 1.59 2.518 1 N-CA-C 99.314 -4.328 . . . . 2.0 99.314 179.432 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 33' ' ' PRO . . . . . . . . . . . . . 5.5 Cg_endo -73.14 178.23 6.81 Favored 'Trans proline' 0 CA--C 1.568 2.19 0 N-CA-C 120.323 3.163 . . . . 2.0 120.323 -179.446 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 34' ' ' VAL . . . . . . . . . . . . . 56.0 t -85.79 -63.05 1.33 Allowed 'Isoleucine or valine' 0 CA--C 1.585 2.292 0 N-CA-C 106.865 -1.531 . . . . 2.0 106.865 179.309 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 35' ' ' LYS . . . . . 0.575 ' H ' ' HB3' ' A' ' 24' ' ' MET . 38.9 ttmt -139.34 113.62 8.92 Favored 'General case' 0 CA--C 1.558 1.281 0 C-N-CA 124.419 1.088 . . . . 2.0 113.609 -179.9 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 36' ' ' ARG . . . . . . . . . . . . 0.345 51.8 ttp180 -85.69 73.27 10.45 Favored 'General case' 0 CA--C 1.59 2.485 0 O-C-N 120.257 -1.527 . . . . 2.0 110.319 179.971 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . -98.44 -145.84 19.48 Favored Glycine 0 N--CA 1.501 2.976 1 N-CA-C 123.535 4.174 . . . . 2.0 123.535 -179.507 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 38' ' ' CYS . . . . . . . . . . . . . 14.6 p -126.64 132.99 51.1 Favored 'General case' 0 N--CA 1.498 1.955 0 N-CA-C 114.887 1.44 . . . . 2.0 114.887 179.921 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 39' ' ' ILE . . . . . 0.596 HG13 ' H ' ' A' ' 40' ' ' ASP . 6.2 tp -152.81 -174.8 0.18 Allowed 'Isoleucine or valine' 0 N--CA 1.502 2.174 0 C-N-CA 124.7 1.2 . . . . 2.0 111.598 -179.93 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 40' ' ' ASP . . . . . 0.596 ' H ' HG13 ' A' ' 39' ' ' ILE . 4.0 p30 -119.55 -25.94 5.87 Favored 'General case' 0 N--CA 1.5 2.046 0 O-C-N 119.339 -2.101 . . . . 2.0 113.075 179.212 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 54.9 t -137.14 16.53 0.84 Allowed 'Isoleucine or valine' 0 N--CA 1.504 2.235 0 CA-C-N 120.546 1.521 . . . . 2.0 113.001 179.853 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 42' ' ' CYS . . . . . . . . . . . . 0.314 3.1 m 81.59 111.91 0.03 OUTLIER Pre-proline 0 CA--C 1.61 3.271 1 N-CA-C 95.454 -5.758 . . . . 2.0 95.454 -178.972 . . . . . . . . 3 2 . 1 . 003 nuclear build core ' A' A ' 43' ' ' PRO . . . . . 0.496 ' HD3' HG21 ' A' ' 39' ' ' ILE 0.498 41.5 Cg_exo -22.03 -75.27 0.02 OUTLIER 'Trans proline' 0 C--N 1.376 1.998 1 N-CA-C 125.061 4.985 . . . . 2.0 125.061 -178.635 . . . . . . . . 4 3 . 1 . 003 nuclear build core ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 3.4 mtpp -179.74 101.64 0.03 OUTLIER 'General case' 0 CA--C 1.564 1.489 1 N-CA-C 99.881 -4.118 . . . . 2.0 99.881 179.832 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 45' ' ' ASN . . . . . . . . . . . . . 2.5 p-10 -73.82 139.69 45.29 Favored 'General case' 0 N--CA 1.492 1.661 0 O-C-N 120.268 -1.52 . . . . 2.0 114.573 -179.811 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 12.3 t -148.34 -173.48 4.33 Favored 'General case' 0 N--CA 1.49 1.551 0 N-CA-C 112.896 0.702 . . . . 2.0 112.896 179.936 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 47' ' ' LEU . . . . . . . . . . . . . 2.6 pp -57.76 -15.34 7.78 Favored 'General case' 0 N--CA 1.508 2.439 0 N-CA-C 116.578 2.066 . . . . 2.0 116.578 179.572 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 10.0 tp -96.78 -27.0 14.93 Favored 'General case' 0 CA--C 1.579 2.064 0 C-N-CA 126.513 1.925 . . . . 2.0 112.049 179.374 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 49' ' ' VAL . . . . . . . . . . . . . 10.9 p -154.15 146.9 13.87 Favored 'Isoleucine or valine' 0 CA--C 1.579 2.059 0 N-CA-C 119.021 2.971 . . . . 2.0 119.021 -179.522 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 18.9 ttpt -132.18 120.64 22.52 Favored 'General case' 0 CA--C 1.572 1.819 0 N-CA-C 101.7 -3.444 . . . . 2.0 101.7 179.526 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -103.05 135.27 45.04 Favored 'General case' 0 N--CA 1.506 2.34 0 O-C-N 118.393 -2.692 . . . . 2.0 117.635 -179.293 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 52' ' ' VAL . . . . . . . . . . . . . 25.4 t -102.22 97.39 5.59 Favored 'Isoleucine or valine' 0 CA--C 1.575 1.91 0 N-CA-C 104.012 -2.588 . . . . 2.0 104.012 179.588 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 53' ' ' CYS . . . . . . . . . . . . . 0.8 OUTLIER -100.22 132.56 45.51 Favored 'General case' 0 CA--C 1.576 1.966 0 N-CA-C 119.975 3.324 . . . . 2.0 119.975 -179.331 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 54' ' ' CYS . . . . . . . . . . . . . 51.4 t -117.14 124.76 49.97 Favored 'General case' 0 N--CA 1.495 1.82 0 C-N-CA 124.401 1.081 . . . . 2.0 110.305 179.909 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 2.6 t30 -67.54 49.03 0.05 OUTLIER 'General case' 0 N--CA 1.503 2.204 1 N-CA-C 124.22 4.896 . . . . 2.0 124.22 -179.368 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 56' ' ' THR . . . . . . . . . . . . 0.332 5.9 t -163.17 171.12 16.77 Favored 'General case' 0 N--CA 1.503 2.208 0 O-C-N 119.673 -1.892 . . . . 2.0 113.346 179.663 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 57' ' ' ASP . . . . . . . . . . . . . 20.0 m-20 -70.32 107.47 3.78 Favored 'General case' 0 CA--C 1.57 1.722 0 N-CA-C 115.661 1.726 . . . . 2.0 115.661 -179.8 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 58' ' ' ARG . . . . . . . . . . . . 0.278 74.7 mtm180 78.2 13.14 1.61 Allowed 'General case' 0 N--CA 1.502 2.162 0 N-CA-C 116.52 2.044 . . . . 2.0 116.52 179.833 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 59' ' ' CYS . . . . . . . . . . . . . 44.3 t -69.33 -10.79 59.51 Favored 'General case' 0 CA--C 1.577 2.019 0 N-CA-C 117.253 2.316 . . . . 2.0 117.253 179.742 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 60' ' ' ASN . . . . . . . . . . . . . 45.4 p30 . . . . . 0 CA--C 1.561 1.403 0 CA-C-O 125.537 2.589 . . . . 2.0 113.737 179.953 . . . . . . . . 0 0 . 1 . 004 nuclear build core ' A' A ' 1' ' ' LEU . . . . . . . . . . . . 0.313 0.3 OUTLIER . . . . . 0 CA--C 1.57 1.734 0 N-CA-C 113.798 1.036 . . . . 2.0 113.798 . . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 4.1 mmmm -69.09 130.24 42.17 Favored 'General case' 0 N--CA 1.494 1.748 0 O-C-N 120.736 -1.227 . . . . 2.0 110.626 179.833 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 70.7 m -135.1 -169.95 2.48 Favored 'General case' 0 CA--C 1.572 1.792 0 O-C-N 120.493 -1.379 . . . . 2.0 114.364 -179.855 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 2.9 m120 -129.8 132.9 46.66 Favored 'General case' 0 N--CA 1.49 1.567 0 C-N-CA 124.98 1.312 . . . . 2.0 110.23 179.909 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 5' ' ' LYS . . . . . 0.447 ' H ' ' HB1' ' A' ' 10' ' ' ALA . 11.9 ptmt -83.84 172.57 12.02 Favored 'General case' 0 CA--C 1.591 2.534 0 CA-C-N 120.183 1.356 . . . . 2.0 107.671 179.088 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 52.1 mt -42.49 -43.69 3.78 Favored 'General case' 0 N--CA 1.514 2.726 0 N-CA-C 119.336 3.087 . . . . 2.0 119.336 -179.758 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 7' ' ' ILE . . . . . . . . . . . . . 43.8 mm -48.02 131.44 12.09 Favored Pre-proline 0 CA--C 1.583 2.213 0 CA-C-O 115.975 -1.964 . . . . 2.0 112.088 179.968 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 8' ' ' PRO . . . . . . . . . . . . 0.323 13.9 Cg_exo -16.01 -68.75 0.01 OUTLIER 'Trans proline' 0 CA--C 1.563 1.965 0 C-N-CA 124.758 3.639 . . . . 2.0 121.547 -179.751 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 9' ' ' ILE . . . . . . . . . . . . 0.298 15.1 tt -88.18 -72.01 0.46 Allowed 'Isoleucine or valine' 0 CA--C 1.573 1.862 0 CA-C-O 118.824 -0.608 . . . . 2.0 109.517 179.72 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 10' ' ' ALA . . . . . 0.447 ' HB1' ' H ' ' A' ' 5' ' ' LYS . . . 52.77 152.02 0.0 OUTLIER 'General case' 0 CA--C 1.576 1.949 1 N-CA-C 121.972 4.064 . . . . 2.0 121.972 179.711 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 20.2 t -148.46 135.27 19.92 Favored 'General case' 0 N--CA 1.492 1.64 0 O-C-N 120.469 -1.394 . . . . 2.0 114.133 -179.97 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 78.1 tttt -135.75 135.16 39.74 Favored 'General case' 0 N--CA 1.493 1.709 0 C-N-CA 125.201 1.4 . . . . 2.0 107.759 179.782 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 13' ' ' THR . . . . . . . . . . . . . 14.3 t -117.12 104.4 11.19 Favored 'General case' 0 N--CA 1.504 2.235 0 CA-C-N 120.845 1.657 . . . . 2.0 111.108 179.962 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 14' ' ' CYS . . . . . . . . . . . . 0.294 0.0 OUTLIER -123.64 168.24 13.02 Favored Pre-proline 0 CA--C 1.588 2.435 0 O-C-N 121.077 -1.014 . . . . 2.0 113.376 179.925 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 15' ' ' PRO . . . . . . . . . . . . . 53.5 Cg_exo -62.78 166.99 12.65 Favored 'Trans proline' 0 N--CA 1.505 2.152 1 N-CA-C 124.989 4.957 . . . . 2.0 124.989 -179.631 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -69.45 173.69 5.65 Favored 'General case' 0 N--CA 1.498 1.958 0 C-N-CA 123.661 0.784 . . . . 2.0 109.14 179.382 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . 84.55 -52.58 4.72 Favored Glycine 0 N--CA 1.516 3.978 0 O-C-N 118.36 -2.712 . . . . 2.0 106.669 -178.963 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 39.4 mmtt -78.74 61.01 2.92 Favored 'General case' 0 CA--C 1.598 2.79 0 N-CA-C 105.224 -2.139 . . . . 2.0 105.224 179.08 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 7.4 p30 -60.96 -41.92 97.27 Favored 'General case' 0 N--CA 1.481 1.123 0 N-CA-C 119.627 3.195 . . . . 2.0 119.627 -179.582 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 97.4 mt -71.93 112.24 7.86 Favored 'General case' 0 CA--C 1.554 1.113 0 N-CA-C 115.44 1.644 . . . . 2.0 115.44 -179.87 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 1.4 m -82.62 97.85 8.71 Favored 'General case' 0 CA--C 1.577 1.994 0 N-CA-C 100.323 -3.954 . . . . 2.0 100.323 179.255 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 22' ' ' TYR . . . . . . . . . . . . 0.381 1.2 p90 -64.87 161.12 18.97 Favored 'General case' 0 CA--C 1.562 1.43 0 N-CA-C 120.65 3.574 . . . . 2.0 120.65 -179.347 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 7.3 tppt? -138.3 98.32 3.58 Favored 'General case' 0 CA--C 1.568 1.665 0 N-CA-C 102.546 -3.131 . . . . 2.0 102.546 179.86 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 24' ' ' MET . . . . . 0.439 ' SD ' ' HB2' ' A' ' 35' ' ' LYS . 10.0 ttt -72.59 85.86 1.18 Allowed 'General case' 0 CA--C 1.565 1.525 0 O-C-N 120.498 -1.377 . . . . 2.0 112.17 -179.892 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 25' ' ' PHE . . . . . . . . . . . . . 2.4 m-30 -76.91 117.68 18.75 Favored 'General case' 0 CA--C 1.569 1.69 0 N-CA-C 106.675 -1.602 . . . . 2.0 106.675 179.632 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 26' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -56.52 129.05 39.17 Favored 'General case' 0 N--CA 1.497 1.912 0 O-C-N 121.047 -1.033 . . . . 2.0 113.668 -179.781 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 27' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -42.83 -44.01 4.28 Favored 'General case' 0 N--CA 1.506 2.331 0 N-CA-C 117.326 2.343 . . . . 2.0 117.326 -179.787 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 53.1 m -76.13 -42.29 47.35 Favored 'General case' 0 CA--C 1.581 2.161 0 N-CA-C 113.287 0.847 . . . . 2.0 113.287 179.566 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 64.4 t0 -133.34 96.28 3.69 Favored 'General case' 0 CA--C 1.568 1.663 0 N-CA-C 105.705 -1.961 . . . . 2.0 105.705 179.712 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 2.8 mm? -64.95 -63.41 1.12 Allowed 'General case' 0 CA--C 1.568 1.669 0 N-CA-C 118.602 2.815 . . . . 2.0 118.602 -179.601 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 31' ' ' THR . . . . . . . . . . . . . 81.3 p -33.41 -46.68 0.19 Allowed 'General case' 0 N--CA 1.508 2.44 0 N-CA-C 120.426 3.491 . . . . 2.0 120.426 -179.673 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 32' ' ' ILE . . . . . . . . . . . . . 2.2 mp -87.39 111.35 40.8 Favored Pre-proline 0 CA--C 1.589 2.444 0 N-CA-C 103.756 -2.683 . . . . 2.0 103.756 179.649 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 33' ' ' PRO . . . . . . . . . . . . . 6.1 Cg_exo -71.42 144.68 46.06 Favored 'Trans proline' 0 CA--C 1.565 2.06 0 N-CA-C 118.214 2.351 . . . . 2.0 118.214 -179.764 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 34' ' ' VAL . . . . . . . . . . . . 0.314 14.3 m -98.0 -14.65 7.69 Favored 'Isoleucine or valine' 0 N--CA 1.508 2.459 0 N-CA-C 113.762 1.023 . . . . 2.0 113.762 179.456 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 35' ' ' LYS . . . . . 0.439 ' HB2' ' SD ' ' A' ' 24' ' ' MET 0.276 3.1 tmtt? -161.93 155.45 21.14 Favored 'General case' 0 CA--C 1.568 1.658 0 C-N-CA 126.332 1.853 . . . . 2.0 108.623 179.472 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 36' ' ' ARG . . . . . . . . . . . . 0.305 13.1 ttp180 -140.64 105.52 4.95 Favored 'General case' 0 CA--C 1.581 2.154 0 N-CA-C 103.024 -2.954 . . . . 2.0 103.024 -180.0 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . -134.14 -139.96 4.22 Favored Glycine 0 N--CA 1.502 3.066 0 N-CA-C 121.622 3.409 . . . . 2.0 121.622 -179.502 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 38' ' ' CYS . . . . . . . . . . . . . 0.8 OUTLIER -135.24 142.4 45.96 Favored 'General case' 0 N--CA 1.498 1.967 0 N-CA-C 113.645 0.98 . . . . 2.0 113.645 -179.971 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 39' ' ' ILE . . . . . 0.502 HG21 ' HD3' ' A' ' 43' ' ' PRO . 8.2 tp -166.57 171.36 0.21 Allowed 'Isoleucine or valine' 0 N--CA 1.507 2.4 0 O-C-N 120.777 -1.202 . . . . 2.0 114.085 -179.623 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 40' ' ' ASP . . . . . . . . . . . . . 20.6 m-20 -87.46 -52.67 5.23 Favored 'General case' 0 CA--C 1.577 1.992 0 O-C-N 120.131 -1.606 . . . . 2.0 112.163 179.364 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 95.7 t -132.8 39.58 0.7 Allowed 'Isoleucine or valine' 0 N--CA 1.51 2.537 0 N-CA-C 114.131 1.16 . . . . 2.0 114.131 -179.624 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 42' ' ' CYS . . . . . . . . . . . . 0.257 2.5 m 73.28 114.89 0.03 OUTLIER Pre-proline 0 N--CA 1.515 2.818 0 N-CA-C 103.278 -2.86 . . . . 2.0 103.278 -179.579 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 43' ' ' PRO . . . . . 0.502 ' HD3' HG21 ' A' ' 39' ' ' ILE . 12.7 Cg_exo -58.7 170.58 2.5 Favored 'Trans proline' 0 C--N 1.373 1.844 0 CA-C-N 127.039 3.549 . . . . 2.0 118.796 -179.318 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 56.4 mtmt -64.45 99.11 0.28 Allowed 'General case' 0 CA--C 1.574 1.887 0 CA-C-O 123.558 1.647 . . . . 2.0 108.023 179.719 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 45' ' ' ASN . . . . . . . . . . . . 0.276 4.0 p-10 -71.89 -157.87 0.04 OUTLIER 'General case' 0 CA--C 1.569 1.702 0 N-CA-C 118.215 2.672 . . . . 2.0 118.215 -179.555 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 46' ' ' SER . . . . . . . . . . . . 0.315 6.3 t 78.11 -43.46 0.38 Allowed 'General case' 0 N--CA 1.489 1.48 0 N-CA-C 117.519 2.414 . . . . 2.0 117.519 179.945 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 47' ' ' LEU . . . . . . . . . . . . . 2.6 pp -47.6 -49.83 25.84 Favored 'General case' 0 N--CA 1.507 2.417 0 CA-C-N 120.348 1.431 . . . . 2.0 113.264 179.643 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 90.3 mt -156.34 25.68 0.35 Allowed 'General case' 0 CA--C 1.586 2.335 0 C-N-CA 126.947 2.099 . . . . 2.0 109.031 179.434 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 49' ' ' VAL . . . . . . . . . . . . . 3.7 p -168.07 171.24 0.18 Allowed 'Isoleucine or valine' 0 CA--C 1.587 2.38 0 N-CA-C 119.425 3.12 . . . . 2.0 119.425 -178.902 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 23.1 ttpt -151.62 75.1 1.15 Allowed 'General case' 0 CA--C 1.583 2.245 0 N-CA-C 101.501 -3.518 . . . . 2.0 101.501 178.954 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 99.0 m-85 -51.37 131.85 28.9 Favored 'General case' 0 CA--C 1.565 1.531 1 N-CA-C 123.17 4.507 . . . . 2.0 123.17 -179.241 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 52' ' ' VAL . . . . . . . . . . . . . 7.0 t -100.46 139.92 20.72 Favored 'Isoleucine or valine' 0 CA--C 1.577 2.018 1 N-CA-C 99.297 -4.334 . . . . 2.0 99.297 179.023 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 53' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -145.45 143.68 30.17 Favored 'General case' 0 CA--C 1.568 1.643 0 O-C-N 118.509 -2.619 . . . . 2.0 115.683 -179.148 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 54' ' ' CYS . . . . . . . . . . . . . 25.7 p -126.78 120.46 29.39 Favored 'General case' 0 CA--C 1.572 1.821 0 C-N-CA 123.448 0.699 . . . . 2.0 110.314 179.905 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 9.0 m120 -51.27 6.81 0.0 OUTLIER 'General case' 0 N--CA 1.506 2.367 1 N-CA-C 125.471 5.36 . . . . 2.0 125.471 -179.506 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 56' ' ' THR . . . . . . . . . . . . 0.252 5.5 t -137.6 175.98 9.12 Favored 'General case' 0 N--CA 1.504 2.233 0 CA-C-N 123.31 2.777 . . . . 2.0 117.315 -179.758 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 57' ' ' ASP . . . . . . . . . . . . . 38.1 m-20 -61.4 116.2 4.47 Favored 'General case' 0 N--CA 1.487 1.415 0 N-CA-C 115.366 1.617 . . . . 2.0 115.366 -179.931 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 58' ' ' ARG . . . . . . . . . . . . 0.315 38.2 mtp180 62.37 21.26 12.43 Favored 'General case' 0 CA--C 1.578 2.046 0 N-CA-C 117.999 2.592 . . . . 2.0 117.999 -179.969 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 59' ' ' CYS . . . . . . . . . . . . . 29.1 p -72.96 -24.7 60.82 Favored 'General case' 0 CA--C 1.573 1.862 0 N-CA-C 116.816 2.154 . . . . 2.0 116.816 179.829 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 60' ' ' ASN . . . . . . . . . . . . . 41.2 p-10 . . . . . 0 CA--C 1.56 1.334 0 CA-C-O 124.161 1.934 . . . . 2.0 112.229 179.849 . . . . . . . . 0 0 . 1 . 005 nuclear build core ' A' A ' 1' ' ' LEU . . . . . 0.438 HD23 ' SG ' ' A' ' 3' ' ' CYS . 6.0 tp . . . . . 0 CA--C 1.57 1.721 0 N-CA-C 113.497 0.925 . . . . 2.0 113.497 . . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -85.66 137.36 32.89 Favored 'General case' 0 CA--C 1.571 1.779 0 N-CA-C 107.886 -1.153 . . . . 2.0 107.886 179.711 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 3' ' ' CYS . . . . . 0.438 ' SG ' HD23 ' A' ' 1' ' ' LEU . 88.2 m -139.59 167.38 22.23 Favored 'General case' 0 N--CA 1.494 1.772 0 O-C-N 119.653 -1.904 . . . . 2.0 114.216 -179.89 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 69.4 m-80 -111.36 138.28 48.04 Favored 'General case' 0 CA--C 1.563 1.48 0 N-CA-C 116.969 2.211 . . . . 2.0 116.969 -179.858 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 5' ' ' LYS . . . . . 0.402 ' H ' ' HB1' ' A' ' 10' ' ' ALA 0.26 14.8 ptpt -87.56 172.17 9.95 Favored 'General case' 0 CA--C 1.587 2.396 0 CA-C-N 120.223 1.374 . . . . 2.0 107.481 178.912 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 1.5 mm? -39.98 -49.34 2.48 Favored 'General case' 0 N--CA 1.506 2.369 0 N-CA-C 120.897 3.665 . . . . 2.0 120.897 -179.835 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 7' ' ' ILE . . . . . . . . . . . . . 21.5 mt -73.7 147.11 86.5 Favored Pre-proline 0 CA--C 1.585 2.325 0 N-CA-C 114.2 1.185 . . . . 2.0 114.2 -179.79 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 70.6 Cg_exo -44.79 -45.54 13.53 Favored 'Trans proline' 0 CA--C 1.567 2.164 0 N-CA-C 119.864 2.986 . . . . 2.0 119.864 179.827 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 9' ' ' ILE . . . . . . . . . . . . 0.297 0.2 OUTLIER -59.37 -46.96 92.15 Favored 'Isoleucine or valine' 0 N--CA 1.514 2.726 0 CA-C-N 120.571 1.532 . . . . 2.0 112.356 179.611 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 10' ' ' ALA . . . . . 0.402 ' HB1' ' H ' ' A' ' 5' ' ' LYS . . . 55.97 159.2 0.01 OUTLIER 'General case' 0 CA--C 1.578 2.032 1 N-CA-C 123.918 4.784 . . . . 2.0 123.918 179.345 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 8.2 t -66.3 -174.31 0.26 Allowed 'General case' 0 CA--C 1.58 2.103 0 N-CA-C 117.763 2.505 . . . . 2.0 117.763 -179.902 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 12' ' ' LYS . . . . . . . . . . . . 0.309 50.4 tptt -98.23 -90.56 0.28 Allowed 'General case' 0 CA--C 1.572 1.801 1 N-CA-C 123.304 4.557 . . . . 2.0 123.304 -179.485 . . . . . . . . 3 2 . 1 . 005 nuclear build core ' A' A ' 13' ' ' THR . . . . . . . . . . . . . 8.4 t -156.92 170.81 21.64 Favored 'General case' 0 N--CA 1.506 2.351 0 N-CA-C 120.108 3.373 . . . . 2.0 120.108 -179.143 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 14' ' ' CYS . . . . . . . . . . . . 0.419 0.5 OUTLIER -146.4 168.44 11.59 Favored Pre-proline 0 CA--C 1.6 2.902 0 C-N-CA 126.104 1.761 . . . . 2.0 108.713 179.215 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 15' ' ' PRO . . . . . . . . . . . . . 92.2 Cg_exo -45.07 171.37 0.02 OUTLIER 'Trans proline' 0 CA--C 1.571 2.347 1 N-CA-C 128.673 6.374 . . . . 2.0 128.673 -179.488 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -78.72 165.36 23.69 Favored 'General case' 0 N--CA 1.499 1.986 0 N-CA-C 104.506 -2.405 . . . . 2.0 104.506 178.944 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . 85.34 -47.94 3.93 Favored Glycine 1 N--CA 1.524 4.512 0 O-C-N 117.082 -3.511 . . . . 2.0 105.37 -178.642 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 39.9 mmtm -83.3 63.78 7.42 Favored 'General case' 0 CA--C 1.604 3.031 1 N-CA-C 99.939 -4.097 . . . . 2.0 99.939 178.493 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 37.3 p-10 -80.85 -20.49 42.23 Favored 'General case' 0 N--CA 1.483 1.18 0 N-CA-C 121.527 3.899 . . . . 2.0 121.527 -179.261 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 70.7 mt -88.59 112.95 23.64 Favored 'General case' 0 CA--C 1.555 1.136 0 CA-C-N 119.284 0.947 . . . . 2.0 110.586 179.771 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 21' ' ' CYS . . . . . 0.425 ' SG ' HD21 ' A' ' 1' ' ' LEU . 1.7 m -79.91 95.4 6.08 Favored 'General case' 0 CA--C 1.576 1.947 0 N-CA-C 100.389 -3.93 . . . . 2.0 100.389 179.257 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 22' ' ' TYR . . . . . . . . . . . . 0.266 0.0 OUTLIER -76.14 154.72 35.24 Favored 'General case' 0 CA--C 1.552 1.054 0 N-CA-C 121.008 3.707 . . . . 2.0 121.008 -179.35 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 31.8 mtmt -117.73 92.2 3.77 Favored 'General case' 0 CA--C 1.559 1.317 1 N-CA-C 99.626 -4.212 . . . . 2.0 99.626 179.311 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 24' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -71.13 72.97 0.63 Allowed 'General case' 0 CA--C 1.578 2.027 0 C-N-CA 124.374 1.07 . . . . 2.0 108.719 179.912 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 25' ' ' PHE . . . . . . . . . . . . . 9.6 m-30 -62.1 133.23 54.99 Favored 'General case' 0 N--CA 1.486 1.367 0 O-C-N 120.709 -1.245 . . . . 2.0 113.152 -179.856 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 26' ' ' MET . . . . . . . . . . . . . 34.4 mtp -64.48 131.2 46.44 Favored 'General case' 0 N--CA 1.489 1.503 0 N-CA-C 113.131 0.789 . . . . 2.0 113.131 -179.995 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 27' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -54.22 -38.83 66.15 Favored 'General case' 0 N--CA 1.514 2.731 0 CA-C-N 120.779 1.627 . . . . 2.0 112.164 179.461 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 50.4 m -79.73 -32.52 41.15 Favored 'General case' 0 CA--C 1.586 2.337 0 N-CA-C 114.062 1.134 . . . . 2.0 114.062 179.418 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 52.7 t0 -146.86 84.31 1.6 Allowed 'General case' 0 CA--C 1.573 1.85 0 O-C-N 120.599 -1.313 . . . . 2.0 109.723 179.871 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 1.6 mm? -51.18 -67.52 0.24 Allowed 'General case' 0 CA--C 1.576 1.972 0 N-CA-C 120.763 3.616 . . . . 2.0 120.763 -179.496 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 31' ' ' THR . . . . . . . . . . . . 0.337 15.3 t -19.22 -61.97 0.02 OUTLIER 'General case' 0 N--CA 1.51 2.538 1 N-CA-C 121.825 4.009 . . . . 2.0 121.825 -179.793 . . . . . . . . 3 2 . 1 . 005 nuclear build core ' A' A ' 32' ' ' ILE . . . . . . . . . . . . . 1.8 mp -100.71 103.68 26.02 Favored Pre-proline 0 CA--C 1.589 2.468 1 N-CA-C 99.661 -4.2 . . . . 2.0 99.661 179.577 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 33' ' ' PRO . . . . . . . . . . . . . 14.5 Cg_endo -62.8 171.1 6.28 Favored 'Trans proline' 0 CA--C 1.561 1.862 1 N-CA-C 123.372 4.335 . . . . 2.0 123.372 -179.512 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 34' ' ' VAL . . . . . . . . . . . . . 97.8 t -73.66 -55.57 12.05 Favored 'Isoleucine or valine' 0 CA--C 1.59 2.49 0 N-CA-C 104.467 -2.42 . . . . 2.0 104.467 178.963 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 36.7 tttm -136.35 162.17 33.75 Favored 'General case' 0 CA--C 1.564 1.496 0 CA-C-O 124.449 2.071 . . . . 2.0 108.963 179.601 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 36' ' ' ARG . . . . . . . . . . . . 0.346 40.2 ttp180 -138.26 108.61 6.49 Favored 'General case' 0 CA--C 1.574 1.866 1 N-CA-C 98.495 -4.631 . . . . 2.0 98.495 179.533 . . . . . . . . 3 2 . 1 . 005 nuclear build core ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . -145.04 -147.77 4.7 Favored Glycine 0 N--CA 1.489 2.21 0 O-C-N 119.053 -2.279 . . . . 2.0 118.387 -179.56 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 38' ' ' CYS . . . . . . . . . . . . . 19.1 p -115.47 137.51 51.98 Favored 'General case' 0 CA--C 1.562 1.421 0 C-N-CA 123.723 0.809 . . . . 2.0 111.587 179.959 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 39' ' ' ILE . . . . . . . . . . . . . 3.4 tp -160.23 166.12 0.73 Allowed 'Isoleucine or valine' 0 N--CA 1.495 1.809 0 O-C-N 120.879 -1.138 . . . . 2.0 113.838 -179.906 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 40' ' ' ASP . . . . . . . . . . . . . 9.6 p30 -80.87 -102.05 0.03 OUTLIER 'General case' 0 N--CA 1.507 2.406 0 N-CA-C 103.736 -2.69 . . . . 2.0 103.736 179.435 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 87.7 t -85.98 162.12 2.87 Favored 'Isoleucine or valine' 0 CA--C 1.58 2.126 0 N-CA-C 104.595 -2.372 . . . . 2.0 104.595 178.982 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 42' ' ' CYS . . . . . . . . . . . . . 1.7 m -63.78 107.24 1.19 Allowed Pre-proline 0 CA--C 1.605 3.068 1 N-CA-C 100.007 -4.071 . . . . 2.0 100.007 179.554 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 43' ' ' PRO . . . . . . . . . . . . . 26.4 Cg_exo -50.37 -178.02 0.01 OUTLIER 'Trans proline' 0 C--N 1.372 1.791 1 N-CA-C 125.088 4.996 . . . . 2.0 125.088 -178.709 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 96.7 mttt -73.08 103.15 3.74 Favored 'General case' 0 CA--C 1.568 1.639 0 N-CA-C 104.187 -2.523 . . . . 2.0 104.187 179.386 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 45' ' ' ASN . . . . . . . . . . . . 0.25 2.0 p-10 -67.6 117.45 9.56 Favored 'General case' 0 CA--C 1.563 1.466 0 N-CA-C 117.174 2.287 . . . . 2.0 117.174 -179.358 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 14.9 t -82.73 179.27 7.83 Favored 'General case' 0 CA--C 1.565 1.54 0 N-CA-C 113.776 1.028 . . . . 2.0 113.776 179.962 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 47' ' ' LEU . . . . . . . . . . . . . 88.8 mt -51.55 -25.01 5.97 Favored 'General case' 0 N--CA 1.507 2.391 0 N-CA-C 116.424 2.009 . . . . 2.0 116.424 179.768 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 78.7 mt -102.51 7.33 40.2 Favored 'General case' 0 CA--C 1.579 2.093 0 C-N-CA 125.131 1.372 . . . . 2.0 114.636 179.591 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 49' ' ' VAL . . . . . . . . . . . . . 9.0 p -153.93 159.24 3.37 Favored 'Isoleucine or valine' 0 N--CA 1.502 2.13 0 N-CA-C 117.505 2.409 . . . . 2.0 117.505 -179.644 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER -153.78 78.47 1.13 Allowed 'General case' 0 CA--C 1.576 1.967 0 N-CA-C 102.752 -3.055 . . . . 2.0 102.752 179.343 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER -58.69 128.81 39.05 Favored 'General case' 0 CA--C 1.569 1.697 1 N-CA-C 122.7 4.333 . . . . 2.0 122.7 -179.341 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 52' ' ' VAL . . . . . . . . . . . . 0.284 14.1 t -103.13 151.88 6.11 Favored 'Isoleucine or valine' 0 CA--C 1.578 2.047 0 N-CA-C 102.107 -3.294 . . . . 2.0 102.107 179.047 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 53' ' ' CYS . . . . . . . . . . . . 0.261 0.8 OUTLIER -147.5 160.82 42.17 Favored 'General case' 0 CA--C 1.568 1.65 0 N-CA-C 119.178 3.029 . . . . 2.0 119.178 -179.026 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 54' ' ' CYS . . . . . . . . . . . . . 29.0 p -143.34 120.69 11.61 Favored 'General case' 0 CA--C 1.574 1.895 0 C-N-CA 123.928 0.891 . . . . 2.0 110.342 179.78 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 14.8 m120 -55.45 12.01 0.0 OUTLIER 'General case' 0 N--CA 1.508 2.467 1 N-CA-C 124.518 5.007 . . . . 2.0 124.518 -179.674 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 56' ' ' THR . . . . . . . . . . . . 0.274 4.9 t -138.26 177.82 7.59 Favored 'General case' 0 N--CA 1.502 2.134 0 CA-C-N 123.077 2.671 . . . . 2.0 116.794 -179.839 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 57' ' ' ASP . . . . . . . . . . . . . 69.9 m-20 -65.11 120.76 13.27 Favored 'General case' 0 CA--C 1.565 1.541 0 N-CA-C 115.779 1.77 . . . . 2.0 115.779 -179.755 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 58' ' ' ARG . . . . . . . . . . . . . 10.7 mmm180 56.45 31.19 18.39 Favored 'General case' 0 CA--C 1.586 2.348 0 N-CA-C 115.193 1.553 . . . . 2.0 115.193 -179.919 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 59' ' ' CYS . . . . . . . . . . . . . 29.7 p -83.77 -21.13 32.3 Favored 'General case' 0 N--CA 1.495 1.813 0 N-CA-C 116.432 2.012 . . . . 2.0 116.432 179.848 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 60' ' ' ASN . . . . . . . . . . . . . 25.3 p-10 . . . . . 0 CA--C 1.56 1.34 0 CA-C-O 124.967 2.318 . . . . 2.0 113.079 179.886 . . . . . . . . 0 0 . 1 . 006 nuclear build core ' A' A ' 1' ' ' LEU . . . . . 0.603 HD13 ' SG ' ' A' ' 3' ' ' CYS . 0.7 OUTLIER . . . . . 0 CA--C 1.576 1.944 0 CA-C-O 123.257 1.503 . . . . 2.0 113.785 . . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 1.6 mptp? -151.87 108.41 3.47 Favored 'General case' 0 CA--C 1.565 1.523 0 N-CA-C 101.15 -3.648 . . . . 2.0 101.15 179.631 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 3' ' ' CYS . . . . . 0.603 ' SG ' HD13 ' A' ' 1' ' ' LEU . 90.7 m -114.01 -168.38 1.35 Allowed 'General case' 0 N--CA 1.499 1.979 0 CA-C-N 122.131 2.241 . . . . 2.0 115.941 -179.926 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 80.4 m-20 -139.4 113.35 8.68 Favored 'General case' 0 CA--C 1.56 1.329 0 C-N-CA 123.843 0.857 . . . . 2.0 110.547 179.911 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 5' ' ' LYS . . . . . 0.429 ' H ' ' HB1' ' A' ' 10' ' ' ALA . 0.3 OUTLIER -66.74 -179.03 0.8 Allowed 'General case' 0 CA--C 1.583 2.243 0 CA-C-N 121.202 1.819 . . . . 2.0 111.44 179.416 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -45.03 -41.87 7.9 Favored 'General case' 0 N--CA 1.509 2.493 0 N-CA-C 120.86 3.652 . . . . 2.0 120.86 -179.704 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 7' ' ' ILE . . . . . . . . . . . . . 38.5 mt -57.03 144.13 69.74 Favored Pre-proline 0 CA--C 1.586 2.348 0 C-N-CA 124.602 1.161 . . . . 2.0 113.53 179.861 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 90.1 Cg_exo -46.48 -42.6 22.99 Favored 'Trans proline' 0 CA--C 1.572 2.382 0 N-CA-C 118.901 2.616 . . . . 2.0 118.901 179.828 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 9' ' ' ILE . . . . . . . . . . . . 0.264 9.5 pt -88.37 -67.49 0.73 Allowed 'Isoleucine or valine' 0 N--CA 1.499 2.018 0 C-N-CA 123.799 0.84 . . . . 2.0 112.125 179.669 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 10' ' ' ALA . . . . . 0.429 ' HB1' ' H ' ' A' ' 5' ' ' LYS 0.259 . . 63.61 166.45 0.14 Allowed 'General case' 0 CA--C 1.581 2.166 0 N-CA-C 120.149 3.388 . . . . 2.0 120.149 179.818 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 15.8 t -87.01 149.86 24.46 Favored 'General case' 0 N--CA 1.495 1.819 0 O-C-N 121.099 -1.0 . . . . 2.0 113.437 179.984 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 12' ' ' LYS . . . . . 0.416 ' HG3' ' H ' ' A' ' 13' ' ' THR 0.388 9.0 ptpp? -84.21 -98.03 0.06 Allowed 'General case' 0 CA--C 1.584 2.287 1 N-CA-C 123.523 4.638 . . . . 2.0 123.523 -179.431 . . . . . . . . 4 3 . 1 . 006 nuclear build core ' A' A ' 13' ' ' THR . . . . . 0.416 ' H ' ' HG3' ' A' ' 12' ' ' LYS . 35.7 m -22.58 129.56 0.02 OUTLIER 'General case' 0 N--CA 1.505 2.285 1 N-CA-C 123.494 4.627 . . . . 2.0 123.494 -179.558 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 52.9 t -156.34 146.05 15.47 Favored Pre-proline 0 CA--C 1.594 2.665 0 C-N-CA 125.525 1.53 . . . . 2.0 110.095 179.72 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 15' ' ' PRO . . . . . . . . . . . . . 44.2 Cg_exo -47.76 169.91 0.06 OUTLIER 'Trans proline' 0 CA--C 1.576 2.606 1 N-CA-C 126.042 5.362 . . . . 2.0 126.042 -179.836 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -78.02 165.77 23.64 Favored 'General case' 0 N--CA 1.496 1.865 0 C-N-CA 124.8 1.24 . . . . 2.0 110.236 179.532 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . 82.86 -48.37 4.0 Favored Glycine 1 N--CA 1.517 4.039 0 O-C-N 119.049 -2.282 . . . . 2.0 109.256 -179.106 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 35.7 mmtm -77.34 91.99 3.88 Favored 'General case' 0 CA--C 1.573 1.858 0 N-CA-C 101.953 -3.351 . . . . 2.0 101.953 179.262 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 9.9 p30 -98.38 -27.23 14.19 Favored 'General case' 0 N--CA 1.491 1.612 0 N-CA-C 117.369 2.359 . . . . 2.0 117.369 -179.85 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 76.6 mt -83.7 114.12 21.35 Favored 'General case' 0 CA--C 1.557 1.233 0 N-CA-C 116.148 1.907 . . . . 2.0 116.148 -179.849 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 21' ' ' CYS . . . . . 0.441 ' SG ' HD22 ' A' ' 1' ' ' LEU . 5.2 m -84.45 91.44 7.83 Favored 'General case' 0 CA--C 1.578 2.031 1 N-CA-C 99.989 -4.078 . . . . 2.0 99.989 179.152 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 22' ' ' TYR . . . . . . . . . . . . . 8.1 p90 -75.47 158.89 31.98 Favored 'General case' 0 CA--C 1.552 1.036 0 N-CA-C 120.461 3.504 . . . . 2.0 120.461 -179.311 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 19.0 ptpt -133.21 101.55 5.24 Favored 'General case' 0 CA--C 1.562 1.406 0 N-CA-C 104.952 -2.24 . . . . 2.0 104.952 179.491 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 24' ' ' MET . . . . . . . . . . . . . 0.1 OUTLIER -68.81 86.92 0.34 Allowed 'General case' 0 N--CA 1.485 1.285 0 C-N-CA 125.438 1.495 . . . . 2.0 112.542 179.949 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 25' ' ' PHE . . . . . . . . . . . . . 8.2 m-30 -78.28 108.33 11.54 Favored 'General case' 0 CA--C 1.563 1.444 0 N-CA-C 104.601 -2.37 . . . . 2.0 104.601 179.568 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 26' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -58.27 128.5 37.43 Favored 'General case' 0 CA--C 1.57 1.712 0 CA-C-O 117.869 -1.062 . . . . 2.0 110.806 179.999 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 27' ' ' MET . . . . . . . . . . . . . 31.0 mtp -41.59 -36.73 0.98 Allowed 'General case' 0 N--CA 1.51 2.54 0 N-CA-C 117.949 2.574 . . . . 2.0 117.949 -179.891 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 67.3 m -89.23 -32.57 17.36 Favored 'General case' 0 CA--C 1.588 2.424 0 C-N-CA 124.189 0.996 . . . . 2.0 112.151 179.293 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 15.9 m-20 -130.44 87.61 2.53 Favored 'General case' 0 CA--C 1.576 1.945 0 O-C-N 119.424 -2.047 . . . . 2.0 105.592 179.748 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 1.5 mm? -74.26 -75.22 0.16 Allowed 'General case' 0 CA--C 1.578 2.022 0 N-CA-C 119.652 3.205 . . . . 2.0 119.652 -179.528 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 31' ' ' THR . . . . . . . . . . . . 0.257 80.7 p -17.92 -68.27 0.02 OUTLIER 'General case' 0 N--CA 1.508 2.47 0 N-CA-C 121.065 3.728 . . . . 2.0 121.065 -179.588 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 32' ' ' ILE . . . . . . . . . . . . . 1.9 mp -90.79 108.02 24.68 Favored Pre-proline 0 CA--C 1.585 2.315 1 N-CA-C 99.714 -4.18 . . . . 2.0 99.714 179.503 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 33' ' ' PRO . . . . . . . . . . . . . 43.1 Cg_endo -61.7 162.85 20.19 Favored 'Trans proline' 0 CA--C 1.56 1.787 0 N-CA-C 119.012 2.659 . . . . 2.0 119.012 -179.659 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 34' ' ' VAL . . . . . . . . . . . . . 14.2 t -88.19 -47.74 15.35 Favored 'Isoleucine or valine' 0 N--CA 1.503 2.2 0 N-CA-C 107.011 -1.477 . . . . 2.0 107.011 179.148 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 4.6 tptp -124.78 155.27 39.63 Favored 'General case' 0 CA--C 1.564 1.505 0 CA-C-O 124.159 1.933 . . . . 2.0 108.559 179.605 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 2.9 mtp180 -141.74 110.85 6.29 Favored 'General case' 0 CA--C 1.566 1.576 0 N-CA-C 100.495 -3.891 . . . . 2.0 100.495 179.782 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . -141.94 -152.74 5.77 Favored Glycine 0 N--CA 1.487 2.035 0 N-CA-C 118.8 2.28 . . . . 2.0 118.8 -179.7 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 38' ' ' CYS . . . . . 0.42 ' HB3' ' SG ' ' A' ' 3' ' ' CYS . 25.7 p -127.66 126.69 42.43 Favored 'General case' 0 CA--C 1.562 1.441 0 C-N-CA 123.581 0.752 . . . . 2.0 112.401 179.902 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 39' ' ' ILE . . . . . 0.424 HG21 ' HD3' ' A' ' 43' ' ' PRO . 8.2 tp -147.81 179.22 0.8 Allowed 'Isoleucine or valine' 0 N--CA 1.497 1.878 0 C-N-CA 124.007 0.923 . . . . 2.0 112.858 -179.702 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 40' ' ' ASP . . . . . 0.412 ' H ' HG13 ' A' ' 39' ' ' ILE . 18.0 p-10 -102.91 -43.86 5.41 Favored 'General case' 0 CA--C 1.569 1.702 0 O-C-N 120.267 -1.521 . . . . 2.0 113.539 179.707 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 4.3 t -137.2 35.94 0.56 Allowed 'Isoleucine or valine' 0 N--CA 1.509 2.496 0 CA-C-N 120.086 1.312 . . . . 2.0 112.459 179.975 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 42' ' ' CYS . . . . . . . . . . . . 0.349 2.7 m 75.31 122.03 0.03 OUTLIER Pre-proline 0 CA--C 1.614 3.415 1 N-CA-C 99.919 -4.104 . . . . 2.0 99.919 -179.26 . . . . . . . . 3 2 . 1 . 006 nuclear build core ' A' A ' 43' ' ' PRO . . . . . 0.424 ' HD3' HG21 ' A' ' 39' ' ' ILE . 27.4 Cg_exo -55.01 -4.08 0.34 Allowed 'Trans proline' 0 N--CA 1.503 2.077 1 N-CA-C 129.512 6.697 . . . . 2.0 129.512 -178.851 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 44' ' ' LYS . . . . . . . . . . . . 0.331 69.3 mttt 110.1 104.66 0.0 OUTLIER 'General case' 0 N--CA 1.494 1.738 0 N-CA-C 100.685 -3.82 . . . . 2.0 100.685 -179.446 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 45' ' ' ASN . . . . . . . . . . . . . 4.0 p-10 -72.77 101.34 3.08 Favored 'General case' 0 CA--C 1.566 1.592 0 N-CA-C 116.449 2.018 . . . . 2.0 116.449 -179.393 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 14.1 t -81.64 178.43 8.34 Favored 'General case' 0 CA--C 1.567 1.625 0 N-CA-C 113.245 0.832 . . . . 2.0 113.245 179.888 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 47' ' ' LEU . . . . . . . . . . . . 0.392 3.4 pp -57.3 -12.78 2.64 Favored 'General case' 0 N--CA 1.508 2.466 0 N-CA-C 117.072 2.249 . . . . 2.0 117.072 179.729 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 77.3 mt -106.61 4.22 27.75 Favored 'General case' 0 CA--C 1.584 2.253 0 C-N-CA 125.549 1.54 . . . . 2.0 111.867 179.209 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 49' ' ' VAL . . . . . . . . . . . . . 14.4 p -157.44 149.33 9.78 Favored 'Isoleucine or valine' 0 N--CA 1.501 2.11 0 CA-C-N 123.378 2.808 . . . . 2.0 116.988 -179.604 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 17.3 ttpt -141.51 73.18 1.41 Allowed 'General case' 0 CA--C 1.58 2.112 0 N-CA-C 104.173 -2.529 . . . . 2.0 104.173 179.539 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER -59.85 130.15 45.35 Favored 'General case' 0 N--CA 1.494 1.755 0 N-CA-C 120.819 3.637 . . . . 2.0 120.819 -179.367 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 52' ' ' VAL . . . . . . . . . . . . . 18.7 t -99.69 121.17 50.04 Favored 'Isoleucine or valine' 0 CA--C 1.574 1.891 1 N-CA-C 100.091 -4.04 . . . . 2.0 100.091 179.244 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 53' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -121.42 135.57 55.05 Favored 'General case' 0 CA--C 1.574 1.896 0 N-CA-C 117.715 2.487 . . . . 2.0 117.715 -179.198 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 54' ' ' CYS . . . . . . . . . . . . . 31.2 p -118.17 120.14 36.81 Favored 'General case' 0 N--CA 1.495 1.788 0 C-N-CA 124.112 0.965 . . . . 2.0 111.96 179.835 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 25.0 p-10 -63.06 40.5 0.01 OUTLIER 'General case' 0 N--CA 1.506 2.36 1 N-CA-C 123.028 4.455 . . . . 2.0 123.028 -179.509 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 5.9 t -155.16 172.57 17.92 Favored 'General case' 0 N--CA 1.497 1.911 0 O-C-N 119.656 -1.902 . . . . 2.0 113.999 179.946 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 57' ' ' ASP . . . . . . . . . . . . . 85.5 m-20 -67.46 122.44 17.97 Favored 'General case' 0 CA--C 1.568 1.648 0 N-CA-C 116.538 2.051 . . . . 2.0 116.538 -179.851 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 58' ' ' ARG . . . . . . . . . . . . 0.254 37.5 mtm105 56.35 28.81 14.03 Favored 'General case' 0 CA--C 1.574 1.901 0 N-CA-C 117.935 2.568 . . . . 2.0 117.935 179.802 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 59' ' ' CYS . . . . . . . . . . . . . 30.2 p -86.14 14.63 6.07 Favored 'General case' 0 CA--C 1.579 2.074 0 N-CA-C 117.191 2.293 . . . . 2.0 117.191 179.893 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 60' ' ' ASN . . . . . . . . . . . . . 35.7 p-10 . . . . . 0 CA--C 1.561 1.369 0 CA-C-O 124.012 1.863 . . . . 2.0 112.541 -179.948 . . . . . . . . 0 0 . 1 . 007 nuclear build core ' A' A ' 1' ' ' LEU . . . . . 0.514 HD21 ' SG ' ' A' ' 3' ' ' CYS . 6.7 tt . . . . . 0 N--CA 1.502 2.175 0 CA-C-O 116.779 -1.581 . . . . 2.0 110.926 . . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 26.3 tttp -111.62 -47.31 3.17 Favored 'General case' 0 N--CA 1.521 3.08 0 CA-C-N 122.72 2.509 . . . . 2.0 113.798 -179.831 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 3' ' ' CYS . . . . . 0.514 ' SG ' HD21 ' A' ' 1' ' ' LEU 0.454 1.9 m 83.09 -136.65 0.01 OUTLIER 'General case' 0 CA--C 1.564 1.518 0 N-CA-C 119.483 3.142 . . . . 2.0 119.483 179.786 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 35.7 m-20 -131.67 131.54 43.21 Favored 'General case' 0 N--CA 1.484 1.242 0 N-CA-C 116.363 1.986 . . . . 2.0 116.363 -179.448 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 19.8 ptmt -76.11 -164.35 0.37 Allowed 'General case' 0 N--CA 1.501 2.077 0 CA-C-N 119.746 1.157 . . . . 2.0 108.398 179.193 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 4.5 mm? -52.65 -30.54 32.25 Favored 'General case' 0 N--CA 1.514 2.753 0 O-C-N 117.617 -3.177 . . . . 2.0 114.586 179.666 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 7' ' ' ILE . . . . . . . . . . . . . 51.2 mm -66.72 132.76 94.05 Favored Pre-proline 0 CA--C 1.587 2.365 0 C-N-CA 125.356 1.462 . . . . 2.0 109.784 179.562 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 8' ' ' PRO . . . . . . . . . . . . 0.314 20.5 Cg_exo -18.61 -71.76 0.02 OUTLIER 'Trans proline' 0 CA--C 1.568 2.225 1 N-CA-C 123.136 4.244 . . . . 2.0 123.136 -179.859 . . . . . . . . 3 2 . 1 . 007 nuclear build core ' A' A ' 9' ' ' ILE . . . . . . . . . . . . . 17.2 tt -135.37 73.12 0.36 Allowed 'Isoleucine or valine' 0 N--CA 1.503 2.191 0 CA-C-O 122.183 0.992 . . . . 2.0 109.15 179.966 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 10' ' ' ALA . . . . . . . . . . . . 0.359 . . -71.46 -101.11 0.01 OUTLIER 'General case' 0 CA--C 1.583 2.223 1 N-CA-C 125.576 5.399 . . . . 2.0 125.576 -179.433 . . . . . . . . 3 2 . 1 . 007 nuclear build core ' A' A ' 11' ' ' SER . . . . . . . . . . . . 0.253 4.9 t -63.21 -169.76 0.03 OUTLIER 'General case' 0 CA--C 1.581 2.154 1 N-CA-C 123.356 4.576 . . . . 2.0 123.356 -179.255 . . . . . . . . 3 2 . 1 . 007 nuclear build core ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 6.7 tptp -132.19 -79.55 0.5 Allowed 'General case' 0 CA--C 1.582 2.191 0 N-CA-C 118.921 2.934 . . . . 2.0 118.921 -179.788 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 13' ' ' THR . . . . . . . . . . . . . 8.1 t -134.15 118.5 17.75 Favored 'General case' 0 N--CA 1.511 2.583 0 N-CA-C 120.286 3.439 . . . . 2.0 120.286 -179.615 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 14' ' ' CYS . . . . . 0.581 ' SG ' ' HD2' ' A' ' 18' ' ' LYS . 0.5 OUTLIER -101.56 179.86 0.93 Allowed Pre-proline 0 CA--C 1.596 2.74 0 C-N-CA 125.663 1.585 . . . . 2.0 110.555 179.604 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 15' ' ' PRO . . . . . . . . . . . . . 87.8 Cg_exo -51.26 177.05 0.04 OUTLIER 'Trans proline' 0 CA--C 1.572 2.406 1 N-CA-C 123.606 4.426 . . . . 2.0 123.606 -179.876 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 16' ' ' ALA . . . . . . . . . . . . 0.253 . . 19.06 -164.96 0.0 OUTLIER 'General case' 0 N--CA 1.5 2.075 1 N-CA-C 124.009 4.818 . . . . 2.0 124.009 179.768 . . . . . . . . 3 2 . 1 . 007 nuclear build core ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . -81.95 37.03 2.51 Favored Glycine 0 N--CA 1.502 3.059 0 O-C-N 119.886 -1.758 . . . . 2.0 113.636 179.503 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 18' ' ' LYS . . . . . 0.581 ' HD2' ' SG ' ' A' ' 14' ' ' CYS . 0.1 OUTLIER -83.51 82.26 8.37 Favored 'General case' 0 CA--C 1.563 1.469 0 C-N-CA 125.613 1.565 . . . . 2.0 106.886 179.937 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 8.5 p30 -69.34 -34.15 74.19 Favored 'General case' 0 CA--C 1.558 1.278 1 N-CA-C 122.715 4.339 . . . . 2.0 122.715 -179.542 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 49.4 mt -68.91 118.36 11.75 Favored 'General case' 0 CA--C 1.56 1.344 0 N-CA-C 115.951 1.834 . . . . 2.0 115.951 -179.844 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 21' ' ' CYS . . . . . 0.535 ' SG ' ' O ' ' A' ' 56' ' ' THR . 34.4 m -81.88 96.39 7.63 Favored 'General case' 0 CA--C 1.572 1.808 0 N-CA-C 103.143 -2.91 . . . . 2.0 103.143 179.304 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 22' ' ' TYR . . . . . . . . . . . . 0.4 0.0 OUTLIER -68.45 158.21 34.2 Favored 'General case' 0 CA--C 1.56 1.34 0 N-CA-C 119.716 3.228 . . . . 2.0 119.716 -179.515 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 29.4 mtmt -131.36 89.36 2.71 Favored 'General case' 0 CA--C 1.557 1.246 1 N-CA-C 99.664 -4.198 . . . . 2.0 99.664 179.466 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 24' ' ' MET . . . . . 0.45 ' HB3' ' H ' ' A' ' 35' ' ' LYS . 20.4 ttt -71.24 68.31 0.5 Allowed 'General case' 0 CA--C 1.571 1.755 0 O-C-N 121.171 -0.956 . . . . 2.0 111.688 -179.842 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 25' ' ' PHE . . . . . . . . . . . . . 11.3 m-30 -59.0 127.18 30.93 Favored 'General case' 0 N--CA 1.486 1.339 0 O-C-N 120.798 -1.189 . . . . 2.0 113.292 -179.932 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 26' ' ' MET . . . . . . . . . . . . . 84.5 mtp -59.95 128.77 38.51 Favored 'General case' 0 N--CA 1.493 1.689 0 CA-C-O 118.048 -0.977 . . . . 2.0 111.577 179.877 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 27' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -54.44 -35.99 63.56 Favored 'General case' 0 N--CA 1.511 2.604 0 CA-C-N 121.474 1.943 . . . . 2.0 112.529 179.62 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 75.6 m -83.96 -14.05 51.84 Favored 'General case' 0 CA--C 1.591 2.54 0 N-CA-C 114.525 1.305 . . . . 2.0 114.525 179.268 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -161.49 77.92 0.55 Allowed 'General case' 0 N--CA 1.499 2.023 0 O-C-N 119.408 -2.058 . . . . 2.0 108.302 179.855 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 2.4 mm? -46.32 -79.99 0.01 OUTLIER 'General case' 0 CA--C 1.576 1.944 1 N-CA-C 123.532 4.642 . . . . 2.0 123.532 -179.399 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 31' ' ' THR . . . . . . . . . . . . 0.337 14.6 t -19.75 -52.44 0.01 OUTLIER 'General case' 0 N--CA 1.508 2.453 1 N-CA-C 122.941 4.423 . . . . 2.0 122.941 -179.689 . . . . . . . . 3 2 . 1 . 007 nuclear build core ' A' A ' 32' ' ' ILE . . . . . . . . . . . . . 1.8 mp -97.86 106.94 37.36 Favored Pre-proline 0 CA--C 1.591 2.523 0 N-CA-C 101.617 -3.475 . . . . 2.0 101.617 179.545 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 33' ' ' PRO . . . . . . . . . . . . . 3.1 Cg_endo -65.3 167.47 16.47 Favored 'Trans proline' 0 CA--C 1.559 1.772 1 N-CA-C 122.63 4.05 . . . . 2.0 122.63 -179.659 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 34' ' ' VAL . . . . . . . . . . . . . 96.5 t -75.38 -53.37 16.26 Favored 'Isoleucine or valine' 0 CA--C 1.591 2.531 0 N-CA-C 104.546 -2.39 . . . . 2.0 104.546 178.965 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 35' ' ' LYS . . . . . 0.45 ' H ' ' HB3' ' A' ' 24' ' ' MET . 97.6 mttt -149.13 117.82 6.61 Favored 'General case' 0 CA--C 1.552 1.055 0 C-N-CA 125.494 1.518 . . . . 2.0 110.795 179.63 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 36' ' ' ARG . . . . . . . . . . . . 0.358 28.1 ttp180 -88.63 109.59 20.23 Favored 'General case' 0 CA--C 1.594 2.653 0 N-CA-C 101.715 -3.439 . . . . 2.0 101.715 179.689 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . -141.04 -135.81 3.22 Favored Glycine 0 N--CA 1.497 2.764 0 N-CA-C 121.264 3.266 . . . . 2.0 121.264 -179.28 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 38' ' ' CYS . . . . . . . . . . . . . 29.7 p -125.73 141.8 51.83 Favored 'General case' 0 N--CA 1.491 1.598 0 N-CA-C 116.116 1.895 . . . . 2.0 116.116 -179.826 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 39' ' ' ILE . . . . . 0.435 HG12 ' CG ' ' A' ' 43' ' ' PRO . 2.4 tp -164.73 166.69 0.51 Allowed 'Isoleucine or valine' 0 CA--C 1.574 1.881 0 N-CA-C 114.465 1.283 . . . . 2.0 114.465 -179.906 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 40' ' ' ASP . . . . . . . . . . . . . 8.0 p-10 -82.74 -51.51 7.62 Favored 'General case' 0 N--CA 1.505 2.289 0 O-C-N 119.868 -1.77 . . . . 2.0 113.402 179.536 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 87.7 t -133.72 143.28 39.16 Favored 'Isoleucine or valine' 0 CA--C 1.563 1.474 0 N-CA-C 102.271 -3.233 . . . . 2.0 102.271 179.677 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 42' ' ' CYS . . . . . . . . . . . . . 1.0 OUTLIER -57.69 105.41 0.53 Allowed Pre-proline 0 CA--C 1.602 2.967 0 N-CA-C 101.872 -3.381 . . . . 2.0 101.872 179.638 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 43' ' ' PRO . . . . . 0.435 ' CG ' HG12 ' A' ' 39' ' ' ILE . 39.8 Cg_exo -48.41 174.17 0.03 OUTLIER 'Trans proline' 0 C--N 1.371 1.755 1 N-CA-C 126.201 5.423 . . . . 2.0 126.201 -178.638 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 57.2 mttp -72.81 89.22 1.36 Allowed 'General case' 0 CA--C 1.568 1.648 0 CA-C-N 112.889 -1.96 . . . . 2.0 105.927 179.597 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 45' ' ' ASN . . . . . . . . . . . . . 4.1 p-10 -63.62 154.54 32.49 Favored 'General case' 0 CA--C 1.567 1.601 0 N-CA-C 117.301 2.334 . . . . 2.0 117.301 -179.614 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 22.5 t -123.33 -173.18 2.67 Favored 'General case' 0 N--CA 1.485 1.286 0 N-CA-C 113.802 1.038 . . . . 2.0 113.802 179.993 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 47' ' ' LEU . . . . . . . . . . . . 0.35 1.0 OUTLIER -56.7 -15.54 4.75 Favored 'General case' 0 N--CA 1.508 2.463 0 N-CA-C 116.338 1.977 . . . . 2.0 116.338 179.63 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 88.8 mt -101.95 -2.43 29.77 Favored 'General case' 0 CA--C 1.588 2.436 0 C-N-CA 125.986 1.714 . . . . 2.0 111.809 179.138 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 49' ' ' VAL . . . . . . . . . . . . . 11.2 p -154.23 165.37 1.37 Allowed 'Isoleucine or valine' 0 CA--C 1.583 2.236 0 N-CA-C 117.254 2.316 . . . . 2.0 117.254 -179.522 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 61.7 tttp -159.14 93.55 1.15 Allowed 'General case' 0 CA--C 1.573 1.829 1 N-CA-C 99.759 -4.163 . . . . 2.0 99.759 179.394 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 83.8 m-85 -72.41 124.01 24.25 Favored 'General case' 0 CA--C 1.568 1.673 0 N-CA-C 121.363 3.838 . . . . 2.0 121.363 -179.309 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 52' ' ' VAL . . . . . . . . . . . . 0.283 78.9 t -100.01 156.7 4.04 Favored 'Isoleucine or valine' 0 CA--C 1.585 2.307 0 N-CA-C 102.816 -3.031 . . . . 2.0 102.816 179.101 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 53' ' ' CYS . . . . . . . . . . . . 0.324 1.4 p -164.86 160.63 19.63 Favored 'General case' 0 N--CA 1.5 2.04 0 O-C-N 117.33 -3.356 . . . . 2.0 119.329 -179.034 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 54' ' ' CYS . . . . . . . . . . . . 0.395 25.4 p -152.35 119.7 5.95 Favored 'General case' 0 CA--C 1.584 2.258 0 CA-C-O 122.85 1.31 . . . . 2.0 111.866 179.471 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 10.6 m120 -34.01 -9.55 0.0 OUTLIER 'General case' 0 N--CA 1.504 2.234 1 N-CA-C 129.839 6.977 . . . . 2.0 129.839 -179.54 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 56' ' ' THR . . . . . 0.535 ' O ' ' SG ' ' A' ' 21' ' ' CYS . 7.9 t -130.79 161.43 31.77 Favored 'General case' 0 N--CA 1.513 2.687 0 CA-C-N 124.861 3.482 . . . . 2.0 115.727 -179.81 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 57' ' ' ASP . . . . . . . . . . . . . 5.5 m-20 -48.22 120.89 3.86 Favored 'General case' 0 N--CA 1.497 1.902 0 N-CA-C 114.796 1.406 . . . . 2.0 114.796 -179.835 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 58' ' ' ARG . . . . . . . . . . . . 0.281 63.4 mtt180 70.92 9.92 6.87 Favored 'General case' 0 N--CA 1.502 2.141 0 N-CA-C 115.699 1.741 . . . . 2.0 115.699 -179.76 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 59' ' ' CYS . . . . . . . . . . . . . 35.7 t -61.57 -32.22 72.3 Favored 'General case' 0 CA--C 1.574 1.867 0 N-CA-C 115.632 1.716 . . . . 2.0 115.632 179.775 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 60' ' ' ASN . . . . . . . . . . . . . 47.9 p30 . . . . . 0 CA--C 1.567 1.602 0 CA-C-O 124.652 2.168 . . . . 2.0 112.848 179.813 . . . . . . . . 0 0 . 1 . 008 nuclear build core ' A' A ' 1' ' ' LEU . . . . . 0.524 HD13 ' SG ' ' A' ' 3' ' ' CYS . 0.5 OUTLIER . . . . . 0 CA--C 1.582 2.203 0 CA-C-O 122.467 1.127 . . . . 2.0 112.823 . . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 6.3 tmtt? -145.76 108.3 4.46 Favored 'General case' 0 N--CA 1.494 1.766 0 N-CA-C 101.076 -3.675 . . . . 2.0 101.076 179.855 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 3' ' ' CYS . . . . . 0.524 ' SG ' HD13 ' A' ' 1' ' ' LEU . 71.7 m -123.13 174.75 7.04 Favored 'General case' 0 N--CA 1.495 1.781 0 N-CA-C 119.126 3.01 . . . . 2.0 119.126 -179.474 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 18.0 m-20 -102.84 137.62 40.81 Favored 'General case' 0 CA--C 1.56 1.362 0 C-N-CA 124.193 0.997 . . . . 2.0 110.852 179.778 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 22.0 ptmt -84.84 -160.93 0.52 Allowed 'General case' 0 CA--C 1.593 2.631 0 CA-C-N 120.376 1.444 . . . . 2.0 108.113 179.224 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -46.0 -42.75 13.58 Favored 'General case' 0 N--CA 1.509 2.483 0 N-CA-C 119.136 3.013 . . . . 2.0 119.136 -179.996 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 7' ' ' ILE . . . . . . . . . . . . . 42.6 mm -65.88 138.77 96.54 Favored Pre-proline 0 CA--C 1.585 2.295 0 N-CA-C 115.542 1.682 . . . . 2.0 115.542 -179.74 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 80.0 Cg_exo -48.16 -40.55 34.55 Favored 'Trans proline' 0 CA--C 1.569 2.256 0 N-CA-C 121.063 3.447 . . . . 2.0 121.063 179.844 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 9' ' ' ILE . . . . . . . . . . . . . 34.4 mm -106.39 30.25 0.96 Allowed 'Isoleucine or valine' 0 CA--C 1.589 2.473 0 N-CA-C 114.169 1.174 . . . . 2.0 114.169 -179.817 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -74.52 160.63 30.66 Favored 'General case' 0 CA--C 1.574 1.9 0 O-C-N 118.108 -2.87 . . . . 2.0 117.205 -179.91 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 96.4 p -153.41 119.99 5.59 Favored 'General case' 0 N--CA 1.501 2.115 0 O-C-N 120.448 -1.407 . . . . 2.0 112.27 -179.919 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -148.49 138.69 22.5 Favored 'General case' 0 N--CA 1.497 1.888 0 O-C-N 120.801 -1.187 . . . . 2.0 113.41 -179.804 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 13' ' ' THR . . . . . . . . . . . . . 50.9 m -74.2 130.26 39.4 Favored 'General case' 0 N--CA 1.505 2.32 0 O-C-N 120.574 -1.329 . . . . 2.0 110.897 179.829 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 14' ' ' CYS . . . . . 0.465 ' SG ' ' HD2' ' A' ' 15' ' ' PRO 0.256 12.7 t -135.27 162.51 57.02 Favored Pre-proline 0 CA--C 1.594 2.641 0 N-CA-C 113.99 1.108 . . . . 2.0 113.99 -179.625 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 15' ' ' PRO . . . . . 0.465 ' HD2' ' SG ' ' A' ' 14' ' ' CYS . 68.4 Cg_exo -50.49 161.81 1.12 Allowed 'Trans proline' 0 CA--C 1.575 2.551 1 N-CA-C 125.538 5.169 . . . . 2.0 125.538 -179.822 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -84.36 171.83 12.31 Favored 'General case' 0 N--CA 1.498 1.954 0 C-N-CA 124.94 1.296 . . . . 2.0 111.757 179.581 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . 81.76 -46.93 3.56 Favored Glycine 1 N--CA 1.523 4.461 0 O-C-N 119.245 -2.159 . . . . 2.0 108.618 -178.938 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 72.8 mmtt -78.64 85.44 4.68 Favored 'General case' 0 CA--C 1.575 1.934 0 C-N-CA 129.017 2.927 . . . . 2.0 104.446 179.336 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 8.1 p30 -82.96 -23.97 33.19 Favored 'General case' 0 N--CA 1.496 1.832 0 N-CA-C 119.642 3.201 . . . . 2.0 119.642 -179.775 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 61.9 mt -88.66 121.71 31.32 Favored 'General case' 0 CA--C 1.551 0.998 0 C-N-CA 123.96 0.904 . . . . 2.0 113.11 -179.966 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 1.3 m -82.26 97.42 8.27 Favored 'General case' 0 CA--C 1.577 1.999 1 N-CA-C 99.001 -4.444 . . . . 2.0 99.001 179.064 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 22' ' ' TYR . . . . . . . . . . . . 0.263 0.0 OUTLIER -82.69 153.55 25.29 Favored 'General case' 0 N--CA 1.482 1.163 0 N-CA-C 118.795 2.887 . . . . 2.0 118.795 -179.429 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 13.4 ptmt -126.32 96.65 4.77 Favored 'General case' 0 CA--C 1.561 1.381 0 N-CA-C 103.938 -2.616 . . . . 2.0 103.938 179.629 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 24' ' ' MET . . . . . . . . . . . . 0.28 42.0 ttm -65.1 70.98 0.04 OUTLIER 'General case' 0 CA--C 1.57 1.742 0 C-N-CA 126.301 1.84 . . . . 2.0 113.911 -179.856 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 25' ' ' PHE . . . . . . . . . . . . . 4.0 m-30 -58.09 133.65 55.75 Favored 'General case' 0 N--CA 1.493 1.715 0 O-C-N 120.55 -1.344 . . . . 2.0 114.014 179.939 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 26' ' ' MET . . . . . . . . . . . . . 58.1 mtp -66.62 131.61 46.37 Favored 'General case' 0 N--CA 1.492 1.632 0 CA-C-O 118.609 -0.71 . . . . 2.0 111.948 179.941 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 27' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -54.06 -41.21 67.88 Favored 'General case' 0 N--CA 1.513 2.716 0 CA-C-N 120.702 1.592 . . . . 2.0 112.542 179.562 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 50.5 m -77.89 -35.26 50.99 Favored 'General case' 0 CA--C 1.585 2.299 0 N-CA-C 113.892 1.071 . . . . 2.0 113.892 179.475 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 11.8 t70 -141.19 82.17 1.82 Allowed 'General case' 0 CA--C 1.574 1.88 0 O-C-N 120.635 -1.29 . . . . 2.0 109.383 179.871 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 2.3 mm? -47.73 -71.42 0.07 Allowed 'General case' 0 CA--C 1.579 2.078 0 N-CA-C 119.876 3.287 . . . . 2.0 119.876 -179.671 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 31' ' ' THR . . . . . . . . . . . . . 56.2 p -15.18 -64.32 0.01 OUTLIER 'General case' 0 N--CA 1.511 2.587 0 N-CA-C 121.787 3.995 . . . . 2.0 121.787 -179.814 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 32' ' ' ILE . . . . . . . . . . . . . 1.8 mp -94.78 110.98 52.52 Favored Pre-proline 0 CA--C 1.587 2.392 0 N-CA-C 101.948 -3.353 . . . . 2.0 101.948 179.609 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 33' ' ' PRO . . . . . . . . . . . . . 5.2 Cg_exo -67.03 164.33 30.43 Favored 'Trans proline' 0 CA--C 1.557 1.665 0 N-CA-C 122.201 3.885 . . . . 2.0 122.201 -179.557 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 34' ' ' VAL . . . . . . . . . . . . . 58.7 t -70.74 -45.6 72.99 Favored 'Isoleucine or valine' 0 CA--C 1.595 2.679 0 N-CA-C 106.462 -1.681 . . . . 2.0 106.462 178.883 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 5.3 tptm -152.42 167.78 27.61 Favored 'General case' 0 CA--C 1.567 1.623 0 C-N-CA 126.626 1.97 . . . . 2.0 109.797 179.773 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 12.5 mtt180 -144.3 110.26 5.38 Favored 'General case' 0 CA--C 1.574 1.868 0 N-CA-C 104.196 -2.52 . . . . 2.0 104.196 179.495 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . -141.83 -135.53 3.13 Favored Glycine 0 N--CA 1.494 2.5 0 O-C-N 120.699 -1.25 . . . . 2.0 115.116 -179.872 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 38' ' ' CYS . . . . . . . . . . . . . 16.1 p -129.33 136.23 49.75 Favored 'General case' 0 N--CA 1.491 1.614 0 CA-C-N 118.174 0.987 . . . . 2.0 112.45 179.713 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 39' ' ' ILE . . . . . . . . . . . . . 3.3 tp -150.38 162.08 3.82 Favored 'Isoleucine or valine' 0 CA--C 1.577 2.003 0 N-CA-C 113.78 1.03 . . . . 2.0 113.78 -179.866 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 40' ' ' ASP . . . . . . . . . . . . . 8.1 p-10 -79.64 -49.84 11.53 Favored 'General case' 0 N--CA 1.513 2.713 0 O-C-N 119.139 -2.226 . . . . 2.0 114.504 179.753 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 70.3 t -134.47 143.72 37.1 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.415 0 N-CA-C 102.537 -3.135 . . . . 2.0 102.537 179.645 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 42' ' ' CYS . . . . . . . . . . . . 0.258 1.9 m -57.55 104.95 0.46 Allowed Pre-proline 0 CA--C 1.599 2.836 0 N-CA-C 102.032 -3.321 . . . . 2.0 102.032 179.67 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 43' ' ' PRO . . . . . . . . . . . . . 25.2 Cg_exo -50.75 179.87 0.02 OUTLIER 'Trans proline' 0 C--N 1.371 1.757 1 N-CA-C 125.466 5.141 . . . . 2.0 125.466 -178.693 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 29.9 mtpp -69.79 96.31 0.97 Allowed 'General case' 0 CA--C 1.565 1.522 0 N-CA-C 105.506 -2.035 . . . . 2.0 105.506 179.535 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 45' ' ' ASN . . . . . . . . . . . . 0.252 2.1 p-10 -62.62 112.91 2.69 Favored 'General case' 0 CA--C 1.567 1.604 0 N-CA-C 116.763 2.134 . . . . 2.0 116.763 -179.456 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 12.4 t -80.17 -179.8 7.25 Favored 'General case' 0 CA--C 1.567 1.604 0 N-CA-C 114.511 1.301 . . . . 2.0 114.511 179.943 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 47' ' ' LEU . . . . . . . . . . . . . 93.3 mt -49.77 -28.55 6.38 Favored 'General case' 0 N--CA 1.507 2.39 0 N-CA-C 116.708 2.114 . . . . 2.0 116.708 179.822 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 78.6 mt -102.54 12.73 36.01 Favored 'General case' 0 CA--C 1.579 2.082 0 C-N-CA 124.849 1.259 . . . . 2.0 114.06 179.655 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 49' ' ' VAL . . . . . . . . . . . . . 9.4 p -155.85 158.62 3.29 Favored 'Isoleucine or valine' 0 N--CA 1.502 2.168 0 N-CA-C 118.114 2.635 . . . . 2.0 118.114 -179.699 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 59.9 tttp -153.57 75.51 1.05 Allowed 'General case' 0 CA--C 1.581 2.135 0 N-CA-C 103.011 -2.959 . . . . 2.0 103.011 179.296 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 18.2 m-85 -50.38 120.79 4.88 Favored 'General case' 0 CA--C 1.572 1.806 0 N-CA-C 121.58 3.918 . . . . 2.0 121.58 -179.53 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 52' ' ' VAL . . . . . . . . . . . . 0.256 25.2 t -101.76 140.79 19.46 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.958 0 N-CA-C 101.968 -3.345 . . . . 2.0 101.968 179.294 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 53' ' ' CYS . . . . . . . . . . . . 0.425 6.8 p -155.71 158.95 39.08 Favored 'General case' 0 N--CA 1.493 1.702 0 N-CA-C 118.821 2.897 . . . . 2.0 118.821 -178.866 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 54' ' ' CYS . . . . . . . . . . . . 0.408 21.6 p -148.57 127.57 12.75 Favored 'General case' 0 CA--C 1.579 2.087 0 CA-C-O 122.606 1.193 . . . . 2.0 110.971 179.505 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 12.3 m120 -42.65 16.31 0.0 OUTLIER 'General case' 0 N--CA 1.504 2.262 1 N-CA-C 127.338 6.051 . . . . 2.0 127.338 -179.481 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 6.9 t -148.14 177.27 9.53 Favored 'General case' 0 N--CA 1.501 2.104 0 CA-C-N 123.179 2.718 . . . . 2.0 115.012 -179.935 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 57' ' ' ASP . . . . . . . . . . . . . 43.4 m-20 -62.86 124.03 19.99 Favored 'General case' 0 CA--C 1.56 1.362 0 C-N-CA 124.126 0.971 . . . . 2.0 112.792 -180.0 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 58' ' ' ARG . . . . . . . . . . . . . 71.3 mtp180 64.66 18.73 11.55 Favored 'General case' 0 N--CA 1.499 1.981 0 N-CA-C 117.01 2.226 . . . . 2.0 117.01 -179.962 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 59' ' ' CYS . . . . . . . . . . . . . 36.8 t -71.18 -19.56 62.39 Favored 'General case' 0 CA--C 1.579 2.078 0 N-CA-C 117.081 2.252 . . . . 2.0 117.081 179.902 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 60' ' ' ASN . . . . . . . . . . . . . 10.2 p30 . . . . . 0 CA--C 1.567 1.615 0 CA-C-O 125.21 2.433 . . . . 2.0 112.823 179.803 . . . . . . . . 0 0 . 1 . 009 nuclear build core ' A' A ' 1' ' ' LEU . . . . . . . . . . . . 0.301 0.3 OUTLIER . . . . . 0 CA--C 1.571 1.788 0 N-CA-C 114.117 1.154 . . . . 2.0 114.117 . . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 28.2 mttp -70.66 128.74 37.11 Favored 'General case' 0 N--CA 1.494 1.748 0 O-C-N 120.735 -1.228 . . . . 2.0 110.451 179.764 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 71.8 m -137.84 -176.52 4.45 Favored 'General case' 0 CA--C 1.566 1.562 0 CA-C-O 122.619 1.2 . . . . 2.0 113.323 -179.816 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 91.8 m-20 -122.86 97.42 5.44 Favored 'General case' 0 CA--C 1.554 1.102 0 C-N-CA 123.583 0.753 . . . . 2.0 111.739 179.957 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 5' ' ' LYS . . . . . . . . . . . . 0.315 22.4 ptmt -56.15 164.14 1.37 Allowed 'General case' 0 CA--C 1.589 2.476 0 CA-C-N 120.396 1.453 . . . . 2.0 112.475 179.465 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 6' ' ' LEU . . . . . . . . . . . . 0.358 2.4 tm? -30.66 -49.52 0.12 Allowed 'General case' 0 N--CA 1.511 2.625 1 N-CA-C 122.648 4.314 . . . . 2.0 122.648 -179.139 . . . . . . . . 3 2 . 1 . 009 nuclear build core ' A' A ' 7' ' ' ILE . . . . . . . . . . . . . 49.0 mm -55.08 149.16 25.89 Favored Pre-proline 0 CA--C 1.594 2.649 0 N-CA-C 114.425 1.268 . . . . 2.0 114.425 179.889 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 97.3 Cg_exo -47.21 -54.16 5.42 Favored 'Trans proline' 0 CA--C 1.575 2.549 0 C-N-CA 123.059 2.506 . . . . 2.0 118.282 179.881 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 9' ' ' ILE . . . . . . . . . . . . 0.256 10.8 tp -74.65 -48.31 35.05 Favored 'Isoleucine or valine' 0 N--CA 1.507 2.42 0 N-CA-C 114.459 1.281 . . . . 2.0 114.459 179.684 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . 24.52 120.1 0.0 OUTLIER 'General case' 0 CA--C 1.58 2.114 1 N-CA-C 124.202 4.89 . . . . 2.0 124.202 179.739 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 94.1 p -112.18 100.59 8.95 Favored 'General case' 0 CA--C 1.568 1.668 0 N-CA-C 117.116 2.265 . . . . 2.0 117.116 -179.754 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 16.6 tppt? -117.35 127.3 53.92 Favored 'General case' 0 N--CA 1.495 1.805 0 N-CA-C 108.05 -1.092 . . . . 2.0 108.05 179.715 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 13' ' ' THR . . . . . . . . . . . . . 9.8 t -135.99 78.47 1.72 Allowed 'General case' 0 N--CA 1.503 2.185 0 O-C-N 120.782 -1.199 . . . . 2.0 111.398 -179.973 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 14' ' ' CYS . . . . . . . . . . . . 0.272 0.1 OUTLIER -103.88 170.87 5.64 Favored Pre-proline 0 CA--C 1.587 2.398 0 N-CA-C 115.364 1.616 . . . . 2.0 115.364 -179.939 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 15' ' ' PRO . . . . . . . . . . . . . 86.2 Cg_exo -55.72 164.82 4.08 Favored 'Trans proline' 0 N--CA 1.501 1.954 1 N-CA-C 126.197 5.422 . . . . 2.0 126.197 -179.617 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -70.19 175.91 4.24 Favored 'General case' 0 N--CA 1.498 1.946 0 C-N-CA 123.935 0.894 . . . . 2.0 109.437 179.398 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . 83.65 -53.2 4.83 Favored Glycine 1 N--CA 1.518 4.141 0 O-C-N 118.341 -2.724 . . . . 2.0 106.558 -179.101 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 18.3 mmtm -80.3 65.83 5.59 Favored 'General case' 0 CA--C 1.602 2.977 0 N-CA-C 103.113 -2.921 . . . . 2.0 103.113 178.926 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 9.8 p30 -64.67 -38.84 92.38 Favored 'General case' 0 N--CA 1.482 1.156 0 N-CA-C 120.69 3.589 . . . . 2.0 120.69 -179.475 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 89.4 mt -72.36 117.02 13.5 Favored 'General case' 0 CA--C 1.55 0.959 0 N-CA-C 115.704 1.742 . . . . 2.0 115.704 -179.764 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 1.5 m -84.79 91.9 8.1 Favored 'General case' 0 CA--C 1.576 1.978 1 N-CA-C 98.902 -4.481 . . . . 2.0 98.902 179.084 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 22' ' ' TYR . . . . . . . . . . . . 0.321 4.4 p90 -65.56 153.69 40.81 Favored 'General case' 0 N--CA 1.481 1.08 0 N-CA-C 119.674 3.212 . . . . 2.0 119.674 -179.368 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 29.5 ttpt -132.21 96.14 3.82 Favored 'General case' 0 CA--C 1.562 1.422 0 N-CA-C 104.171 -2.529 . . . . 2.0 104.171 179.857 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 24' ' ' MET . . . . . 0.489 ' SD ' ' HB3' ' A' ' 35' ' ' LYS . 15.0 ttt -68.12 86.05 0.25 Allowed 'General case' 0 CA--C 1.567 1.609 0 N-CA-C 114.356 1.243 . . . . 2.0 114.356 -179.722 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 25' ' ' PHE . . . . . . . . . . . . . 3.0 m-30 -81.76 108.51 15.35 Favored 'General case' 0 CA--C 1.569 1.696 0 N-CA-C 105.153 -2.166 . . . . 2.0 105.153 179.649 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 26' ' ' MET . . . . . . . . . . . . . 22.3 ttt -58.11 137.99 56.47 Favored 'General case' 0 N--CA 1.496 1.841 0 O-C-N 120.885 -1.134 . . . . 2.0 113.864 -179.864 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 27' ' ' MET . . . . . . . . . . . . . 2.2 mmt -48.21 -39.69 21.94 Favored 'General case' 0 N--CA 1.508 2.456 0 N-CA-C 115.359 1.614 . . . . 2.0 115.359 179.929 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 59.4 m -80.76 -38.91 27.79 Favored 'General case' 0 CA--C 1.584 2.275 0 C-N-CA 123.611 0.765 . . . . 2.0 112.932 179.538 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 59.0 t0 -132.63 99.44 4.64 Favored 'General case' 0 CA--C 1.572 1.825 0 N-CA-C 106.573 -1.64 . . . . 2.0 106.573 179.733 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 2.4 mm? -76.55 -77.35 0.14 Allowed 'General case' 0 CA--C 1.578 2.046 0 N-CA-C 117.59 2.441 . . . . 2.0 117.59 -179.658 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 31' ' ' THR . . . . . . . . . . . . . 56.5 p -14.24 -69.81 0.01 OUTLIER 'General case' 0 N--CA 1.511 2.58 0 N-CA-C 121.15 3.759 . . . . 2.0 121.15 -179.804 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 32' ' ' ILE . . . . . . . . . . . . . 2.0 mp -89.44 112.47 51.73 Favored Pre-proline 0 CA--C 1.589 2.451 1 N-CA-C 99.562 -4.236 . . . . 2.0 99.562 179.552 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 33' ' ' PRO . . . . . . . . . . . . . 6.0 Cg_exo -66.87 158.19 57.73 Favored 'Trans proline' 0 CA--C 1.554 1.512 0 N-CA-C 119.706 2.925 . . . . 2.0 119.706 -179.41 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 34' ' ' VAL . . . . . . . . . . . . 0.255 13.2 m -85.16 -37.18 12.0 Favored 'Isoleucine or valine' 0 CA--C 1.585 2.315 0 CA-C-O 121.627 0.727 . . . . 2.0 109.82 179.078 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 35' ' ' LYS . . . . . 0.489 ' HB3' ' SD ' ' A' ' 24' ' ' MET . 34.8 ttmt -145.66 163.87 33.53 Favored 'General case' 0 CA--C 1.569 1.706 0 CA-C-O 123.72 1.724 . . . . 2.0 109.293 179.59 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 14.4 mtp180 -145.39 132.22 20.11 Favored 'General case' 0 CA--C 1.576 1.964 0 N-CA-C 102.815 -3.031 . . . . 2.0 102.815 179.585 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . -153.21 -146.35 4.35 Favored Glycine 0 N--CA 1.488 2.162 0 O-C-N 119.797 -1.815 . . . . 2.0 117.61 -179.775 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 38' ' ' CYS . . . . . . . . . . . . . 10.5 p -129.33 132.5 47.12 Favored 'General case' 0 CA--C 1.571 1.765 0 C-N-CA 123.668 0.787 . . . . 2.0 111.481 179.944 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 39' ' ' ILE . . . . . 0.515 HG21 ' HD3' ' A' ' 43' ' ' PRO . 9.9 tp -158.98 172.66 0.39 Allowed 'Isoleucine or valine' 0 N--CA 1.503 2.198 0 O-C-N 120.692 -1.255 . . . . 2.0 113.08 -179.773 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 40' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -95.3 -46.39 6.75 Favored 'General case' 0 N--CA 1.498 1.945 0 O-C-N 119.858 -1.776 . . . . 2.0 114.173 179.724 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 69.0 t -130.87 25.82 1.63 Allowed 'Isoleucine or valine' 0 N--CA 1.512 2.631 0 N-CA-C 114.934 1.457 . . . . 2.0 114.934 -179.584 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 42' ' ' CYS . . . . . . . . . . . . 0.283 2.8 m 81.21 114.07 0.03 OUTLIER Pre-proline 0 N--CA 1.526 3.339 1 N-CA-C 96.337 -5.431 . . . . 2.0 96.337 -179.15 . . . . . . . . 3 2 . 1 . 009 nuclear build core ' A' A ' 43' ' ' PRO . . . . . 0.515 ' HD3' HG21 ' A' ' 39' ' ' ILE 0.472 31.5 Cg_exo -34.46 -96.52 0.0 OUTLIER 'Trans proline' 0 CA--C 1.565 2.027 1 N-CA-C 123.617 4.43 . . . . 2.0 123.617 -178.832 . . . . . . . . 4 3 . 1 . 009 nuclear build core ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 44.7 mttm -159.28 95.86 1.27 Allowed 'General case' 0 CA--C 1.562 1.426 1 N-CA-C 98.706 -4.553 . . . . 2.0 98.706 179.696 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 45' ' ' ASN . . . . . . . . . . . . . 5.2 p-10 -72.91 -168.3 0.46 Allowed 'General case' 0 CA--C 1.572 1.812 0 N-CA-C 117.793 2.516 . . . . 2.0 117.793 -179.594 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 46' ' ' SER . . . . . . . . . . . . 0.349 5.5 t 80.79 -41.6 0.18 Allowed 'General case' 0 N--CA 1.491 1.605 0 N-CA-C 118.236 2.68 . . . . 2.0 118.236 179.907 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 47' ' ' LEU . . . . . . . . . . . . 0.252 2.7 pp -49.36 -51.1 36.83 Favored 'General case' 0 N--CA 1.508 2.473 0 CA-C-N 120.724 1.602 . . . . 2.0 113.07 179.696 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 92.3 mt -155.37 27.44 0.4 Allowed 'General case' 0 CA--C 1.589 2.444 0 C-N-CA 126.688 1.995 . . . . 2.0 108.269 179.428 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 49' ' ' VAL . . . . . 0.4 HG21 ' HG3' ' A' ' 24' ' ' MET . 14.5 p -169.33 168.24 0.27 Allowed 'Isoleucine or valine' 0 CA--C 1.582 2.201 0 N-CA-C 118.932 2.938 . . . . 2.0 118.932 -179.139 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 28.4 ttpt -146.92 74.26 1.34 Allowed 'General case' 0 CA--C 1.581 2.141 0 N-CA-C 102.251 -3.24 . . . . 2.0 102.251 178.977 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 54.3 m-85 -53.04 126.45 20.64 Favored 'General case' 0 CA--C 1.572 1.816 0 N-CA-C 120.187 3.403 . . . . 2.0 120.187 -179.41 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 52' ' ' VAL . . . . . . . . . . . . . 55.9 t -100.43 110.86 28.43 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.853 0 N-CA-C 101.176 -3.639 . . . . 2.0 101.176 179.371 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 53' ' ' CYS . . . . . . . . . . . . 0.312 1.4 p -123.68 136.61 54.57 Favored 'General case' 0 CA--C 1.569 1.709 0 N-CA-C 118.406 2.743 . . . . 2.0 118.406 -179.211 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 54' ' ' CYS . . . . . . . . . . . . 0.307 19.6 p -128.41 124.92 37.48 Favored 'General case' 0 CA--C 1.578 2.026 0 CA-C-O 122.722 1.248 . . . . 2.0 110.533 179.75 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 12.4 p-10 -52.9 32.36 0.0 OUTLIER 'General case' 0 N--CA 1.498 1.964 1 N-CA-C 127.675 6.176 . . . . 2.0 127.675 -179.544 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 56' ' ' THR . . . . . . . . . . . . 0.256 9.4 t -150.24 170.01 20.0 Favored 'General case' 0 N--CA 1.501 2.114 0 O-C-N 119.342 -2.098 . . . . 2.0 114.238 179.95 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 57' ' ' ASP . . . . . . . . . . . . . 39.5 m-20 -62.0 118.96 7.97 Favored 'General case' 0 N--CA 1.488 1.427 0 N-CA-C 113.894 1.072 . . . . 2.0 113.894 -179.925 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 58' ' ' ARG . . . . . . . . . . . . 0.277 21.5 mtt85 65.84 18.69 11.19 Favored 'General case' 0 N--CA 1.498 1.941 0 N-CA-C 117.403 2.372 . . . . 2.0 117.403 -179.881 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 59' ' ' CYS . . . . . . . . . . . . . 48.4 t -63.78 -32.47 73.98 Favored 'General case' 0 CA--C 1.577 1.999 0 N-CA-C 116.567 2.062 . . . . 2.0 116.567 179.899 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 60' ' ' ASN . . . . . . . . . . . . . 19.6 p30 . . . . . 0 CA--C 1.566 1.566 0 CA-C-O 124.993 2.33 . . . . 2.0 114.58 179.859 . . . . . . . . 0 0 . 1 . 010 nuclear build core ' A' A ' 1' ' ' LEU . . . . . 0.455 HD21 ' SG ' ' A' ' 21' ' ' CYS . 6.2 tp . . . . . 0 CA--C 1.572 1.824 0 N-CA-C 114.727 1.381 . . . . 2.0 114.727 . . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 15.8 mtmm -86.77 140.96 29.21 Favored 'General case' 0 CA--C 1.576 1.946 0 O-C-N 120.993 -1.067 . . . . 2.0 108.314 179.549 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 3' ' ' CYS . . . . . 0.429 ' SG ' ' HB2' ' A' ' 38' ' ' CYS . 85.7 m -137.39 174.41 10.63 Favored 'General case' 0 N--CA 1.499 1.988 0 O-C-N 119.339 -2.101 . . . . 2.0 115.251 -179.906 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 60.8 m-20 -123.65 103.41 8.4 Favored 'General case' 0 CA--C 1.574 1.868 0 N-CA-C 119.119 3.007 . . . . 2.0 119.119 -179.839 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 19.2 ptmt -59.23 170.62 0.9 Allowed 'General case' 0 CA--C 1.6 2.875 0 O-C-N 119.67 -1.893 . . . . 2.0 111.934 179.264 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 4.2 mm? -31.37 -49.99 0.16 Allowed 'General case' 0 N--CA 1.511 2.58 1 N-CA-C 122.234 4.161 . . . . 2.0 122.234 -179.758 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 7' ' ' ILE . . . . . . . . . . . . . 20.9 mt -69.57 148.11 96.81 Favored Pre-proline 0 CA--C 1.584 2.258 0 N-CA-C 115.256 1.576 . . . . 2.0 115.256 -179.816 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 82.6 Cg_exo -51.47 -48.3 21.97 Favored 'Trans proline' 0 CA--C 1.574 2.475 0 C-N-CA 123.154 2.57 . . . . 2.0 117.167 179.681 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 9' ' ' ILE . . . . . . . . . . . . 0.283 11.3 tp -61.85 -46.49 96.41 Favored 'Isoleucine or valine' 0 N--CA 1.511 2.593 0 CA-C-N 119.712 1.142 . . . . 2.0 112.444 179.521 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . 54.51 175.77 0.03 OUTLIER 'General case' 0 CA--C 1.579 2.091 1 N-CA-C 126.484 5.735 . . . . 2.0 126.484 179.336 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 8.7 t -68.68 -169.99 0.19 Allowed 'General case' 0 CA--C 1.58 2.099 0 N-CA-C 118.548 2.796 . . . . 2.0 118.548 -179.833 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 12' ' ' LYS . . . . . . . . . . . . 0.297 2.5 tppp? -106.01 -90.66 0.41 Allowed 'General case' 0 CA--C 1.572 1.819 1 N-CA-C 122.967 4.432 . . . . 2.0 122.967 -179.545 . . . . . . . . 3 2 . 1 . 010 nuclear build core ' A' A ' 13' ' ' THR . . . . . . . . . . . . . 7.8 t -154.39 165.15 37.3 Favored 'General case' 0 N--CA 1.51 2.543 1 N-CA-C 121.903 4.038 . . . . 2.0 121.903 -179.116 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -132.62 170.15 12.12 Favored Pre-proline 0 CA--C 1.599 2.854 0 C-N-CA 126.119 1.767 . . . . 2.0 108.717 179.331 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 15' ' ' PRO . . . . . . . . . . . . . 61.0 Cg_exo -59.3 -179.11 0.16 Allowed 'Trans proline' 0 CA--C 1.574 2.488 1 N-CA-C 124.941 4.939 . . . . 2.0 124.941 -179.784 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -78.83 164.12 24.76 Favored 'General case' 0 N--CA 1.5 2.04 0 N-CA-C 106.174 -1.787 . . . . 2.0 106.174 179.278 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . 84.45 -48.58 4.08 Favored Glycine 1 N--CA 1.523 4.437 0 N-CA-C 105.714 -2.954 . . . . 2.0 105.714 -178.769 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 28.4 mmtm -81.69 63.9 6.16 Favored 'General case' 0 CA--C 1.596 2.731 0 N-CA-C 102.052 -3.314 . . . . 2.0 102.052 178.698 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 45.5 p-10 -84.09 -13.59 52.64 Favored 'General case' 0 N--CA 1.487 1.397 0 N-CA-C 121.034 3.716 . . . . 2.0 121.034 -179.451 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 76.8 mt -91.14 113.84 26.21 Favored 'General case' 0 CA--C 1.553 1.087 0 CA-C-N 119.083 0.856 . . . . 2.0 111.166 179.862 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 21' ' ' CYS . . . . . 0.455 ' SG ' HD21 ' A' ' 1' ' ' LEU . 1.8 m -80.32 94.12 6.06 Favored 'General case' 0 CA--C 1.574 1.9 0 N-CA-C 101.303 -3.592 . . . . 2.0 101.303 179.235 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 22' ' ' TYR . . . . . . . . . . . . 0.302 0.0 OUTLIER -72.26 148.13 45.77 Favored 'General case' 0 CA--C 1.551 0.993 0 N-CA-C 121.446 3.869 . . . . 2.0 121.446 -179.313 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 58.5 mttp -111.29 92.2 3.95 Favored 'General case' 0 CA--C 1.561 1.38 1 N-CA-C 99.233 -4.358 . . . . 2.0 99.233 179.249 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 24' ' ' MET . . . . . . . . . . . . . 27.9 ttt -72.24 67.99 0.72 Allowed 'General case' 0 CA--C 1.573 1.852 0 O-C-N 120.811 -1.181 . . . . 2.0 111.55 -179.873 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 25' ' ' PHE . . . . . . . . . . . . . 10.8 m-30 -57.64 131.19 49.48 Favored 'General case' 0 N--CA 1.486 1.362 0 N-CA-C 114.804 1.409 . . . . 2.0 114.804 -179.861 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 26' ' ' MET . . . . . . . . . . . . . 42.3 mtt -65.58 130.81 44.61 Favored 'General case' 0 N--CA 1.493 1.698 0 CA-C-O 118.536 -0.745 . . . . 2.0 110.74 179.778 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 27' ' ' MET . . . . . . . . . . . . . 8.6 tmm? -56.47 -35.24 67.72 Favored 'General case' 0 N--CA 1.51 2.543 0 CA-C-N 121.106 1.775 . . . . 2.0 112.131 179.561 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 49.2 m -76.32 -36.49 58.26 Favored 'General case' 0 CA--C 1.586 2.364 0 C-N-CA 124.276 1.031 . . . . 2.0 113.14 179.315 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 10.3 t0 -144.21 84.2 1.76 Allowed 'General case' 0 CA--C 1.577 1.992 0 O-C-N 120.692 -1.255 . . . . 2.0 107.766 179.794 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 1.9 mm? -48.46 -74.63 0.03 OUTLIER 'General case' 0 CA--C 1.574 1.887 0 N-CA-C 121.002 3.704 . . . . 2.0 121.002 -179.482 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 31' ' ' THR . . . . . . . . . . . . 0.283 12.2 t -18.41 -60.2 0.02 OUTLIER 'General case' 0 N--CA 1.508 2.44 0 N-CA-C 121.366 3.839 . . . . 2.0 121.366 -179.942 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 32' ' ' ILE . . . . . . . . . . . . . 1.8 mp -95.9 103.76 14.34 Favored Pre-proline 0 CA--C 1.59 2.491 0 N-CA-C 101.414 -3.551 . . . . 2.0 101.414 179.641 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 33' ' ' PRO . . . . . . . . . . . . . 55.6 Cg_endo -65.69 170.3 11.49 Favored 'Trans proline' 0 CA--C 1.56 1.791 1 N-CA-C 123.571 4.412 . . . . 2.0 123.571 -179.521 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 34' ' ' VAL . . . . . . . . . . . . . 54.9 t -73.04 -50.64 30.75 Favored 'Isoleucine or valine' 0 CA--C 1.594 2.642 0 N-CA-C 105.303 -2.11 . . . . 2.0 105.303 178.889 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 2.0 tptm -141.5 157.68 44.82 Favored 'General case' 0 CA--C 1.562 1.43 0 C-N-CA 126.618 1.967 . . . . 2.0 109.007 179.654 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 36' ' ' ARG . . . . . . . . . . . . 0.333 45.2 ttp180 -132.61 67.54 1.53 Allowed 'General case' 0 N--CA 1.498 1.937 0 N-CA-C 104.069 -2.567 . . . . 2.0 104.069 179.484 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . -94.23 -142.75 12.66 Favored Glycine 0 CA--C 1.545 1.924 1 N-CA-C 124.788 4.675 . . . . 2.0 124.788 -179.439 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 38' ' ' CYS . . . . . 0.429 ' HB2' ' SG ' ' A' ' 3' ' ' CYS 0.275 40.3 t -129.86 131.65 46.17 Favored 'General case' 0 CA--C 1.567 1.6 0 C-N-CA 125.23 1.412 . . . . 2.0 113.588 -179.575 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 39' ' ' ILE . . . . . . . . . . . . . 4.4 tp -153.75 172.95 0.68 Allowed 'Isoleucine or valine' 0 N--CA 1.504 2.23 0 N-CA-C 115.079 1.511 . . . . 2.0 115.079 -179.72 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 40' ' ' ASP . . . . . . . . . . . . . 10.1 p-10 -84.67 -54.98 4.35 Favored 'General case' 0 N--CA 1.513 2.677 0 O-C-N 119.315 -2.116 . . . . 2.0 113.683 179.694 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 73.5 t -128.34 148.39 32.83 Favored 'Isoleucine or valine' 0 CA--C 1.564 1.51 0 N-CA-C 103.16 -2.904 . . . . 2.0 103.16 179.522 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 42' ' ' CYS . . . . . . . . . . . . . 1.0 OUTLIER -61.42 105.22 0.56 Allowed Pre-proline 0 CA--C 1.603 2.988 1 N-CA-C 99.936 -4.098 . . . . 2.0 99.936 179.456 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 43' ' ' PRO . . . . . . . . . . . . 0.257 25.9 Cg_exo -49.6 175.93 0.03 OUTLIER 'Trans proline' 0 C--N 1.372 1.77 1 N-CA-C 125.23 5.05 . . . . 2.0 125.23 -178.555 . . . . . . . . 3 2 . 1 . 010 nuclear build core ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 97.3 mttt -72.72 92.5 1.56 Allowed 'General case' 0 CA--C 1.569 1.684 0 N-CA-C 106.388 -1.708 . . . . 2.0 106.388 179.579 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 45' ' ' ASN . . . . . . . . . . . . . 2.6 p-10 -65.53 156.89 31.19 Favored 'General case' 0 CA--C 1.565 1.531 0 N-CA-C 116.429 2.011 . . . . 2.0 116.429 -179.607 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 11.3 t -132.44 -170.45 2.43 Favored 'General case' 0 N--CA 1.487 1.394 0 N-CA-C 113.614 0.968 . . . . 2.0 113.614 179.896 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 47' ' ' LEU . . . . . . . . . . . . 0.285 3.9 pp -58.41 -10.99 2.41 Favored 'General case' 0 N--CA 1.507 2.388 0 N-CA-C 117.125 2.268 . . . . 2.0 117.125 179.836 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 85.3 mt -104.57 -7.64 19.57 Favored 'General case' 0 CA--C 1.584 2.253 0 C-N-CA 126.281 1.833 . . . . 2.0 112.418 179.437 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 49' ' ' VAL . . . . . . . . . . . . . 8.1 p -156.17 164.33 1.27 Allowed 'Isoleucine or valine' 0 CA--C 1.579 2.085 0 N-CA-C 116.906 2.187 . . . . 2.0 116.906 -179.615 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 58.0 tttp -159.04 76.09 0.7 Allowed 'General case' 0 CA--C 1.577 2.015 0 N-CA-C 104.585 -2.376 . . . . 2.0 104.585 179.32 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 33.4 m-85 -51.76 126.04 16.73 Favored 'General case' 0 CA--C 1.571 1.755 1 N-CA-C 123.162 4.504 . . . . 2.0 123.162 -179.509 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 52' ' ' VAL . . . . . . . . . . . . 0.294 14.7 t -104.86 154.58 6.36 Favored 'Isoleucine or valine' 0 CA--C 1.581 2.143 0 N-CA-C 102.642 -3.095 . . . . 2.0 102.642 179.016 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 53' ' ' CYS . . . . . . . . . . . . . 1.3 p -153.0 159.94 42.96 Favored 'General case' 0 N--CA 1.496 1.857 0 O-C-N 117.851 -3.031 . . . . 2.0 118.277 -179.16 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 54' ' ' CYS . . . . . . . . . . . . . 27.6 p -145.23 120.66 10.32 Favored 'General case' 0 CA--C 1.574 1.879 0 C-N-CA 123.801 0.84 . . . . 2.0 110.358 179.784 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 16.0 m120 -55.18 12.26 0.0 OUTLIER 'General case' 0 N--CA 1.508 2.46 1 N-CA-C 124.719 5.081 . . . . 2.0 124.719 -179.618 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 56' ' ' THR . . . . . . . . . . . . 0.253 5.5 t -137.88 176.93 8.27 Favored 'General case' 0 N--CA 1.505 2.29 0 CA-C-N 123.078 2.672 . . . . 2.0 116.071 -179.91 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 57' ' ' ASP . . . . . . . . . . . . . 72.1 m-20 -63.68 121.11 13.16 Favored 'General case' 0 CA--C 1.567 1.633 0 N-CA-C 115.528 1.677 . . . . 2.0 115.528 -179.788 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 58' ' ' ARG . . . . . . . . . . . . 0.29 23.4 mtt180 59.65 14.76 4.21 Favored 'General case' 0 N--CA 1.503 2.203 0 N-CA-C 117.959 2.577 . . . . 2.0 117.959 -179.901 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 59' ' ' CYS . . . . . . . . . . . . . 29.3 p -68.0 -14.22 62.8 Favored 'General case' 0 N--CA 1.496 1.864 0 N-CA-C 118.349 2.722 . . . . 2.0 118.349 179.947 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 60' ' ' ASN . . . . . . . . . . . . . 32.5 p-10 . . . . . 0 CA--C 1.56 1.346 0 CA-C-O 125.216 2.436 . . . . 2.0 111.598 179.848 . . . . . . . . 0 0 . 1 . 011 nuclear build core ' A' A ' 1' ' ' LEU . . . . . 0.63 HD13 ' SG ' ' A' ' 3' ' ' CYS . 0.4 OUTLIER . . . . . 0 CA--C 1.576 1.953 0 CA-C-O 122.51 1.148 . . . . 2.0 111.639 . . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 2.7 mppt? -145.0 97.74 3.06 Favored 'General case' 0 N--CA 1.486 1.371 0 N-CA-C 101.855 -3.387 . . . . 2.0 101.855 179.533 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 3' ' ' CYS . . . . . 0.63 ' SG ' HD13 ' A' ' 1' ' ' LEU . 72.6 m -105.48 -166.48 1.22 Allowed 'General case' 0 N--CA 1.49 1.562 0 N-CA-C 115.416 1.636 . . . . 2.0 115.416 -179.691 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 78.3 m-20 -126.68 121.42 32.05 Favored 'General case' 0 CA--C 1.559 1.3 0 CA-C-O 116.751 -1.595 . . . . 2.0 108.951 179.778 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 5' ' ' LYS . . . . . 0.414 ' HG2' ' H ' ' A' ' 11' ' ' SER . 0.0 OUTLIER -71.61 178.64 3.44 Favored 'General case' 0 CA--C 1.588 2.427 0 CA-C-N 123.579 2.9 . . . . 2.0 110.756 179.452 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 68.1 tp -58.41 -54.14 50.38 Favored 'General case' 0 N--CA 1.506 2.344 0 O-C-N 118.944 -2.347 . . . . 2.0 116.614 -179.768 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 7' ' ' ILE . . . . . . . . . . . . . 53.9 mt -52.21 141.71 30.31 Favored Pre-proline 0 CA--C 1.586 2.357 0 CA-C-O 117.175 -1.393 . . . . 2.0 114.515 -179.838 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 63.1 Cg_exo -39.03 -47.26 2.9 Favored 'Trans proline' 0 C--N 1.378 2.094 0 N-CA-C 120.271 3.143 . . . . 2.0 120.271 179.901 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 9' ' ' ILE . . . . . . . . . . . . . 11.3 tp -60.74 -39.55 82.08 Favored 'Isoleucine or valine' 0 N--CA 1.507 2.402 0 N-CA-C 113.932 1.086 . . . . 2.0 113.932 179.617 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . 48.55 111.34 0.0 OUTLIER 'General case' 0 CA--C 1.579 2.06 1 N-CA-C 123.97 4.804 . . . . 2.0 123.97 179.384 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 11' ' ' SER . . . . . 0.414 ' H ' ' HG2' ' A' ' 5' ' ' LYS . 98.2 p -58.05 153.45 14.57 Favored 'General case' 0 N--CA 1.501 2.082 0 C-N-CA 124.605 1.162 . . . . 2.0 114.117 179.689 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 12' ' ' LYS . . . . . . . . . . . . 0.279 81.4 tttt -90.93 -93.32 0.13 Allowed 'General case' 0 CA--C 1.581 2.165 0 N-CA-C 121.493 3.886 . . . . 2.0 121.493 -179.544 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 13' ' ' THR . . . . . . . . . . . . . 33.4 m -41.91 136.81 1.95 Allowed 'General case' 0 N--CA 1.498 1.974 0 N-CA-C 120.47 3.507 . . . . 2.0 120.47 -179.567 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 4.1 t -153.19 153.75 29.92 Favored Pre-proline 0 CA--C 1.601 2.934 0 C-N-CA 124.793 1.237 . . . . 2.0 111.226 -179.959 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 15' ' ' PRO . . . . . . . . . . . . . 65.7 Cg_exo -45.27 160.36 0.14 Allowed 'Trans proline' 0 CA--C 1.579 2.741 1 N-CA-C 126.083 5.378 . . . . 2.0 126.083 -179.819 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -82.27 168.22 17.82 Favored 'General case' 0 N--CA 1.5 2.064 0 C-N-CA 125.177 1.391 . . . . 2.0 112.944 179.731 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . 82.96 -49.65 4.26 Favored Glycine 1 N--CA 1.522 4.374 0 N-CA-C 108.162 -1.975 . . . . 2.0 108.162 -179.01 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 30.1 mmtm -72.41 94.8 1.68 Allowed 'General case' 0 CA--C 1.575 1.915 0 C-N-CA 129.32 3.048 . . . . 2.0 105.898 179.354 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 10.2 p30 -94.11 -25.03 17.33 Favored 'General case' 0 N--CA 1.498 1.932 0 N-CA-C 117.212 2.301 . . . . 2.0 117.212 179.913 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 70.2 mt -84.05 111.22 19.11 Favored 'General case' 0 CA--C 1.558 1.28 0 C-N-CA 125.596 1.558 . . . . 2.0 113.617 179.968 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 21' ' ' CYS . . . . . 0.428 ' SG ' HD22 ' A' ' 1' ' ' LEU . 2.0 m -81.25 101.31 9.64 Favored 'General case' 0 CA--C 1.578 2.026 1 N-CA-C 99.621 -4.214 . . . . 2.0 99.621 179.158 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 22' ' ' TYR . . . . . . . . . . . . . 5.8 p90 -83.66 164.26 19.78 Favored 'General case' 0 N--CA 1.48 1.074 0 N-CA-C 120.843 3.646 . . . . 2.0 120.843 -179.31 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 23' ' ' LYS . . . . . . . . . . . . 0.303 10.6 ptpp? -137.66 101.87 4.59 Favored 'General case' 0 CA--C 1.566 1.577 0 N-CA-C 104.389 -2.448 . . . . 2.0 104.389 179.306 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 24' ' ' MET . . . . . . . . . . . . . 4.7 ttt -65.41 92.8 0.13 Allowed 'General case' 0 CA--C 1.563 1.442 0 C-N-CA 125.149 1.38 . . . . 2.0 114.07 -179.803 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 25' ' ' PHE . . . . . . . . . . . . . 5.3 m-30 -81.61 104.14 11.82 Favored 'General case' 0 CA--C 1.568 1.636 0 N-CA-C 103.853 -2.647 . . . . 2.0 103.853 179.491 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 26' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -57.09 127.72 33.37 Favored 'General case' 0 N--CA 1.494 1.753 0 O-C-N 120.797 -1.189 . . . . 2.0 112.279 -179.809 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 27' ' ' MET . . . . . . . . . . . . . 0.1 OUTLIER -48.82 -32.74 9.24 Favored 'General case' 0 N--CA 1.509 2.496 0 N-CA-C 116.613 2.079 . . . . 2.0 116.613 -179.944 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 50.5 m -75.03 -30.61 61.13 Favored 'General case' 0 CA--C 1.592 2.594 0 O-C-N 121.512 -0.743 . . . . 2.0 112.238 179.162 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 56.5 t0 -151.04 92.2 1.79 Allowed 'General case' 0 CA--C 1.571 1.769 0 N-CA-C 105.083 -2.191 . . . . 2.0 105.083 179.687 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 3.2 mm? -65.56 -66.7 0.51 Allowed 'General case' 0 CA--C 1.571 1.769 0 N-CA-C 118.837 2.903 . . . . 2.0 118.837 -179.526 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 31' ' ' THR . . . . . . . . . . . . . 72.1 p -33.83 -48.44 0.29 Allowed 'General case' 0 N--CA 1.506 2.355 0 N-CA-C 120.457 3.503 . . . . 2.0 120.457 -179.704 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 32' ' ' ILE . . . . . . . . . . . . . 2.1 mp -93.96 107.27 26.88 Favored Pre-proline 0 CA--C 1.586 2.356 0 N-CA-C 101.606 -3.479 . . . . 2.0 101.606 179.554 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 33' ' ' PRO . . . . . . . . . . . . . 12.6 Cg_exo -68.79 149.08 72.55 Favored 'Trans proline' 0 CA--C 1.561 1.842 0 N-CA-C 118.383 2.417 . . . . 2.0 118.383 -179.602 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 34' ' ' VAL . . . . . . . . . . . . 0.283 24.5 t -86.75 -29.77 5.88 Favored 'Isoleucine or valine' 0 CA--C 1.583 2.249 0 C-N-CA 123.579 0.751 . . . . 2.0 111.543 179.421 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER -144.81 167.02 23.58 Favored 'General case' 0 CA--C 1.559 1.317 0 CA-C-O 123.602 1.668 . . . . 2.0 110.067 179.453 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 6.6 mtp180 -150.69 108.89 3.75 Favored 'General case' 0 CA--C 1.571 1.773 0 N-CA-C 104.814 -2.291 . . . . 2.0 104.814 -179.867 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . -140.97 -144.58 4.46 Favored Glycine 0 N--CA 1.498 2.824 0 N-CA-C 118.393 2.117 . . . . 2.0 118.393 -179.697 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 38' ' ' CYS . . . . . . . . . . . . . 20.8 p -130.93 131.99 44.81 Favored 'General case' 0 N--CA 1.494 1.738 0 N-CA-C 113.653 0.983 . . . . 2.0 113.653 179.99 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 39' ' ' ILE . . . . . 0.488 HG21 ' HD3' ' A' ' 43' ' ' PRO . 9.6 tp -152.85 175.83 0.58 Allowed 'Isoleucine or valine' 0 N--CA 1.498 1.969 0 C-N-CA 124.182 0.993 . . . . 2.0 112.751 -179.839 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 40' ' ' ASP . . . . . 0.428 ' H ' HG13 ' A' ' 39' ' ' ILE . 13.3 p-10 -108.02 -28.88 9.3 Favored 'General case' 0 N--CA 1.497 1.908 0 O-C-N 119.527 -1.983 . . . . 2.0 113.53 179.354 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 8.0 t -140.35 27.54 0.48 Allowed 'Isoleucine or valine' 0 N--CA 1.506 2.334 0 CA-C-N 120.134 1.334 . . . . 2.0 112.649 179.952 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 42' ' ' CYS . . . . . . . . . . . . 0.359 2.8 m 77.11 115.75 0.03 OUTLIER Pre-proline 0 CA--C 1.615 3.469 1 N-CA-C 97.03 -5.174 . . . . 2.0 97.03 -179.221 . . . . . . . . 3 2 . 1 . 011 nuclear build core ' A' A ' 43' ' ' PRO . . . . . 0.488 ' HD3' HG21 ' A' ' 39' ' ' ILE 0.45 80.0 Cg_exo -30.06 -60.06 0.13 Allowed 'Trans proline' 0 C--N 1.371 1.745 1 N-CA-C 127.799 6.038 . . . . 2.0 127.799 -178.484 . . . . . . . . 4 3 . 1 . 011 nuclear build core ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 9.1 mtmm 160.78 91.14 0.0 OUTLIER 'General case' 0 CA--C 1.561 1.373 1 N-CA-C 98.512 -4.625 . . . . 2.0 98.512 -179.879 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 45' ' ' ASN . . . . . . . . . . . . . 4.6 p-10 -66.02 113.76 4.68 Favored 'General case' 0 CA--C 1.572 1.798 0 N-CA-C 114.759 1.392 . . . . 2.0 114.759 -179.713 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 10.8 t -113.02 -169.96 1.58 Allowed 'General case' 0 N--CA 1.492 1.669 0 N-CA-C 114.09 1.145 . . . . 2.0 114.09 -179.947 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 47' ' ' LEU . . . . . . . . . . . . . 6.7 mp -54.77 -16.33 2.5 Favored 'General case' 0 N--CA 1.509 2.492 0 N-CA-C 116.984 2.216 . . . . 2.0 116.984 179.803 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 74.6 mt -103.98 -3.49 24.59 Favored 'General case' 0 CA--C 1.578 2.046 0 C-N-CA 125.577 1.551 . . . . 2.0 112.366 179.456 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 49' ' ' VAL . . . . . . . . . . . . . 7.2 p -166.91 150.78 1.56 Allowed 'Isoleucine or valine' 0 N--CA 1.5 2.071 0 N-CA-C 118.114 2.635 . . . . 2.0 118.114 -179.645 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 55.7 tttp -134.1 111.06 10.03 Favored 'General case' 0 CA--C 1.571 1.781 1 N-CA-C 98.259 -4.719 . . . . 2.0 98.259 179.391 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 86.8 m-85 -92.3 122.31 34.65 Favored 'General case' 0 N--CA 1.497 1.917 0 N-CA-C 118.573 2.805 . . . . 2.0 118.573 -179.353 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 52' ' ' VAL . . . . . . . . . . . . . 53.3 t -92.6 106.25 17.64 Favored 'Isoleucine or valine' 0 N--CA 1.503 2.208 0 N-CA-C 102.982 -2.97 . . . . 2.0 102.982 179.522 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 53' ' ' CYS . . . . . . . . . . . . 0.261 0.7 OUTLIER -108.16 139.32 43.01 Favored 'General case' 0 CA--C 1.575 1.923 0 N-CA-C 118.988 2.958 . . . . 2.0 118.988 -179.323 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 54' ' ' CYS . . . . . . . . . . . . . 30.0 p -127.71 118.83 24.54 Favored 'General case' 0 CA--C 1.575 1.922 0 C-N-CA 124.035 0.934 . . . . 2.0 110.834 179.821 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 4.8 p-10 -57.11 37.61 0.0 OUTLIER 'General case' 0 N--CA 1.508 2.463 1 N-CA-C 124.981 5.178 . . . . 2.0 124.981 -179.584 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 6.3 t -158.55 174.33 15.24 Favored 'General case' 0 N--CA 1.503 2.21 0 O-C-N 119.326 -2.109 . . . . 2.0 114.168 179.939 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 57' ' ' ASP . . . . . . . . . . . . . 69.4 m-20 -66.94 129.56 40.28 Favored 'General case' 0 CA--C 1.571 1.782 0 O-C-N 120.325 -1.485 . . . . 2.0 114.82 179.932 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 58' ' ' ARG . . . . . . . . . . . . 0.332 40.1 mtp85 52.19 24.71 2.91 Favored 'General case' 0 N--CA 1.499 2.008 0 N-CA-C 118.726 2.862 . . . . 2.0 118.726 179.917 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 59' ' ' CYS . . . . . . . . . . . . . 29.2 p -77.37 -19.89 55.57 Favored 'General case' 0 CA--C 1.579 2.06 0 O-C-N 120.668 -1.27 . . . . 2.0 114.352 179.608 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 60' ' ' ASN . . . . . . . . . . . . . 34.9 p-10 . . . . . 0 CA--C 1.563 1.473 0 CA-C-O 124.392 2.044 . . . . 2.0 113.525 179.881 . . . . . . . . 0 0 . 1 . 001 nuclear build full ' A' A ' 1' ' ' LEU . . . . . 0.466 ' C ' ' H ' ' A' ' 14' ' ' CYS . 3.4 tm? . . . . . 0 N--CA 1.495 1.782 0 CA-C-O 117.023 -1.465 . . . . 2.0 111.804 . . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 54.7 tptt -119.84 -55.31 2.1 Favored 'General case' 0 N--CA 1.514 2.757 0 CA-C-N 121.886 2.13 . . . . 2.0 109.181 179.656 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 3' ' ' CYS . . . . . . . . . . . . 0.312 1.9 m 76.6 -172.87 0.09 Allowed 'General case' 0 CA--C 1.563 1.471 0 N-CA-C 114.38 1.252 . . . . 2.0 114.38 -179.9 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 79.5 m-20 -91.05 152.48 20.63 Favored 'General case' 0 CA--C 1.55 0.955 0 N-CA-C 115.312 1.597 . . . . 2.0 115.312 -179.803 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 18.3 ptpt -90.84 -156.91 0.46 Allowed 'General case' 0 CA--C 1.579 2.087 0 N-CA-C 104.913 -2.254 . . . . 2.0 104.913 179.103 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 3.8 mm? -54.9 -34.0 62.6 Favored 'General case' 0 N--CA 1.512 2.637 0 O-C-N 117.679 -3.138 . . . . 2.0 115.154 179.665 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 7' ' ' ILE . . . . . . . . . . . . . 35.1 mt -75.74 141.43 72.21 Favored Pre-proline 0 CA--C 1.586 2.329 0 C-N-CA 125.312 1.445 . . . . 2.0 112.426 179.871 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 77.4 Cg_exo -55.94 -40.13 86.92 Favored 'Trans proline' 0 CA--C 1.57 2.321 0 C-N-CA 122.836 2.357 . . . . 2.0 117.964 179.596 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 9' ' ' ILE . . . . . . . . . . . . . 10.7 tp -97.75 93.04 3.13 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.726 0 C-N-CA 124.144 0.977 . . . . 2.0 111.083 179.969 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . 0.466 . . -133.71 -166.97 1.86 Allowed 'General case' 0 CA--C 1.583 2.223 0 N-CA-C 114.828 1.418 . . . . 2.0 114.828 179.991 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 11' ' ' SER . . . . . . . . . . . . 0.368 2.0 t -43.66 165.69 0.01 OUTLIER 'General case' 0 CA--C 1.586 2.34 1 N-CA-C 127.027 5.936 . . . . 2.0 127.027 -179.351 . . . . . . . . 3 2 . 1 . 001 nuclear build full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 1.6 ttmp? -105.99 -74.96 0.64 Allowed 'General case' 0 CA--C 1.577 2.008 0 N-CA-C 121.475 3.88 . . . . 2.0 121.475 -179.545 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 13' ' ' THR . . . . . . . . . . . . . 14.9 t -135.22 124.32 24.37 Favored 'General case' 0 N--CA 1.506 2.33 0 N-CA-C 121.741 3.978 . . . . 2.0 121.741 -179.374 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 14' ' ' CYS . . . . . 0.554 ' SG ' ' HD2' ' A' ' 18' ' ' LYS . 0.5 OUTLIER -106.5 171.94 4.33 Favored Pre-proline 0 CA--C 1.599 2.863 0 C-N-CA 126.613 1.965 . . . . 2.0 108.938 179.493 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 15' ' ' PRO . . . . . . . . . . . . . 83.5 Cg_exo -49.04 174.63 0.03 OUTLIER 'Trans proline' 0 CA--C 1.57 2.288 1 N-CA-C 124.474 4.759 . . . . 2.0 124.474 -179.722 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . 32.82 -172.87 0.0 OUTLIER 'General case' 0 N--CA 1.5 2.065 1 N-CA-C 123.558 4.651 . . . . 2.0 123.558 179.734 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . -82.59 38.71 2.65 Favored Glycine 0 N--CA 1.502 3.092 0 O-C-N 120.296 -1.503 . . . . 2.0 113.861 179.459 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 18' ' ' LYS . . . . . 0.554 ' HD2' ' SG ' ' A' ' 14' ' ' CYS . 0.1 OUTLIER -82.91 74.63 9.85 Favored 'General case' 0 CA--C 1.566 1.573 0 C-N-CA 125.546 1.538 . . . . 2.0 109.059 179.902 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 7.8 p30 -57.18 -36.65 71.06 Favored 'General case' 0 N--CA 1.487 1.403 1 N-CA-C 122.821 4.378 . . . . 2.0 122.821 -179.626 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 88.2 mt -70.18 122.96 20.48 Favored 'General case' 0 CA--C 1.558 1.251 0 N-CA-C 117.209 2.3 . . . . 2.0 117.209 -179.801 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 21' ' ' CYS . . . . . 0.562 ' SG ' ' O ' ' A' ' 56' ' ' THR . 32.1 m -82.91 95.34 7.94 Favored 'General case' 0 CA--C 1.566 1.565 0 N-CA-C 102.516 -3.142 . . . . 2.0 102.516 179.314 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 22' ' ' TYR . . . . . . . . . . . . 0.442 0.0 OUTLIER -61.57 153.17 28.44 Favored 'General case' 0 CA--C 1.554 1.12 0 N-CA-C 118.018 2.599 . . . . 2.0 118.018 -179.478 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 39.2 ttmt -133.98 76.67 1.67 Allowed 'General case' 0 CA--C 1.563 1.442 0 N-CA-C 103.373 -2.825 . . . . 2.0 103.373 179.584 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 24' ' ' MET . . . . . . . . . . . . 0.262 5.9 ttt -63.17 78.67 0.02 OUTLIER 'General case' 0 CA--C 1.567 1.609 0 C-N-CA 126.037 1.735 . . . . 2.0 113.968 -179.838 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 25' ' ' PHE . . . . . . . . . . . . . 13.9 m-85 -72.35 147.37 46.35 Favored 'General case' 0 N--CA 1.485 1.318 0 N-CA-C 113.784 1.031 . . . . 2.0 113.784 179.976 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 26' ' ' MET . . . . . . . . . . . . . 73.4 mtp -72.04 127.16 31.68 Favored 'General case' 0 N--CA 1.493 1.696 0 O-C-N 121.307 -0.871 . . . . 2.0 108.85 179.51 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 27' ' ' MET . . . . . . . . . . . . . 27.9 ttt -55.76 -36.45 67.32 Favored 'General case' 0 N--CA 1.513 2.708 0 CA-C-N 121.621 2.01 . . . . 2.0 111.717 179.365 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 73.2 m -76.85 -29.6 55.93 Favored 'General case' 0 CA--C 1.585 2.308 0 N-CA-C 114.163 1.172 . . . . 2.0 114.163 179.324 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 8.9 t70 -150.76 81.12 1.34 Allowed 'General case' 0 CA--C 1.57 1.748 0 O-C-N 120.174 -1.579 . . . . 2.0 108.558 179.695 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 1.8 mm? -45.79 -75.98 0.03 OUTLIER 'General case' 0 CA--C 1.575 1.927 0 N-CA-C 120.688 3.588 . . . . 2.0 120.688 -179.507 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 31' ' ' THR . . . . . . . . . . . . 0.259 43.4 p -6.71 -66.87 0.0 OUTLIER 'General case' 0 N--CA 1.506 2.341 1 N-CA-C 122.511 4.263 . . . . 2.0 122.511 -179.735 . . . . . . . . 3 2 . 1 . 001 nuclear build full ' A' A ' 32' ' ' ILE . . . . . . . . . . . . . 2.0 mp -99.04 106.89 40.96 Favored Pre-proline 0 CA--C 1.584 2.265 0 N-CA-C 102.173 -3.269 . . . . 2.0 102.173 179.726 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 33' ' ' PRO . . . . . . . . . . . . . 21.5 Cg_exo -59.39 166.02 8.34 Favored 'Trans proline' 0 CA--C 1.559 1.753 1 N-CA-C 123.744 4.478 . . . . 2.0 123.744 -179.658 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 34' ' ' VAL . . . . . . . . . . . . . 78.7 t -76.14 -51.67 19.47 Favored 'Isoleucine or valine' 0 CA--C 1.592 2.57 0 N-CA-C 103.125 -2.917 . . . . 2.0 103.125 178.637 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 59.9 mttm -143.43 167.52 21.99 Favored 'General case' 0 CA--C 1.564 1.494 0 CA-C-O 125.574 2.606 . . . . 2.0 108.652 179.451 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 9.1 mtp180 -142.88 119.56 11.13 Favored 'General case' 0 CA--C 1.582 2.191 1 N-CA-C 98.184 -4.747 . . . . 2.0 98.184 179.7 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . -157.8 -134.84 1.8 Allowed Glycine 0 N--CA 1.488 2.107 0 O-C-N 118.942 -2.349 . . . . 2.0 118.891 -179.44 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 38' ' ' CYS . . . . . . . . . . . . . 26.9 p -123.23 138.92 54.52 Favored 'General case' 0 N--CA 1.489 1.51 0 N-CA-C 117.421 2.378 . . . . 2.0 117.421 -179.821 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 39' ' ' ILE . . . . . 0.443 HG12 ' CG ' ' A' ' 43' ' ' PRO . 2.2 tp -164.65 159.01 1.29 Allowed 'Isoleucine or valine' 0 CA--C 1.576 1.959 0 N-CA-C 115.312 1.597 . . . . 2.0 115.312 -179.909 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 40' ' ' ASP . . . . . . . . . . . . . 9.3 p-10 -78.69 -48.14 15.58 Favored 'General case' 0 N--CA 1.506 2.363 0 O-C-N 119.751 -1.843 . . . . 2.0 114.313 179.595 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 91.2 t -135.83 144.02 34.7 Favored 'Isoleucine or valine' 0 CA--C 1.56 1.346 0 N-CA-C 102.972 -2.973 . . . . 2.0 102.972 179.703 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 42' ' ' CYS . . . . . . . . . . . . . 0.8 OUTLIER -58.37 105.49 0.55 Allowed Pre-proline 0 CA--C 1.603 3.01 0 N-CA-C 101.401 -3.555 . . . . 2.0 101.401 179.578 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 43' ' ' PRO . . . . . 0.443 ' CG ' HG12 ' A' ' 39' ' ' ILE . 24.7 Cg_exo -50.18 177.92 0.03 OUTLIER 'Trans proline' 0 C--N 1.372 1.811 1 N-CA-C 125.105 5.002 . . . . 2.0 125.105 -178.571 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 9.7 mtmp? -70.14 92.22 0.74 Allowed 'General case' 0 CA--C 1.566 1.589 0 N-CA-C 105.511 -2.033 . . . . 2.0 105.511 179.534 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 45' ' ' ASN . . . . . . . . . . . . . 2.5 p-10 -60.06 114.05 2.65 Favored 'General case' 0 CA--C 1.567 1.601 0 N-CA-C 116.73 2.122 . . . . 2.0 116.73 -179.402 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 7.8 t -80.09 -178.03 6.33 Favored 'General case' 0 CA--C 1.567 1.608 0 N-CA-C 114.667 1.358 . . . . 2.0 114.667 179.968 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 47' ' ' LEU . . . . . . . . . . . . . 97.4 mt -51.74 -28.34 14.8 Favored 'General case' 0 N--CA 1.505 2.309 0 N-CA-C 115.955 1.835 . . . . 2.0 115.955 179.777 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 79.1 mt -101.84 7.44 41.64 Favored 'General case' 0 CA--C 1.581 2.14 0 N-CA-C 114.518 1.303 . . . . 2.0 114.518 179.735 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 49' ' ' VAL . . . . . . . . . . . . . 13.9 p -148.14 159.67 7.4 Favored 'Isoleucine or valine' 0 N--CA 1.5 2.067 0 CA-C-N 122.195 2.27 . . . . 2.0 117.127 -179.518 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 13.3 tmtt? -155.27 86.65 1.09 Allowed 'General case' 0 CA--C 1.573 1.84 0 N-CA-C 101.625 -3.472 . . . . 2.0 101.625 179.562 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 36.7 m-85 -69.56 127.32 32.58 Favored 'General case' 0 CA--C 1.57 1.735 0 N-CA-C 121.442 3.867 . . . . 2.0 121.442 -179.297 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 52' ' ' VAL . . . . . . . . . . . . 0.323 8.6 t -99.51 162.51 2.98 Favored 'Isoleucine or valine' 0 CA--C 1.586 2.349 0 N-CA-C 102.574 -3.121 . . . . 2.0 102.574 178.881 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 53' ' ' CYS . . . . . . . . . . . . 0.318 1.2 p -166.2 153.47 9.83 Favored 'General case' 0 N--CA 1.495 1.801 0 O-C-N 117.388 -3.32 . . . . 2.0 117.993 -179.046 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 54' ' ' CYS . . . . . . . . . . . . 0.389 23.2 p -151.13 117.61 5.71 Favored 'General case' 0 CA--C 1.583 2.25 0 CA-C-O 122.946 1.355 . . . . 2.0 111.694 179.412 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 9.7 m120 -30.27 -0.8 0.0 OUTLIER 'General case' 0 CA--C 1.582 2.19 1 N-CA-C 129.681 6.919 . . . . 2.0 129.681 -179.596 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 56' ' ' THR . . . . . 0.562 ' O ' ' SG ' ' A' ' 21' ' ' CYS . 7.2 t -143.46 160.85 39.83 Favored 'General case' 0 N--CA 1.515 2.782 0 CA-C-N 125.564 3.802 . . . . 2.0 116.225 -179.747 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 57' ' ' ASP . . . . . . . . . . . . . 44.1 m-20 -46.27 104.07 0.05 OUTLIER 'General case' 0 N--CA 1.503 2.203 0 N-CA-C 118.416 2.747 . . . . 2.0 118.416 -179.783 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 58' ' ' ARG . . . . . . . . . . . . 0.315 27.7 mtm180 82.27 16.8 0.39 Allowed 'General case' 0 N--CA 1.507 2.405 0 C-N-CA 125.481 1.512 . . . . 2.0 115.057 -179.695 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 59' ' ' CYS . . . . . . . . . . . . . 34.0 t -63.84 -26.34 68.57 Favored 'General case' 0 CA--C 1.58 2.11 0 N-CA-C 115.148 1.536 . . . . 2.0 115.148 179.689 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 60' ' ' ASN . . . . . . . . . . . . . 51.2 p30 . . . . . 0 CA--C 1.568 1.652 0 CA-C-O 124.309 2.004 . . . . 2.0 114.975 179.837 . . . . . . . . 0 0 . 1 . 002 nuclear build full ' A' A ' 1' ' ' LEU . . . . . 0.436 HD23 ' SG ' ' A' ' 3' ' ' CYS . 14.2 tp . . . . . 0 CA--C 1.567 1.597 0 N-CA-C 113.883 1.068 . . . . 2.0 113.883 . . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 27.5 mtpt -89.87 130.33 36.11 Favored 'General case' 0 CA--C 1.571 1.776 0 N-CA-C 106.118 -1.808 . . . . 2.0 106.118 179.399 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 3' ' ' CYS . . . . . 0.436 ' SG ' HD23 ' A' ' 1' ' ' LEU . 90.8 m -131.75 -171.44 2.62 Favored 'General case' 0 N--CA 1.499 2.012 0 O-C-N 119.374 -2.079 . . . . 2.0 113.935 -179.84 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 77.9 m-20 -135.83 118.92 16.46 Favored 'General case' 0 CA--C 1.558 1.262 0 C-N-CA 123.562 0.745 . . . . 2.0 112.789 179.943 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -71.14 177.12 3.96 Favored 'General case' 0 CA--C 1.594 2.65 0 CA-C-N 120.34 1.427 . . . . 2.0 110.438 179.209 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 32.1 mt -48.72 -43.45 37.31 Favored 'General case' 0 N--CA 1.514 2.758 0 N-CA-C 119.394 3.109 . . . . 2.0 119.394 -179.84 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 7' ' ' ILE . . . . . . . . . . . . . 46.4 mm -35.62 139.11 0.39 Allowed Pre-proline 0 CA--C 1.583 2.214 0 N-CA-C 116.636 2.088 . . . . 2.0 116.636 -179.87 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 49.4 Cg_exo -37.39 -51.94 1.56 Allowed 'Trans proline' 0 CA--C 1.565 2.055 0 C-N-CA 123.673 2.916 . . . . 2.0 118.729 -179.961 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 9' ' ' ILE . . . . . . . . . . . . 0.31 17.4 tt -84.63 -71.69 0.41 Allowed 'Isoleucine or valine' 0 N--CA 1.496 1.852 0 N-CA-C 107.745 -1.206 . . . . 2.0 107.745 179.471 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . 58.76 137.55 0.01 OUTLIER 'General case' 0 CA--C 1.574 1.887 0 N-CA-C 119.447 3.128 . . . . 2.0 119.447 179.639 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 38.8 t -147.99 -143.61 0.14 Allowed 'General case' 0 CA--C 1.581 2.158 0 O-C-N 120.32 -1.487 . . . . 2.0 111.644 -179.943 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . 0.369 3.9 ttmt 92.14 174.98 0.02 OUTLIER 'General case' 0 N--CA 1.503 2.188 0 C-N-CA 126.061 1.745 . . . . 2.0 115.172 -179.915 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 13' ' ' THR . . . . . . . . . . . . . 84.9 m -152.66 149.59 28.58 Favored 'General case' 0 N--CA 1.495 1.807 0 N-CA-C 114.007 1.114 . . . . 2.0 114.007 -179.689 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 14' ' ' CYS . . . . . . . . . . . . 0.295 0.1 OUTLIER -134.16 176.97 2.48 Favored Pre-proline 0 CA--C 1.599 2.85 0 C-N-CA 124.545 1.138 . . . . 2.0 109.625 179.398 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 15' ' ' PRO . . . . . . . . . . . . . 88.0 Cg_exo -52.99 172.2 0.2 Allowed 'Trans proline' 0 CA--C 1.572 2.422 1 N-CA-C 126.232 5.435 . . . . 2.0 126.232 -179.64 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -78.56 169.97 17.4 Favored 'General case' 0 N--CA 1.498 1.938 0 N-CA-C 107.965 -1.124 . . . . 2.0 107.965 179.247 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . 83.79 -50.41 4.4 Favored Glycine 1 N--CA 1.519 4.201 0 O-C-N 118.295 -2.753 . . . . 2.0 106.942 -178.953 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 73.9 mmtt -78.76 71.62 5.23 Favored 'General case' 0 CA--C 1.581 2.168 0 N-CA-C 104.259 -2.497 . . . . 2.0 104.259 179.105 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 8.5 p30 -82.15 -21.48 36.56 Favored 'General case' 0 N--CA 1.49 1.571 1 N-CA-C 121.928 4.047 . . . . 2.0 121.928 -179.513 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 86.0 mt -88.16 119.54 28.65 Favored 'General case' 0 CA--C 1.553 1.087 0 N-CA-C 113.298 0.851 . . . . 2.0 113.298 -179.934 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 21' ' ' CYS . . . . . 0.407 ' SG ' HD21 ' A' ' 1' ' ' LEU . 4.5 m -83.96 100.82 11.28 Favored 'General case' 0 CA--C 1.58 2.131 1 N-CA-C 99.664 -4.198 . . . . 2.0 99.664 179.198 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 22' ' ' TYR . . . . . . . . . . . . . 4.7 p90 -75.45 159.58 31.19 Favored 'General case' 0 CA--C 1.556 1.181 0 N-CA-C 119.505 3.15 . . . . 2.0 119.505 -179.349 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 29.4 ttpt -139.03 98.65 3.58 Favored 'General case' 0 CA--C 1.565 1.556 0 N-CA-C 103.219 -2.882 . . . . 2.0 103.219 179.567 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 24' ' ' MET . . . . . 0.526 ' SD ' ' HB2' ' A' ' 35' ' ' LYS . 13.6 ttm -69.73 74.93 0.43 Allowed 'General case' 0 CA--C 1.57 1.737 0 N-CA-C 114.805 1.409 . . . . 2.0 114.805 -179.76 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 25' ' ' PHE . . . . . . . . . . . . . 4.5 m-30 -62.48 128.09 34.36 Favored 'General case' 0 N--CA 1.497 1.917 0 O-C-N 120.431 -1.418 . . . . 2.0 112.121 179.821 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 26' ' ' MET . . . . . . . . . . . . . 76.5 mtp -57.31 129.32 41.25 Favored 'General case' 0 N--CA 1.497 1.886 0 N-CA-C 114.305 1.224 . . . . 2.0 114.305 179.895 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 27' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -59.09 -39.42 82.12 Favored 'General case' 0 N--CA 1.512 2.644 0 CA-C-N 120.985 1.72 . . . . 2.0 110.742 179.381 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 48.9 m -68.75 -34.35 75.44 Favored 'General case' 0 CA--C 1.584 2.281 0 N-CA-C 113.647 0.981 . . . . 2.0 113.647 179.368 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 8.9 t70 -155.47 84.49 1.05 Allowed 'General case' 0 CA--C 1.572 1.794 0 O-C-N 120.631 -1.293 . . . . 2.0 109.343 179.671 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 30' ' ' LEU . . . . . 0.471 ' H ' HD22 ' A' ' 30' ' ' LEU . 2.3 mm? -44.43 -41.51 6.3 Favored 'General case' 0 CA--C 1.574 1.887 0 N-CA-C 120.76 3.615 . . . . 2.0 120.76 -179.776 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 31' ' ' THR . . . . . . . . . . . . . 43.3 p -41.06 -54.82 2.73 Favored 'General case' 0 N--CA 1.502 2.138 0 N-CA-C 119.587 3.18 . . . . 2.0 119.587 -179.784 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 32' ' ' ILE . . . . . . . . . . . . . 2.1 mp -96.61 114.63 64.81 Favored Pre-proline 0 CA--C 1.586 2.34 0 N-CA-C 106.7 -1.593 . . . . 2.0 106.7 179.914 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 33' ' ' PRO . . . . . . . . . . . . . 13.3 Cg_exo -70.29 151.0 65.84 Favored 'Trans proline' 0 CA--C 1.572 2.422 0 N-CA-C 119.261 2.754 . . . . 2.0 119.261 -179.871 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 34' ' ' VAL . . . . . . . . . . . . . 60.9 t -79.14 -38.75 20.63 Favored 'Isoleucine or valine' 0 N--CA 1.509 2.489 0 C-N-CA 124.397 1.079 . . . . 2.0 111.119 179.445 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 35' ' ' LYS . . . . . 0.526 ' HB2' ' SD ' ' A' ' 24' ' ' MET . 18.1 tptt -147.93 170.32 17.95 Favored 'General case' 0 CA--C 1.559 1.295 0 CA-C-O 123.986 1.85 . . . . 2.0 110.151 179.817 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 36' ' ' ARG . . . . . . . . . . . . 0.269 7.2 ttp180 -148.21 114.27 5.81 Favored 'General case' 0 CA--C 1.575 1.939 0 N-CA-C 101.423 -3.547 . . . . 2.0 101.423 -179.906 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . -145.65 -148.99 4.91 Favored Glycine 0 N--CA 1.496 2.694 0 N-CA-C 119.793 2.677 . . . . 2.0 119.793 -179.561 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 38' ' ' CYS . . . . . . . . . . . . . 13.6 p -126.42 137.27 53.4 Favored 'General case' 0 CA--C 1.571 1.752 0 C-N-CA 123.89 0.876 . . . . 2.0 112.064 179.933 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 39' ' ' ILE . . . . . 0.841 HG21 ' HD3' ' A' ' 43' ' ' PRO . 10.5 tp -165.03 165.77 0.55 Allowed 'Isoleucine or valine' 0 N--CA 1.509 2.494 0 O-C-N 120.595 -1.316 . . . . 2.0 113.997 -179.703 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 40' ' ' ASP . . . . . . . . . . . . . 7.9 p-10 -79.31 -46.95 16.7 Favored 'General case' 0 N--CA 1.505 2.29 0 O-C-N 119.283 -2.136 . . . . 2.0 114.471 179.493 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 80.5 t -130.75 152.03 36.87 Favored 'Isoleucine or valine' 0 CA--C 1.576 1.965 0 C-N-CA 127.134 2.174 . . . . 2.0 105.275 179.644 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 42' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -52.59 111.01 2.23 Favored Pre-proline 0 N--CA 1.526 3.332 0 N-CA-C 102.745 -3.057 . . . . 2.0 102.745 179.359 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 43' ' ' PRO . . . . . 0.841 ' HD3' HG21 ' A' ' 39' ' ' ILE 0.548 71.7 Cg_exo -11.94 -109.4 0.0 OUTLIER 'Trans proline' 0 C--N 1.378 2.079 2 C-N-CA 125.799 4.332 . . . . 2.0 123.02 -178.408 . . . . . . . . 4 3 . 1 . 002 nuclear build full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 6.0 mtmp? -159.8 95.28 1.18 Allowed 'General case' 0 CA--C 1.556 1.183 1 N-CA-C 96.68 -5.304 . . . . 2.0 96.68 179.691 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 45' ' ' ASN . . . . . . . . . . . . . 2.8 p-10 -62.66 97.47 0.1 Allowed 'General case' 0 CA--C 1.575 1.912 0 N-CA-C 116.404 2.001 . . . . 2.0 116.404 -179.522 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 13.7 t -79.64 -179.18 6.74 Favored 'General case' 0 CA--C 1.567 1.615 0 N-CA-C 114.35 1.241 . . . . 2.0 114.35 179.981 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 47' ' ' LEU . . . . . . . . . . . . 0.385 1.3 pp -54.52 -15.66 1.88 Allowed 'General case' 0 N--CA 1.509 2.521 0 N-CA-C 117.938 2.57 . . . . 2.0 117.938 179.819 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 84.5 mt -104.29 3.49 32.64 Favored 'General case' 0 CA--C 1.59 2.501 0 C-N-CA 125.463 1.505 . . . . 2.0 111.471 179.133 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 49' ' ' VAL . . . . . . . . . . . . . 6.7 p -157.7 156.09 4.43 Favored 'Isoleucine or valine' 0 CA--C 1.579 2.082 0 N-CA-C 118.439 2.755 . . . . 2.0 118.439 -179.584 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -145.81 72.37 1.3 Allowed 'General case' 0 CA--C 1.584 2.258 0 N-CA-C 103.143 -2.91 . . . . 2.0 103.143 179.097 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 97.2 m-85 -44.88 133.72 6.09 Favored 'General case' 0 CA--C 1.574 1.896 0 N-CA-C 120.402 3.482 . . . . 2.0 120.402 -179.498 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 52' ' ' VAL . . . . . . . . . . . . . 40.6 t -115.9 103.02 14.55 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.897 0 N-CA-C 103.081 -2.933 . . . . 2.0 103.081 179.726 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 53' ' ' CYS . . . . . . . . . . . . 0.255 4.2 m -121.11 153.65 37.19 Favored 'General case' 0 CA--C 1.569 1.695 0 N-CA-C 117.881 2.548 . . . . 2.0 117.881 -179.6 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 54' ' ' CYS . . . . . . . . . . . . 0.351 8.6 p -141.73 127.69 19.46 Favored 'General case' 0 CA--C 1.577 2.019 0 CA-C-O 122.427 1.108 . . . . 2.0 111.065 179.703 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 4.7 p-10 -53.15 36.24 0.0 OUTLIER 'General case' 0 N--CA 1.5 2.062 1 N-CA-C 125.8 5.481 . . . . 2.0 125.8 -179.56 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 56' ' ' THR . . . . . . . . . . . . 0.253 7.2 t -153.8 170.88 19.9 Favored 'General case' 0 N--CA 1.499 2.022 0 O-C-N 119.443 -2.035 . . . . 2.0 114.424 179.968 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 57' ' ' ASP . . . . . . . . . . . . . 73.3 m-20 -60.98 117.96 6.13 Favored 'General case' 0 CA--C 1.563 1.444 0 N-CA-C 114.487 1.291 . . . . 2.0 114.487 -179.807 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 58' ' ' ARG . . . . . . . . . . . . . 78.0 mtt85 64.09 20.51 12.22 Favored 'General case' 0 N--CA 1.5 2.075 0 N-CA-C 116.222 1.934 . . . . 2.0 116.222 -179.834 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 59' ' ' CYS . . . . . . . . . . . . . 49.3 t -62.84 -28.82 70.28 Favored 'General case' 0 CA--C 1.575 1.94 0 N-CA-C 116.7 2.111 . . . . 2.0 116.7 179.912 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 60' ' ' ASN . . . . . . . . . . . . . 41.3 p-10 . . . . . 0 CA--C 1.572 1.793 0 CA-C-O 124.252 1.977 . . . . 2.0 115.46 179.846 . . . . . . . . 0 0 . 1 . 003 nuclear build full ' A' A ' 1' ' ' LEU . . . . . 0.548 HD13 ' SG ' ' A' ' 3' ' ' CYS . 0.5 OUTLIER . . . . . 0 CA--C 1.579 2.058 0 CA-C-O 123.065 1.412 . . . . 2.0 112.51 . . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 53.9 mttp -145.2 111.28 5.56 Favored 'General case' 0 CA--C 1.566 1.559 0 N-CA-C 100.801 -3.777 . . . . 2.0 100.801 179.427 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 3' ' ' CYS . . . . . 0.548 ' SG ' HD13 ' A' ' 1' ' ' LEU . 90.7 m -133.02 156.85 46.6 Favored 'General case' 0 N--CA 1.491 1.588 0 O-C-N 120.335 -1.478 . . . . 2.0 113.909 -179.722 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 29.6 m-20 -105.63 117.18 33.35 Favored 'General case' 0 N--CA 1.487 1.415 0 N-CA-C 114.259 1.207 . . . . 2.0 114.259 -179.768 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . 0.301 1.1 pttt -64.63 -179.9 0.55 Allowed 'General case' 0 CA--C 1.58 2.133 0 O-C-N 120.518 -1.364 . . . . 2.0 112.686 179.634 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -41.75 -43.82 3.03 Favored 'General case' 0 N--CA 1.502 2.171 1 N-CA-C 121.94 4.052 . . . . 2.0 121.94 -179.691 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 7' ' ' ILE . . . . . . . . . . . . . 35.8 mt -55.39 142.15 60.67 Favored Pre-proline 0 CA--C 1.588 2.416 0 CA-C-O 116.882 -1.532 . . . . 2.0 113.227 179.878 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 65.3 Cg_exo -35.54 -54.04 0.77 Allowed 'Trans proline' 0 CA--C 1.57 2.321 0 C-N-CA 123.914 3.076 . . . . 2.0 118.78 179.977 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 9' ' ' ILE . . . . . . . . . . . . . 1.6 pp -126.44 75.27 0.51 Allowed 'Isoleucine or valine' 0 CA--C 1.575 1.924 0 N-CA-C 107.253 -1.388 . . . . 2.0 107.253 179.658 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -80.23 -163.32 0.54 Allowed 'General case' 0 CA--C 1.579 2.087 0 N-CA-C 119.19 3.033 . . . . 2.0 119.19 -179.749 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 8.8 t -57.12 -178.94 0.03 OUTLIER 'General case' 0 CA--C 1.582 2.201 0 N-CA-C 118.091 2.626 . . . . 2.0 118.091 -179.845 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . 0.25 37.1 ttpt -120.97 -93.5 0.52 Allowed 'General case' 0 CA--C 1.578 2.021 0 N-CA-C 118.324 2.712 . . . . 2.0 118.324 -179.64 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 13' ' ' THR . . . . . . . . . . . . . 32.6 m -46.59 134.56 9.36 Favored 'General case' 0 N--CA 1.501 2.087 0 N-CA-C 120.259 3.429 . . . . 2.0 120.259 -179.454 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 3.9 t -149.47 154.57 38.51 Favored Pre-proline 0 CA--C 1.598 2.823 0 C-N-CA 124.616 1.166 . . . . 2.0 111.174 -179.932 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 15' ' ' PRO . . . . . . . . . . . . . 58.4 Cg_exo -43.25 157.63 0.1 Allowed 'Trans proline' 0 CA--C 1.575 2.535 1 N-CA-C 126.659 5.6 . . . . 2.0 126.659 -179.66 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -79.76 168.92 18.68 Favored 'General case' 0 N--CA 1.499 1.981 0 C-N-CA 124.87 1.268 . . . . 2.0 111.385 179.642 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . 83.75 -51.59 4.59 Favored Glycine 1 N--CA 1.519 4.197 0 O-C-N 119.381 -2.074 . . . . 2.0 108.215 -179.049 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 21.1 mmtm -71.87 101.44 2.64 Favored 'General case' 0 CA--C 1.572 1.803 0 C-N-CA 129.048 2.939 . . . . 2.0 106.764 179.386 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 19' ' ' ASN . . . . . . . . . . . . 0.34 0.2 OUTLIER -106.94 -8.11 16.76 Favored 'General case' 0 N--CA 1.499 2.012 0 N-CA-C 117.406 2.372 . . . . 2.0 117.406 179.862 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 89.0 mt -100.2 113.97 27.04 Favored 'General case' 0 CA--C 1.563 1.471 0 C-N-CA 126.141 1.776 . . . . 2.0 109.593 179.605 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 1.3 m -80.23 101.05 8.63 Favored 'General case' 0 CA--C 1.577 1.996 0 N-CA-C 101.457 -3.535 . . . . 2.0 101.457 179.226 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 22' ' ' TYR . . . . . . . . . . . . 0.37 13.2 p90 -75.91 160.29 30.06 Favored 'General case' 0 N--CA 1.484 1.23 0 N-CA-C 119.145 3.016 . . . . 2.0 119.145 -179.509 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 60.2 tttt -135.98 87.31 2.3 Favored 'General case' 0 CA--C 1.565 1.527 0 N-CA-C 103.125 -2.917 . . . . 2.0 103.125 179.846 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 24' ' ' MET . . . . . 0.575 ' HB3' ' H ' ' A' ' 35' ' ' LYS . 24.2 ttt -61.89 76.75 0.02 OUTLIER 'General case' 0 N--CA 1.492 1.659 0 N-CA-C 118.242 2.682 . . . . 2.0 118.242 -179.58 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 25' ' ' PHE . . . . . . . . . . . . . 12.5 m-30 -69.53 128.0 34.96 Favored 'General case' 0 CA--C 1.568 1.656 0 O-C-N 120.598 -1.313 . . . . 2.0 112.328 179.839 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 26' ' ' MET . . . . . . . . . . . . . 32.2 mtm -64.16 132.02 49.17 Favored 'General case' 0 N--CA 1.501 2.087 0 O-C-N 120.308 -1.495 . . . . 2.0 108.524 179.619 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 27' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -53.48 -31.12 44.45 Favored 'General case' 0 N--CA 1.511 2.58 0 CA-C-N 121.772 2.078 . . . . 2.0 114.045 179.775 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 50.3 m -83.73 -39.77 19.7 Favored 'General case' 0 CA--C 1.587 2.371 0 C-N-CA 124.634 1.174 . . . . 2.0 112.004 179.218 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 38.6 t70 -131.66 88.32 2.56 Favored 'General case' 0 CA--C 1.572 1.789 0 N-CA-C 107.08 -1.452 . . . . 2.0 107.08 179.773 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 2.2 mm? -60.57 -82.66 0.02 OUTLIER 'General case' 0 CA--C 1.578 2.022 0 N-CA-C 121.078 3.733 . . . . 2.0 121.078 -179.413 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 31' ' ' THR . . . . . . . . . . . . 0.344 13.9 t -19.13 -52.22 0.01 OUTLIER 'General case' 0 N--CA 1.51 2.543 1 N-CA-C 123.257 4.54 . . . . 2.0 123.257 -179.643 . . . . . . . . 3 2 . 1 . 003 nuclear build full ' A' A ' 32' ' ' ILE . . . . . . . . . . . . . 1.7 mp -97.28 105.93 28.5 Favored Pre-proline 0 CA--C 1.59 2.518 1 N-CA-C 99.314 -4.328 . . . . 2.0 99.314 179.432 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 33' ' ' PRO . . . . . . . . . . . . . 5.5 Cg_endo -73.14 178.23 6.81 Favored 'Trans proline' 0 CA--C 1.568 2.19 0 N-CA-C 120.323 3.163 . . . . 2.0 120.323 -179.446 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 34' ' ' VAL . . . . . . . . . . . . . 56.0 t -85.79 -63.05 1.33 Allowed 'Isoleucine or valine' 0 CA--C 1.585 2.292 0 N-CA-C 106.865 -1.531 . . . . 2.0 106.865 179.309 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 35' ' ' LYS . . . . . 0.575 ' H ' ' HB3' ' A' ' 24' ' ' MET . 38.9 ttmt -139.34 113.62 8.92 Favored 'General case' 0 CA--C 1.558 1.281 0 C-N-CA 124.419 1.088 . . . . 2.0 113.609 -179.9 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 36' ' ' ARG . . . . . . . . . . . . 0.345 51.8 ttp180 -85.69 73.27 10.45 Favored 'General case' 0 CA--C 1.59 2.485 0 O-C-N 120.257 -1.527 . . . . 2.0 110.319 179.971 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . -98.44 -145.84 19.48 Favored Glycine 0 N--CA 1.501 2.976 1 N-CA-C 123.535 4.174 . . . . 2.0 123.535 -179.507 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 38' ' ' CYS . . . . . . . . . . . . . 14.6 p -126.64 132.99 51.1 Favored 'General case' 0 N--CA 1.498 1.955 0 N-CA-C 114.887 1.44 . . . . 2.0 114.887 179.921 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 39' ' ' ILE . . . . . 0.596 HG13 ' H ' ' A' ' 40' ' ' ASP . 6.2 tp -152.81 -174.8 0.18 Allowed 'Isoleucine or valine' 0 N--CA 1.502 2.174 0 C-N-CA 124.7 1.2 . . . . 2.0 111.598 -179.93 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 40' ' ' ASP . . . . . 0.596 ' H ' HG13 ' A' ' 39' ' ' ILE . 4.0 p30 -119.55 -25.94 5.87 Favored 'General case' 0 N--CA 1.5 2.046 0 O-C-N 119.339 -2.101 . . . . 2.0 113.075 179.212 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 54.9 t -137.14 16.53 0.84 Allowed 'Isoleucine or valine' 0 N--CA 1.504 2.235 0 CA-C-N 120.546 1.521 . . . . 2.0 113.001 179.853 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 42' ' ' CYS . . . . . . . . . . . . 0.314 3.1 m 81.59 111.91 0.03 OUTLIER Pre-proline 0 CA--C 1.61 3.271 1 N-CA-C 95.454 -5.758 . . . . 2.0 95.454 -178.972 . . . . . . . . 3 2 . 1 . 003 nuclear build full ' A' A ' 43' ' ' PRO . . . . . 0.496 ' HD3' HG21 ' A' ' 39' ' ' ILE 0.498 41.5 Cg_exo -22.03 -75.27 0.02 OUTLIER 'Trans proline' 0 C--N 1.376 1.998 1 N-CA-C 125.061 4.985 . . . . 2.0 125.061 -178.635 . . . . . . . . 4 3 . 1 . 003 nuclear build full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 3.4 mtpp -179.74 101.64 0.03 OUTLIER 'General case' 0 CA--C 1.564 1.489 1 N-CA-C 99.881 -4.118 . . . . 2.0 99.881 179.832 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 45' ' ' ASN . . . . . . . . . . . . . 2.5 p-10 -73.82 139.69 45.29 Favored 'General case' 0 N--CA 1.492 1.661 0 O-C-N 120.268 -1.52 . . . . 2.0 114.573 -179.811 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 12.3 t -148.34 -173.48 4.33 Favored 'General case' 0 N--CA 1.49 1.551 0 N-CA-C 112.896 0.702 . . . . 2.0 112.896 179.936 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 47' ' ' LEU . . . . . . . . . . . . . 2.6 pp -57.76 -15.34 7.78 Favored 'General case' 0 N--CA 1.508 2.439 0 N-CA-C 116.578 2.066 . . . . 2.0 116.578 179.572 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 10.0 tp -96.78 -27.0 14.93 Favored 'General case' 0 CA--C 1.579 2.064 0 C-N-CA 126.513 1.925 . . . . 2.0 112.049 179.374 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 49' ' ' VAL . . . . . . . . . . . . . 10.9 p -154.15 146.9 13.87 Favored 'Isoleucine or valine' 0 CA--C 1.579 2.059 0 N-CA-C 119.021 2.971 . . . . 2.0 119.021 -179.522 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 18.9 ttpt -132.18 120.64 22.52 Favored 'General case' 0 CA--C 1.572 1.819 0 N-CA-C 101.7 -3.444 . . . . 2.0 101.7 179.526 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -103.05 135.27 45.04 Favored 'General case' 0 N--CA 1.506 2.34 0 O-C-N 118.393 -2.692 . . . . 2.0 117.635 -179.293 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 52' ' ' VAL . . . . . . . . . . . . . 25.4 t -102.22 97.39 5.59 Favored 'Isoleucine or valine' 0 CA--C 1.575 1.91 0 N-CA-C 104.012 -2.588 . . . . 2.0 104.012 179.588 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 53' ' ' CYS . . . . . . . . . . . . . 0.8 OUTLIER -100.22 132.56 45.51 Favored 'General case' 0 CA--C 1.576 1.966 0 N-CA-C 119.975 3.324 . . . . 2.0 119.975 -179.331 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 54' ' ' CYS . . . . . . . . . . . . . 51.4 t -117.14 124.76 49.97 Favored 'General case' 0 N--CA 1.495 1.82 0 C-N-CA 124.401 1.081 . . . . 2.0 110.305 179.909 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 2.6 t30 -67.54 49.03 0.05 OUTLIER 'General case' 0 N--CA 1.503 2.204 1 N-CA-C 124.22 4.896 . . . . 2.0 124.22 -179.368 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 56' ' ' THR . . . . . . . . . . . . 0.332 5.9 t -163.17 171.12 16.77 Favored 'General case' 0 N--CA 1.503 2.208 0 O-C-N 119.673 -1.892 . . . . 2.0 113.346 179.663 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 57' ' ' ASP . . . . . . . . . . . . . 20.0 m-20 -70.32 107.47 3.78 Favored 'General case' 0 CA--C 1.57 1.722 0 N-CA-C 115.661 1.726 . . . . 2.0 115.661 -179.8 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 58' ' ' ARG . . . . . . . . . . . . 0.278 74.7 mtm180 78.2 13.14 1.61 Allowed 'General case' 0 N--CA 1.502 2.162 0 N-CA-C 116.52 2.044 . . . . 2.0 116.52 179.833 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 59' ' ' CYS . . . . . . . . . . . . . 44.3 t -69.33 -10.79 59.51 Favored 'General case' 0 CA--C 1.577 2.019 0 N-CA-C 117.253 2.316 . . . . 2.0 117.253 179.742 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 60' ' ' ASN . . . . . . . . . . . . . 45.4 p30 . . . . . 0 CA--C 1.561 1.403 0 CA-C-O 125.537 2.589 . . . . 2.0 113.737 179.953 . . . . . . . . 0 0 . 1 . 004 nuclear build full ' A' A ' 1' ' ' LEU . . . . . . . . . . . . 0.313 0.3 OUTLIER . . . . . 0 CA--C 1.57 1.734 0 N-CA-C 113.798 1.036 . . . . 2.0 113.798 . . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 4.1 mmmm -69.09 130.24 42.17 Favored 'General case' 0 N--CA 1.494 1.748 0 O-C-N 120.736 -1.227 . . . . 2.0 110.626 179.833 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 70.7 m -135.1 -169.95 2.48 Favored 'General case' 0 CA--C 1.572 1.792 0 O-C-N 120.493 -1.379 . . . . 2.0 114.364 -179.855 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 2.9 m120 -129.8 132.9 46.66 Favored 'General case' 0 N--CA 1.49 1.567 0 C-N-CA 124.98 1.312 . . . . 2.0 110.23 179.909 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 5' ' ' LYS . . . . . 0.447 ' H ' ' HB1' ' A' ' 10' ' ' ALA . 11.9 ptmt -83.84 172.57 12.02 Favored 'General case' 0 CA--C 1.591 2.534 0 CA-C-N 120.183 1.356 . . . . 2.0 107.671 179.088 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 52.1 mt -42.49 -43.69 3.78 Favored 'General case' 0 N--CA 1.514 2.726 0 N-CA-C 119.336 3.087 . . . . 2.0 119.336 -179.758 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 7' ' ' ILE . . . . . . . . . . . . . 43.8 mm -48.02 131.44 12.09 Favored Pre-proline 0 CA--C 1.583 2.213 0 CA-C-O 115.975 -1.964 . . . . 2.0 112.088 179.968 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . 0.323 13.9 Cg_exo -16.01 -68.75 0.01 OUTLIER 'Trans proline' 0 CA--C 1.563 1.965 0 C-N-CA 124.758 3.639 . . . . 2.0 121.547 -179.751 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 9' ' ' ILE . . . . . . . . . . . . 0.298 15.1 tt -88.18 -72.01 0.46 Allowed 'Isoleucine or valine' 0 CA--C 1.573 1.862 0 CA-C-O 118.824 -0.608 . . . . 2.0 109.517 179.72 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 10' ' ' ALA . . . . . 0.447 ' HB1' ' H ' ' A' ' 5' ' ' LYS . . . 52.77 152.02 0.0 OUTLIER 'General case' 0 CA--C 1.576 1.949 1 N-CA-C 121.972 4.064 . . . . 2.0 121.972 179.711 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 20.2 t -148.46 135.27 19.92 Favored 'General case' 0 N--CA 1.492 1.64 0 O-C-N 120.469 -1.394 . . . . 2.0 114.133 -179.97 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 78.1 tttt -135.75 135.16 39.74 Favored 'General case' 0 N--CA 1.493 1.709 0 C-N-CA 125.201 1.4 . . . . 2.0 107.759 179.782 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 13' ' ' THR . . . . . . . . . . . . . 14.3 t -117.12 104.4 11.19 Favored 'General case' 0 N--CA 1.504 2.235 0 CA-C-N 120.845 1.657 . . . . 2.0 111.108 179.962 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 14' ' ' CYS . . . . . . . . . . . . 0.294 0.0 OUTLIER -123.64 168.24 13.02 Favored Pre-proline 0 CA--C 1.588 2.435 0 O-C-N 121.077 -1.014 . . . . 2.0 113.376 179.925 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 15' ' ' PRO . . . . . . . . . . . . . 53.5 Cg_exo -62.78 166.99 12.65 Favored 'Trans proline' 0 N--CA 1.505 2.152 1 N-CA-C 124.989 4.957 . . . . 2.0 124.989 -179.631 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -69.45 173.69 5.65 Favored 'General case' 0 N--CA 1.498 1.958 0 C-N-CA 123.661 0.784 . . . . 2.0 109.14 179.382 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . 84.55 -52.58 4.72 Favored Glycine 0 N--CA 1.516 3.978 0 O-C-N 118.36 -2.712 . . . . 2.0 106.669 -178.963 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 39.4 mmtt -78.74 61.01 2.92 Favored 'General case' 0 CA--C 1.598 2.79 0 N-CA-C 105.224 -2.139 . . . . 2.0 105.224 179.08 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 7.4 p30 -60.96 -41.92 97.27 Favored 'General case' 0 N--CA 1.481 1.123 0 N-CA-C 119.627 3.195 . . . . 2.0 119.627 -179.582 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 97.4 mt -71.93 112.24 7.86 Favored 'General case' 0 CA--C 1.554 1.113 0 N-CA-C 115.44 1.644 . . . . 2.0 115.44 -179.87 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 1.4 m -82.62 97.85 8.71 Favored 'General case' 0 CA--C 1.577 1.994 0 N-CA-C 100.323 -3.954 . . . . 2.0 100.323 179.255 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 22' ' ' TYR . . . . . . . . . . . . 0.381 1.2 p90 -64.87 161.12 18.97 Favored 'General case' 0 CA--C 1.562 1.43 0 N-CA-C 120.65 3.574 . . . . 2.0 120.65 -179.347 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 7.3 tppt? -138.3 98.32 3.58 Favored 'General case' 0 CA--C 1.568 1.665 0 N-CA-C 102.546 -3.131 . . . . 2.0 102.546 179.86 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 24' ' ' MET . . . . . 0.439 ' SD ' ' HB2' ' A' ' 35' ' ' LYS . 10.0 ttt -72.59 85.86 1.18 Allowed 'General case' 0 CA--C 1.565 1.525 0 O-C-N 120.498 -1.377 . . . . 2.0 112.17 -179.892 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 25' ' ' PHE . . . . . . . . . . . . . 2.4 m-30 -76.91 117.68 18.75 Favored 'General case' 0 CA--C 1.569 1.69 0 N-CA-C 106.675 -1.602 . . . . 2.0 106.675 179.632 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 26' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -56.52 129.05 39.17 Favored 'General case' 0 N--CA 1.497 1.912 0 O-C-N 121.047 -1.033 . . . . 2.0 113.668 -179.781 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 27' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -42.83 -44.01 4.28 Favored 'General case' 0 N--CA 1.506 2.331 0 N-CA-C 117.326 2.343 . . . . 2.0 117.326 -179.787 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 53.1 m -76.13 -42.29 47.35 Favored 'General case' 0 CA--C 1.581 2.161 0 N-CA-C 113.287 0.847 . . . . 2.0 113.287 179.566 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 64.4 t0 -133.34 96.28 3.69 Favored 'General case' 0 CA--C 1.568 1.663 0 N-CA-C 105.705 -1.961 . . . . 2.0 105.705 179.712 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 2.8 mm? -64.95 -63.41 1.12 Allowed 'General case' 0 CA--C 1.568 1.669 0 N-CA-C 118.602 2.815 . . . . 2.0 118.602 -179.601 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 31' ' ' THR . . . . . . . . . . . . . 81.3 p -33.41 -46.68 0.19 Allowed 'General case' 0 N--CA 1.508 2.44 0 N-CA-C 120.426 3.491 . . . . 2.0 120.426 -179.673 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 32' ' ' ILE . . . . . . . . . . . . . 2.2 mp -87.39 111.35 40.8 Favored Pre-proline 0 CA--C 1.589 2.444 0 N-CA-C 103.756 -2.683 . . . . 2.0 103.756 179.649 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 33' ' ' PRO . . . . . . . . . . . . . 6.1 Cg_exo -71.42 144.68 46.06 Favored 'Trans proline' 0 CA--C 1.565 2.06 0 N-CA-C 118.214 2.351 . . . . 2.0 118.214 -179.764 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 34' ' ' VAL . . . . . . . . . . . . 0.314 14.3 m -98.0 -14.65 7.69 Favored 'Isoleucine or valine' 0 N--CA 1.508 2.459 0 N-CA-C 113.762 1.023 . . . . 2.0 113.762 179.456 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 35' ' ' LYS . . . . . 0.439 ' HB2' ' SD ' ' A' ' 24' ' ' MET 0.276 3.1 tmtt? -161.93 155.45 21.14 Favored 'General case' 0 CA--C 1.568 1.658 0 C-N-CA 126.332 1.853 . . . . 2.0 108.623 179.472 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 36' ' ' ARG . . . . . . . . . . . . 0.305 13.1 ttp180 -140.64 105.52 4.95 Favored 'General case' 0 CA--C 1.581 2.154 0 N-CA-C 103.024 -2.954 . . . . 2.0 103.024 -180.0 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . -134.14 -139.96 4.22 Favored Glycine 0 N--CA 1.502 3.066 0 N-CA-C 121.622 3.409 . . . . 2.0 121.622 -179.502 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 38' ' ' CYS . . . . . . . . . . . . . 0.8 OUTLIER -135.24 142.4 45.96 Favored 'General case' 0 N--CA 1.498 1.967 0 N-CA-C 113.645 0.98 . . . . 2.0 113.645 -179.971 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 39' ' ' ILE . . . . . 0.502 HG21 ' HD3' ' A' ' 43' ' ' PRO . 8.2 tp -166.57 171.36 0.21 Allowed 'Isoleucine or valine' 0 N--CA 1.507 2.4 0 O-C-N 120.777 -1.202 . . . . 2.0 114.085 -179.623 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 40' ' ' ASP . . . . . . . . . . . . . 20.6 m-20 -87.46 -52.67 5.23 Favored 'General case' 0 CA--C 1.577 1.992 0 O-C-N 120.131 -1.606 . . . . 2.0 112.163 179.364 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 95.7 t -132.8 39.58 0.7 Allowed 'Isoleucine or valine' 0 N--CA 1.51 2.537 0 N-CA-C 114.131 1.16 . . . . 2.0 114.131 -179.624 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 42' ' ' CYS . . . . . . . . . . . . 0.257 2.5 m 73.28 114.89 0.03 OUTLIER Pre-proline 0 N--CA 1.515 2.818 0 N-CA-C 103.278 -2.86 . . . . 2.0 103.278 -179.579 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 43' ' ' PRO . . . . . 0.502 ' HD3' HG21 ' A' ' 39' ' ' ILE . 12.7 Cg_exo -58.7 170.58 2.5 Favored 'Trans proline' 0 C--N 1.373 1.844 0 CA-C-N 127.039 3.549 . . . . 2.0 118.796 -179.318 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 56.4 mtmt -64.45 99.11 0.28 Allowed 'General case' 0 CA--C 1.574 1.887 0 CA-C-O 123.558 1.647 . . . . 2.0 108.023 179.719 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 45' ' ' ASN . . . . . . . . . . . . 0.276 4.0 p-10 -71.89 -157.87 0.04 OUTLIER 'General case' 0 CA--C 1.569 1.702 0 N-CA-C 118.215 2.672 . . . . 2.0 118.215 -179.555 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 46' ' ' SER . . . . . . . . . . . . 0.315 6.3 t 78.11 -43.46 0.38 Allowed 'General case' 0 N--CA 1.489 1.48 0 N-CA-C 117.519 2.414 . . . . 2.0 117.519 179.945 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 47' ' ' LEU . . . . . . . . . . . . . 2.6 pp -47.6 -49.83 25.84 Favored 'General case' 0 N--CA 1.507 2.417 0 CA-C-N 120.348 1.431 . . . . 2.0 113.264 179.643 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 90.3 mt -156.34 25.68 0.35 Allowed 'General case' 0 CA--C 1.586 2.335 0 C-N-CA 126.947 2.099 . . . . 2.0 109.031 179.434 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 49' ' ' VAL . . . . . . . . . . . . . 3.7 p -168.07 171.24 0.18 Allowed 'Isoleucine or valine' 0 CA--C 1.587 2.38 0 N-CA-C 119.425 3.12 . . . . 2.0 119.425 -178.902 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 23.1 ttpt -151.62 75.1 1.15 Allowed 'General case' 0 CA--C 1.583 2.245 0 N-CA-C 101.501 -3.518 . . . . 2.0 101.501 178.954 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 99.0 m-85 -51.37 131.85 28.9 Favored 'General case' 0 CA--C 1.565 1.531 1 N-CA-C 123.17 4.507 . . . . 2.0 123.17 -179.241 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 52' ' ' VAL . . . . . . . . . . . . . 7.0 t -100.46 139.92 20.72 Favored 'Isoleucine or valine' 0 CA--C 1.577 2.018 1 N-CA-C 99.297 -4.334 . . . . 2.0 99.297 179.023 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 53' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -145.45 143.68 30.17 Favored 'General case' 0 CA--C 1.568 1.643 0 O-C-N 118.509 -2.619 . . . . 2.0 115.683 -179.148 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 54' ' ' CYS . . . . . . . . . . . . . 25.7 p -126.78 120.46 29.39 Favored 'General case' 0 CA--C 1.572 1.821 0 C-N-CA 123.448 0.699 . . . . 2.0 110.314 179.905 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 9.0 m120 -51.27 6.81 0.0 OUTLIER 'General case' 0 N--CA 1.506 2.367 1 N-CA-C 125.471 5.36 . . . . 2.0 125.471 -179.506 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 56' ' ' THR . . . . . . . . . . . . 0.252 5.5 t -137.6 175.98 9.12 Favored 'General case' 0 N--CA 1.504 2.233 0 CA-C-N 123.31 2.777 . . . . 2.0 117.315 -179.758 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 57' ' ' ASP . . . . . . . . . . . . . 38.1 m-20 -61.4 116.2 4.47 Favored 'General case' 0 N--CA 1.487 1.415 0 N-CA-C 115.366 1.617 . . . . 2.0 115.366 -179.931 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 58' ' ' ARG . . . . . . . . . . . . 0.315 38.2 mtp180 62.37 21.26 12.43 Favored 'General case' 0 CA--C 1.578 2.046 0 N-CA-C 117.999 2.592 . . . . 2.0 117.999 -179.969 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 59' ' ' CYS . . . . . . . . . . . . . 29.1 p -72.96 -24.7 60.82 Favored 'General case' 0 CA--C 1.573 1.862 0 N-CA-C 116.816 2.154 . . . . 2.0 116.816 179.829 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 60' ' ' ASN . . . . . . . . . . . . . 41.2 p-10 . . . . . 0 CA--C 1.56 1.334 0 CA-C-O 124.161 1.934 . . . . 2.0 112.229 179.849 . . . . . . . . 0 0 . 1 . 005 nuclear build full ' A' A ' 1' ' ' LEU . . . . . 0.438 HD23 ' SG ' ' A' ' 3' ' ' CYS . 6.0 tp . . . . . 0 CA--C 1.57 1.721 0 N-CA-C 113.497 0.925 . . . . 2.0 113.497 . . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -85.66 137.36 32.89 Favored 'General case' 0 CA--C 1.571 1.779 0 N-CA-C 107.886 -1.153 . . . . 2.0 107.886 179.711 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 3' ' ' CYS . . . . . 0.438 ' SG ' HD23 ' A' ' 1' ' ' LEU . 88.2 m -139.59 167.38 22.23 Favored 'General case' 0 N--CA 1.494 1.772 0 O-C-N 119.653 -1.904 . . . . 2.0 114.216 -179.89 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 69.4 m-80 -111.36 138.28 48.04 Favored 'General case' 0 CA--C 1.563 1.48 0 N-CA-C 116.969 2.211 . . . . 2.0 116.969 -179.858 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 5' ' ' LYS . . . . . 0.402 ' H ' ' HB1' ' A' ' 10' ' ' ALA 0.26 14.8 ptpt -87.56 172.17 9.95 Favored 'General case' 0 CA--C 1.587 2.396 0 CA-C-N 120.223 1.374 . . . . 2.0 107.481 178.912 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 1.5 mm? -39.98 -49.34 2.48 Favored 'General case' 0 N--CA 1.506 2.369 0 N-CA-C 120.897 3.665 . . . . 2.0 120.897 -179.835 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 7' ' ' ILE . . . . . . . . . . . . . 21.5 mt -73.7 147.11 86.5 Favored Pre-proline 0 CA--C 1.585 2.325 0 N-CA-C 114.2 1.185 . . . . 2.0 114.2 -179.79 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 70.6 Cg_exo -44.79 -45.54 13.53 Favored 'Trans proline' 0 CA--C 1.567 2.164 0 N-CA-C 119.864 2.986 . . . . 2.0 119.864 179.827 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 9' ' ' ILE . . . . . . . . . . . . 0.297 0.2 OUTLIER -59.37 -46.96 92.15 Favored 'Isoleucine or valine' 0 N--CA 1.514 2.726 0 CA-C-N 120.571 1.532 . . . . 2.0 112.356 179.611 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 10' ' ' ALA . . . . . 0.402 ' HB1' ' H ' ' A' ' 5' ' ' LYS . . . 55.97 159.2 0.01 OUTLIER 'General case' 0 CA--C 1.578 2.032 1 N-CA-C 123.918 4.784 . . . . 2.0 123.918 179.345 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 8.2 t -66.3 -174.31 0.26 Allowed 'General case' 0 CA--C 1.58 2.103 0 N-CA-C 117.763 2.505 . . . . 2.0 117.763 -179.902 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . 0.309 50.4 tptt -98.23 -90.56 0.28 Allowed 'General case' 0 CA--C 1.572 1.801 1 N-CA-C 123.304 4.557 . . . . 2.0 123.304 -179.485 . . . . . . . . 3 2 . 1 . 005 nuclear build full ' A' A ' 13' ' ' THR . . . . . . . . . . . . . 8.4 t -156.92 170.81 21.64 Favored 'General case' 0 N--CA 1.506 2.351 0 N-CA-C 120.108 3.373 . . . . 2.0 120.108 -179.143 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 14' ' ' CYS . . . . . . . . . . . . 0.419 0.5 OUTLIER -146.4 168.44 11.59 Favored Pre-proline 0 CA--C 1.6 2.902 0 C-N-CA 126.104 1.761 . . . . 2.0 108.713 179.215 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 15' ' ' PRO . . . . . . . . . . . . . 92.2 Cg_exo -45.07 171.37 0.02 OUTLIER 'Trans proline' 0 CA--C 1.571 2.347 1 N-CA-C 128.673 6.374 . . . . 2.0 128.673 -179.488 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -78.72 165.36 23.69 Favored 'General case' 0 N--CA 1.499 1.986 0 N-CA-C 104.506 -2.405 . . . . 2.0 104.506 178.944 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . 85.34 -47.94 3.93 Favored Glycine 1 N--CA 1.524 4.512 0 O-C-N 117.082 -3.511 . . . . 2.0 105.37 -178.642 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 39.9 mmtm -83.3 63.78 7.42 Favored 'General case' 0 CA--C 1.604 3.031 1 N-CA-C 99.939 -4.097 . . . . 2.0 99.939 178.493 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 37.3 p-10 -80.85 -20.49 42.23 Favored 'General case' 0 N--CA 1.483 1.18 0 N-CA-C 121.527 3.899 . . . . 2.0 121.527 -179.261 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 70.7 mt -88.59 112.95 23.64 Favored 'General case' 0 CA--C 1.555 1.136 0 CA-C-N 119.284 0.947 . . . . 2.0 110.586 179.771 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 21' ' ' CYS . . . . . 0.425 ' SG ' HD21 ' A' ' 1' ' ' LEU . 1.7 m -79.91 95.4 6.08 Favored 'General case' 0 CA--C 1.576 1.947 0 N-CA-C 100.389 -3.93 . . . . 2.0 100.389 179.257 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 22' ' ' TYR . . . . . . . . . . . . 0.266 0.0 OUTLIER -76.14 154.72 35.24 Favored 'General case' 0 CA--C 1.552 1.054 0 N-CA-C 121.008 3.707 . . . . 2.0 121.008 -179.35 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 31.8 mtmt -117.73 92.2 3.77 Favored 'General case' 0 CA--C 1.559 1.317 1 N-CA-C 99.626 -4.212 . . . . 2.0 99.626 179.311 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 24' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -71.13 72.97 0.63 Allowed 'General case' 0 CA--C 1.578 2.027 0 C-N-CA 124.374 1.07 . . . . 2.0 108.719 179.912 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 25' ' ' PHE . . . . . . . . . . . . . 9.6 m-30 -62.1 133.23 54.99 Favored 'General case' 0 N--CA 1.486 1.367 0 O-C-N 120.709 -1.245 . . . . 2.0 113.152 -179.856 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 26' ' ' MET . . . . . . . . . . . . . 34.4 mtp -64.48 131.2 46.44 Favored 'General case' 0 N--CA 1.489 1.503 0 N-CA-C 113.131 0.789 . . . . 2.0 113.131 -179.995 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 27' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -54.22 -38.83 66.15 Favored 'General case' 0 N--CA 1.514 2.731 0 CA-C-N 120.779 1.627 . . . . 2.0 112.164 179.461 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 50.4 m -79.73 -32.52 41.15 Favored 'General case' 0 CA--C 1.586 2.337 0 N-CA-C 114.062 1.134 . . . . 2.0 114.062 179.418 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 52.7 t0 -146.86 84.31 1.6 Allowed 'General case' 0 CA--C 1.573 1.85 0 O-C-N 120.599 -1.313 . . . . 2.0 109.723 179.871 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 1.6 mm? -51.18 -67.52 0.24 Allowed 'General case' 0 CA--C 1.576 1.972 0 N-CA-C 120.763 3.616 . . . . 2.0 120.763 -179.496 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 31' ' ' THR . . . . . . . . . . . . 0.337 15.3 t -19.22 -61.97 0.02 OUTLIER 'General case' 0 N--CA 1.51 2.538 1 N-CA-C 121.825 4.009 . . . . 2.0 121.825 -179.793 . . . . . . . . 3 2 . 1 . 005 nuclear build full ' A' A ' 32' ' ' ILE . . . . . . . . . . . . . 1.8 mp -100.71 103.68 26.02 Favored Pre-proline 0 CA--C 1.589 2.468 1 N-CA-C 99.661 -4.2 . . . . 2.0 99.661 179.577 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 33' ' ' PRO . . . . . . . . . . . . . 14.5 Cg_endo -62.8 171.1 6.28 Favored 'Trans proline' 0 CA--C 1.561 1.862 1 N-CA-C 123.372 4.335 . . . . 2.0 123.372 -179.512 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 34' ' ' VAL . . . . . . . . . . . . . 97.8 t -73.66 -55.57 12.05 Favored 'Isoleucine or valine' 0 CA--C 1.59 2.49 0 N-CA-C 104.467 -2.42 . . . . 2.0 104.467 178.963 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 36.7 tttm -136.35 162.17 33.75 Favored 'General case' 0 CA--C 1.564 1.496 0 CA-C-O 124.449 2.071 . . . . 2.0 108.963 179.601 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 36' ' ' ARG . . . . . . . . . . . . 0.346 40.2 ttp180 -138.26 108.61 6.49 Favored 'General case' 0 CA--C 1.574 1.866 1 N-CA-C 98.495 -4.631 . . . . 2.0 98.495 179.533 . . . . . . . . 3 2 . 1 . 005 nuclear build full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . -145.04 -147.77 4.7 Favored Glycine 0 N--CA 1.489 2.21 0 O-C-N 119.053 -2.279 . . . . 2.0 118.387 -179.56 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 38' ' ' CYS . . . . . . . . . . . . . 19.1 p -115.47 137.51 51.98 Favored 'General case' 0 CA--C 1.562 1.421 0 C-N-CA 123.723 0.809 . . . . 2.0 111.587 179.959 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 39' ' ' ILE . . . . . . . . . . . . . 3.4 tp -160.23 166.12 0.73 Allowed 'Isoleucine or valine' 0 N--CA 1.495 1.809 0 O-C-N 120.879 -1.138 . . . . 2.0 113.838 -179.906 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 40' ' ' ASP . . . . . . . . . . . . . 9.6 p30 -80.87 -102.05 0.03 OUTLIER 'General case' 0 N--CA 1.507 2.406 0 N-CA-C 103.736 -2.69 . . . . 2.0 103.736 179.435 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 87.7 t -85.98 162.12 2.87 Favored 'Isoleucine or valine' 0 CA--C 1.58 2.126 0 N-CA-C 104.595 -2.372 . . . . 2.0 104.595 178.982 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 42' ' ' CYS . . . . . . . . . . . . . 1.7 m -63.78 107.24 1.19 Allowed Pre-proline 0 CA--C 1.605 3.068 1 N-CA-C 100.007 -4.071 . . . . 2.0 100.007 179.554 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 43' ' ' PRO . . . . . . . . . . . . . 26.4 Cg_exo -50.37 -178.02 0.01 OUTLIER 'Trans proline' 0 C--N 1.372 1.791 1 N-CA-C 125.088 4.996 . . . . 2.0 125.088 -178.709 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 96.7 mttt -73.08 103.15 3.74 Favored 'General case' 0 CA--C 1.568 1.639 0 N-CA-C 104.187 -2.523 . . . . 2.0 104.187 179.386 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 45' ' ' ASN . . . . . . . . . . . . 0.25 2.0 p-10 -67.6 117.45 9.56 Favored 'General case' 0 CA--C 1.563 1.466 0 N-CA-C 117.174 2.287 . . . . 2.0 117.174 -179.358 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 14.9 t -82.73 179.27 7.83 Favored 'General case' 0 CA--C 1.565 1.54 0 N-CA-C 113.776 1.028 . . . . 2.0 113.776 179.962 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 47' ' ' LEU . . . . . . . . . . . . . 88.8 mt -51.55 -25.01 5.97 Favored 'General case' 0 N--CA 1.507 2.391 0 N-CA-C 116.424 2.009 . . . . 2.0 116.424 179.768 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 78.7 mt -102.51 7.33 40.2 Favored 'General case' 0 CA--C 1.579 2.093 0 C-N-CA 125.131 1.372 . . . . 2.0 114.636 179.591 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 49' ' ' VAL . . . . . . . . . . . . . 9.0 p -153.93 159.24 3.37 Favored 'Isoleucine or valine' 0 N--CA 1.502 2.13 0 N-CA-C 117.505 2.409 . . . . 2.0 117.505 -179.644 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER -153.78 78.47 1.13 Allowed 'General case' 0 CA--C 1.576 1.967 0 N-CA-C 102.752 -3.055 . . . . 2.0 102.752 179.343 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER -58.69 128.81 39.05 Favored 'General case' 0 CA--C 1.569 1.697 1 N-CA-C 122.7 4.333 . . . . 2.0 122.7 -179.341 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 52' ' ' VAL . . . . . . . . . . . . 0.284 14.1 t -103.13 151.88 6.11 Favored 'Isoleucine or valine' 0 CA--C 1.578 2.047 0 N-CA-C 102.107 -3.294 . . . . 2.0 102.107 179.047 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 53' ' ' CYS . . . . . . . . . . . . 0.261 0.8 OUTLIER -147.5 160.82 42.17 Favored 'General case' 0 CA--C 1.568 1.65 0 N-CA-C 119.178 3.029 . . . . 2.0 119.178 -179.026 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 54' ' ' CYS . . . . . . . . . . . . . 29.0 p -143.34 120.69 11.61 Favored 'General case' 0 CA--C 1.574 1.895 0 C-N-CA 123.928 0.891 . . . . 2.0 110.342 179.78 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 14.8 m120 -55.45 12.01 0.0 OUTLIER 'General case' 0 N--CA 1.508 2.467 1 N-CA-C 124.518 5.007 . . . . 2.0 124.518 -179.674 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 56' ' ' THR . . . . . . . . . . . . 0.274 4.9 t -138.26 177.82 7.59 Favored 'General case' 0 N--CA 1.502 2.134 0 CA-C-N 123.077 2.671 . . . . 2.0 116.794 -179.839 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 57' ' ' ASP . . . . . . . . . . . . . 69.9 m-20 -65.11 120.76 13.27 Favored 'General case' 0 CA--C 1.565 1.541 0 N-CA-C 115.779 1.77 . . . . 2.0 115.779 -179.755 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 58' ' ' ARG . . . . . . . . . . . . . 10.7 mmm180 56.45 31.19 18.39 Favored 'General case' 0 CA--C 1.586 2.348 0 N-CA-C 115.193 1.553 . . . . 2.0 115.193 -179.919 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 59' ' ' CYS . . . . . . . . . . . . . 29.7 p -83.77 -21.13 32.3 Favored 'General case' 0 N--CA 1.495 1.813 0 N-CA-C 116.432 2.012 . . . . 2.0 116.432 179.848 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 60' ' ' ASN . . . . . . . . . . . . . 25.3 p-10 . . . . . 0 CA--C 1.56 1.34 0 CA-C-O 124.967 2.318 . . . . 2.0 113.079 179.886 . . . . . . . . 0 0 . 1 . 006 nuclear build full ' A' A ' 1' ' ' LEU . . . . . 0.603 HD13 ' SG ' ' A' ' 3' ' ' CYS . 0.7 OUTLIER . . . . . 0 CA--C 1.576 1.944 0 CA-C-O 123.257 1.503 . . . . 2.0 113.785 . . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 1.6 mptp? -151.87 108.41 3.47 Favored 'General case' 0 CA--C 1.565 1.523 0 N-CA-C 101.15 -3.648 . . . . 2.0 101.15 179.631 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 3' ' ' CYS . . . . . 0.603 ' SG ' HD13 ' A' ' 1' ' ' LEU . 90.7 m -114.01 -168.38 1.35 Allowed 'General case' 0 N--CA 1.499 1.979 0 CA-C-N 122.131 2.241 . . . . 2.0 115.941 -179.926 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 80.4 m-20 -139.4 113.35 8.68 Favored 'General case' 0 CA--C 1.56 1.329 0 C-N-CA 123.843 0.857 . . . . 2.0 110.547 179.911 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 5' ' ' LYS . . . . . 0.429 ' H ' ' HB1' ' A' ' 10' ' ' ALA . 0.3 OUTLIER -66.74 -179.03 0.8 Allowed 'General case' 0 CA--C 1.583 2.243 0 CA-C-N 121.202 1.819 . . . . 2.0 111.44 179.416 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -45.03 -41.87 7.9 Favored 'General case' 0 N--CA 1.509 2.493 0 N-CA-C 120.86 3.652 . . . . 2.0 120.86 -179.704 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 7' ' ' ILE . . . . . . . . . . . . . 38.5 mt -57.03 144.13 69.74 Favored Pre-proline 0 CA--C 1.586 2.348 0 C-N-CA 124.602 1.161 . . . . 2.0 113.53 179.861 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 90.1 Cg_exo -46.48 -42.6 22.99 Favored 'Trans proline' 0 CA--C 1.572 2.382 0 N-CA-C 118.901 2.616 . . . . 2.0 118.901 179.828 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 9' ' ' ILE . . . . . . . . . . . . 0.264 9.5 pt -88.37 -67.49 0.73 Allowed 'Isoleucine or valine' 0 N--CA 1.499 2.018 0 C-N-CA 123.799 0.84 . . . . 2.0 112.125 179.669 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 10' ' ' ALA . . . . . 0.429 ' HB1' ' H ' ' A' ' 5' ' ' LYS 0.259 . . 63.61 166.45 0.14 Allowed 'General case' 0 CA--C 1.581 2.166 0 N-CA-C 120.149 3.388 . . . . 2.0 120.149 179.818 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 15.8 t -87.01 149.86 24.46 Favored 'General case' 0 N--CA 1.495 1.819 0 O-C-N 121.099 -1.0 . . . . 2.0 113.437 179.984 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 12' ' ' LYS . . . . . 0.416 ' HG3' ' H ' ' A' ' 13' ' ' THR 0.388 9.0 ptpp? -84.21 -98.03 0.06 Allowed 'General case' 0 CA--C 1.584 2.287 1 N-CA-C 123.523 4.638 . . . . 2.0 123.523 -179.431 . . . . . . . . 4 3 . 1 . 006 nuclear build full ' A' A ' 13' ' ' THR . . . . . 0.416 ' H ' ' HG3' ' A' ' 12' ' ' LYS . 35.7 m -22.58 129.56 0.02 OUTLIER 'General case' 0 N--CA 1.505 2.285 1 N-CA-C 123.494 4.627 . . . . 2.0 123.494 -179.558 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 52.9 t -156.34 146.05 15.47 Favored Pre-proline 0 CA--C 1.594 2.665 0 C-N-CA 125.525 1.53 . . . . 2.0 110.095 179.72 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 15' ' ' PRO . . . . . . . . . . . . . 44.2 Cg_exo -47.76 169.91 0.06 OUTLIER 'Trans proline' 0 CA--C 1.576 2.606 1 N-CA-C 126.042 5.362 . . . . 2.0 126.042 -179.836 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -78.02 165.77 23.64 Favored 'General case' 0 N--CA 1.496 1.865 0 C-N-CA 124.8 1.24 . . . . 2.0 110.236 179.532 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . 82.86 -48.37 4.0 Favored Glycine 1 N--CA 1.517 4.039 0 O-C-N 119.049 -2.282 . . . . 2.0 109.256 -179.106 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 35.7 mmtm -77.34 91.99 3.88 Favored 'General case' 0 CA--C 1.573 1.858 0 N-CA-C 101.953 -3.351 . . . . 2.0 101.953 179.262 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 9.9 p30 -98.38 -27.23 14.19 Favored 'General case' 0 N--CA 1.491 1.612 0 N-CA-C 117.369 2.359 . . . . 2.0 117.369 -179.85 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 76.6 mt -83.7 114.12 21.35 Favored 'General case' 0 CA--C 1.557 1.233 0 N-CA-C 116.148 1.907 . . . . 2.0 116.148 -179.849 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 21' ' ' CYS . . . . . 0.441 ' SG ' HD22 ' A' ' 1' ' ' LEU . 5.2 m -84.45 91.44 7.83 Favored 'General case' 0 CA--C 1.578 2.031 1 N-CA-C 99.989 -4.078 . . . . 2.0 99.989 179.152 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 22' ' ' TYR . . . . . . . . . . . . . 8.1 p90 -75.47 158.89 31.98 Favored 'General case' 0 CA--C 1.552 1.036 0 N-CA-C 120.461 3.504 . . . . 2.0 120.461 -179.311 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 19.0 ptpt -133.21 101.55 5.24 Favored 'General case' 0 CA--C 1.562 1.406 0 N-CA-C 104.952 -2.24 . . . . 2.0 104.952 179.491 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 24' ' ' MET . . . . . . . . . . . . . 0.1 OUTLIER -68.81 86.92 0.34 Allowed 'General case' 0 N--CA 1.485 1.285 0 C-N-CA 125.438 1.495 . . . . 2.0 112.542 179.949 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 25' ' ' PHE . . . . . . . . . . . . . 8.2 m-30 -78.28 108.33 11.54 Favored 'General case' 0 CA--C 1.563 1.444 0 N-CA-C 104.601 -2.37 . . . . 2.0 104.601 179.568 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 26' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -58.27 128.5 37.43 Favored 'General case' 0 CA--C 1.57 1.712 0 CA-C-O 117.869 -1.062 . . . . 2.0 110.806 179.999 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 27' ' ' MET . . . . . . . . . . . . . 31.0 mtp -41.59 -36.73 0.98 Allowed 'General case' 0 N--CA 1.51 2.54 0 N-CA-C 117.949 2.574 . . . . 2.0 117.949 -179.891 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 67.3 m -89.23 -32.57 17.36 Favored 'General case' 0 CA--C 1.588 2.424 0 C-N-CA 124.189 0.996 . . . . 2.0 112.151 179.293 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 15.9 m-20 -130.44 87.61 2.53 Favored 'General case' 0 CA--C 1.576 1.945 0 O-C-N 119.424 -2.047 . . . . 2.0 105.592 179.748 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 1.5 mm? -74.26 -75.22 0.16 Allowed 'General case' 0 CA--C 1.578 2.022 0 N-CA-C 119.652 3.205 . . . . 2.0 119.652 -179.528 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 31' ' ' THR . . . . . . . . . . . . 0.257 80.7 p -17.92 -68.27 0.02 OUTLIER 'General case' 0 N--CA 1.508 2.47 0 N-CA-C 121.065 3.728 . . . . 2.0 121.065 -179.588 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 32' ' ' ILE . . . . . . . . . . . . . 1.9 mp -90.79 108.02 24.68 Favored Pre-proline 0 CA--C 1.585 2.315 1 N-CA-C 99.714 -4.18 . . . . 2.0 99.714 179.503 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 33' ' ' PRO . . . . . . . . . . . . . 43.1 Cg_endo -61.7 162.85 20.19 Favored 'Trans proline' 0 CA--C 1.56 1.787 0 N-CA-C 119.012 2.659 . . . . 2.0 119.012 -179.659 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 34' ' ' VAL . . . . . . . . . . . . . 14.2 t -88.19 -47.74 15.35 Favored 'Isoleucine or valine' 0 N--CA 1.503 2.2 0 N-CA-C 107.011 -1.477 . . . . 2.0 107.011 179.148 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 4.6 tptp -124.78 155.27 39.63 Favored 'General case' 0 CA--C 1.564 1.505 0 CA-C-O 124.159 1.933 . . . . 2.0 108.559 179.605 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 2.9 mtp180 -141.74 110.85 6.29 Favored 'General case' 0 CA--C 1.566 1.576 0 N-CA-C 100.495 -3.891 . . . . 2.0 100.495 179.782 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . -141.94 -152.74 5.77 Favored Glycine 0 N--CA 1.487 2.035 0 N-CA-C 118.8 2.28 . . . . 2.0 118.8 -179.7 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 38' ' ' CYS . . . . . 0.42 ' HB3' ' SG ' ' A' ' 3' ' ' CYS . 25.7 p -127.66 126.69 42.43 Favored 'General case' 0 CA--C 1.562 1.441 0 C-N-CA 123.581 0.752 . . . . 2.0 112.401 179.902 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 39' ' ' ILE . . . . . 0.424 HG21 ' HD3' ' A' ' 43' ' ' PRO . 8.2 tp -147.81 179.22 0.8 Allowed 'Isoleucine or valine' 0 N--CA 1.497 1.878 0 C-N-CA 124.007 0.923 . . . . 2.0 112.858 -179.702 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 40' ' ' ASP . . . . . 0.412 ' H ' HG13 ' A' ' 39' ' ' ILE . 18.0 p-10 -102.91 -43.86 5.41 Favored 'General case' 0 CA--C 1.569 1.702 0 O-C-N 120.267 -1.521 . . . . 2.0 113.539 179.707 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 4.3 t -137.2 35.94 0.56 Allowed 'Isoleucine or valine' 0 N--CA 1.509 2.496 0 CA-C-N 120.086 1.312 . . . . 2.0 112.459 179.975 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 42' ' ' CYS . . . . . . . . . . . . 0.349 2.7 m 75.31 122.03 0.03 OUTLIER Pre-proline 0 CA--C 1.614 3.415 1 N-CA-C 99.919 -4.104 . . . . 2.0 99.919 -179.26 . . . . . . . . 3 2 . 1 . 006 nuclear build full ' A' A ' 43' ' ' PRO . . . . . 0.424 ' HD3' HG21 ' A' ' 39' ' ' ILE . 27.4 Cg_exo -55.01 -4.08 0.34 Allowed 'Trans proline' 0 N--CA 1.503 2.077 1 N-CA-C 129.512 6.697 . . . . 2.0 129.512 -178.851 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . 0.331 69.3 mttt 110.1 104.66 0.0 OUTLIER 'General case' 0 N--CA 1.494 1.738 0 N-CA-C 100.685 -3.82 . . . . 2.0 100.685 -179.446 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 45' ' ' ASN . . . . . . . . . . . . . 4.0 p-10 -72.77 101.34 3.08 Favored 'General case' 0 CA--C 1.566 1.592 0 N-CA-C 116.449 2.018 . . . . 2.0 116.449 -179.393 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 14.1 t -81.64 178.43 8.34 Favored 'General case' 0 CA--C 1.567 1.625 0 N-CA-C 113.245 0.832 . . . . 2.0 113.245 179.888 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 47' ' ' LEU . . . . . . . . . . . . 0.392 3.4 pp -57.3 -12.78 2.64 Favored 'General case' 0 N--CA 1.508 2.466 0 N-CA-C 117.072 2.249 . . . . 2.0 117.072 179.729 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 77.3 mt -106.61 4.22 27.75 Favored 'General case' 0 CA--C 1.584 2.253 0 C-N-CA 125.549 1.54 . . . . 2.0 111.867 179.209 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 49' ' ' VAL . . . . . . . . . . . . . 14.4 p -157.44 149.33 9.78 Favored 'Isoleucine or valine' 0 N--CA 1.501 2.11 0 CA-C-N 123.378 2.808 . . . . 2.0 116.988 -179.604 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 17.3 ttpt -141.51 73.18 1.41 Allowed 'General case' 0 CA--C 1.58 2.112 0 N-CA-C 104.173 -2.529 . . . . 2.0 104.173 179.539 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER -59.85 130.15 45.35 Favored 'General case' 0 N--CA 1.494 1.755 0 N-CA-C 120.819 3.637 . . . . 2.0 120.819 -179.367 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 52' ' ' VAL . . . . . . . . . . . . . 18.7 t -99.69 121.17 50.04 Favored 'Isoleucine or valine' 0 CA--C 1.574 1.891 1 N-CA-C 100.091 -4.04 . . . . 2.0 100.091 179.244 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 53' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -121.42 135.57 55.05 Favored 'General case' 0 CA--C 1.574 1.896 0 N-CA-C 117.715 2.487 . . . . 2.0 117.715 -179.198 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 54' ' ' CYS . . . . . . . . . . . . . 31.2 p -118.17 120.14 36.81 Favored 'General case' 0 N--CA 1.495 1.788 0 C-N-CA 124.112 0.965 . . . . 2.0 111.96 179.835 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 25.0 p-10 -63.06 40.5 0.01 OUTLIER 'General case' 0 N--CA 1.506 2.36 1 N-CA-C 123.028 4.455 . . . . 2.0 123.028 -179.509 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 5.9 t -155.16 172.57 17.92 Favored 'General case' 0 N--CA 1.497 1.911 0 O-C-N 119.656 -1.902 . . . . 2.0 113.999 179.946 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 57' ' ' ASP . . . . . . . . . . . . . 85.5 m-20 -67.46 122.44 17.97 Favored 'General case' 0 CA--C 1.568 1.648 0 N-CA-C 116.538 2.051 . . . . 2.0 116.538 -179.851 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 58' ' ' ARG . . . . . . . . . . . . 0.254 37.5 mtm105 56.35 28.81 14.03 Favored 'General case' 0 CA--C 1.574 1.901 0 N-CA-C 117.935 2.568 . . . . 2.0 117.935 179.802 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 59' ' ' CYS . . . . . . . . . . . . . 30.2 p -86.14 14.63 6.07 Favored 'General case' 0 CA--C 1.579 2.074 0 N-CA-C 117.191 2.293 . . . . 2.0 117.191 179.893 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 60' ' ' ASN . . . . . . . . . . . . . 35.7 p-10 . . . . . 0 CA--C 1.561 1.369 0 CA-C-O 124.012 1.863 . . . . 2.0 112.541 -179.948 . . . . . . . . 0 0 . 1 . 007 nuclear build full ' A' A ' 1' ' ' LEU . . . . . 0.514 HD21 ' SG ' ' A' ' 3' ' ' CYS . 6.7 tt . . . . . 0 N--CA 1.502 2.175 0 CA-C-O 116.779 -1.581 . . . . 2.0 110.926 . . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 26.3 tttp -111.62 -47.31 3.17 Favored 'General case' 0 N--CA 1.521 3.08 0 CA-C-N 122.72 2.509 . . . . 2.0 113.798 -179.831 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 3' ' ' CYS . . . . . 0.514 ' SG ' HD21 ' A' ' 1' ' ' LEU 0.454 1.9 m 83.09 -136.65 0.01 OUTLIER 'General case' 0 CA--C 1.564 1.518 0 N-CA-C 119.483 3.142 . . . . 2.0 119.483 179.786 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 35.7 m-20 -131.67 131.54 43.21 Favored 'General case' 0 N--CA 1.484 1.242 0 N-CA-C 116.363 1.986 . . . . 2.0 116.363 -179.448 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 19.8 ptmt -76.11 -164.35 0.37 Allowed 'General case' 0 N--CA 1.501 2.077 0 CA-C-N 119.746 1.157 . . . . 2.0 108.398 179.193 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 4.5 mm? -52.65 -30.54 32.25 Favored 'General case' 0 N--CA 1.514 2.753 0 O-C-N 117.617 -3.177 . . . . 2.0 114.586 179.666 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 7' ' ' ILE . . . . . . . . . . . . . 51.2 mm -66.72 132.76 94.05 Favored Pre-proline 0 CA--C 1.587 2.365 0 C-N-CA 125.356 1.462 . . . . 2.0 109.784 179.562 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . 0.314 20.5 Cg_exo -18.61 -71.76 0.02 OUTLIER 'Trans proline' 0 CA--C 1.568 2.225 1 N-CA-C 123.136 4.244 . . . . 2.0 123.136 -179.859 . . . . . . . . 3 2 . 1 . 007 nuclear build full ' A' A ' 9' ' ' ILE . . . . . . . . . . . . . 17.2 tt -135.37 73.12 0.36 Allowed 'Isoleucine or valine' 0 N--CA 1.503 2.191 0 CA-C-O 122.183 0.992 . . . . 2.0 109.15 179.966 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . 0.359 . . -71.46 -101.11 0.01 OUTLIER 'General case' 0 CA--C 1.583 2.223 1 N-CA-C 125.576 5.399 . . . . 2.0 125.576 -179.433 . . . . . . . . 3 2 . 1 . 007 nuclear build full ' A' A ' 11' ' ' SER . . . . . . . . . . . . 0.253 4.9 t -63.21 -169.76 0.03 OUTLIER 'General case' 0 CA--C 1.581 2.154 1 N-CA-C 123.356 4.576 . . . . 2.0 123.356 -179.255 . . . . . . . . 3 2 . 1 . 007 nuclear build full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 6.7 tptp -132.19 -79.55 0.5 Allowed 'General case' 0 CA--C 1.582 2.191 0 N-CA-C 118.921 2.934 . . . . 2.0 118.921 -179.788 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 13' ' ' THR . . . . . . . . . . . . . 8.1 t -134.15 118.5 17.75 Favored 'General case' 0 N--CA 1.511 2.583 0 N-CA-C 120.286 3.439 . . . . 2.0 120.286 -179.615 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 14' ' ' CYS . . . . . 0.581 ' SG ' ' HD2' ' A' ' 18' ' ' LYS . 0.5 OUTLIER -101.56 179.86 0.93 Allowed Pre-proline 0 CA--C 1.596 2.74 0 C-N-CA 125.663 1.585 . . . . 2.0 110.555 179.604 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 15' ' ' PRO . . . . . . . . . . . . . 87.8 Cg_exo -51.26 177.05 0.04 OUTLIER 'Trans proline' 0 CA--C 1.572 2.406 1 N-CA-C 123.606 4.426 . . . . 2.0 123.606 -179.876 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 16' ' ' ALA . . . . . . . . . . . . 0.253 . . 19.06 -164.96 0.0 OUTLIER 'General case' 0 N--CA 1.5 2.075 1 N-CA-C 124.009 4.818 . . . . 2.0 124.009 179.768 . . . . . . . . 3 2 . 1 . 007 nuclear build full ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . -81.95 37.03 2.51 Favored Glycine 0 N--CA 1.502 3.059 0 O-C-N 119.886 -1.758 . . . . 2.0 113.636 179.503 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 18' ' ' LYS . . . . . 0.581 ' HD2' ' SG ' ' A' ' 14' ' ' CYS . 0.1 OUTLIER -83.51 82.26 8.37 Favored 'General case' 0 CA--C 1.563 1.469 0 C-N-CA 125.613 1.565 . . . . 2.0 106.886 179.937 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 8.5 p30 -69.34 -34.15 74.19 Favored 'General case' 0 CA--C 1.558 1.278 1 N-CA-C 122.715 4.339 . . . . 2.0 122.715 -179.542 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 49.4 mt -68.91 118.36 11.75 Favored 'General case' 0 CA--C 1.56 1.344 0 N-CA-C 115.951 1.834 . . . . 2.0 115.951 -179.844 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 21' ' ' CYS . . . . . 0.535 ' SG ' ' O ' ' A' ' 56' ' ' THR . 34.4 m -81.88 96.39 7.63 Favored 'General case' 0 CA--C 1.572 1.808 0 N-CA-C 103.143 -2.91 . . . . 2.0 103.143 179.304 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 22' ' ' TYR . . . . . . . . . . . . 0.4 0.0 OUTLIER -68.45 158.21 34.2 Favored 'General case' 0 CA--C 1.56 1.34 0 N-CA-C 119.716 3.228 . . . . 2.0 119.716 -179.515 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 29.4 mtmt -131.36 89.36 2.71 Favored 'General case' 0 CA--C 1.557 1.246 1 N-CA-C 99.664 -4.198 . . . . 2.0 99.664 179.466 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 24' ' ' MET . . . . . 0.45 ' HB3' ' H ' ' A' ' 35' ' ' LYS . 20.4 ttt -71.24 68.31 0.5 Allowed 'General case' 0 CA--C 1.571 1.755 0 O-C-N 121.171 -0.956 . . . . 2.0 111.688 -179.842 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 25' ' ' PHE . . . . . . . . . . . . . 11.3 m-30 -59.0 127.18 30.93 Favored 'General case' 0 N--CA 1.486 1.339 0 O-C-N 120.798 -1.189 . . . . 2.0 113.292 -179.932 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 26' ' ' MET . . . . . . . . . . . . . 84.5 mtp -59.95 128.77 38.51 Favored 'General case' 0 N--CA 1.493 1.689 0 CA-C-O 118.048 -0.977 . . . . 2.0 111.577 179.877 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 27' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -54.44 -35.99 63.56 Favored 'General case' 0 N--CA 1.511 2.604 0 CA-C-N 121.474 1.943 . . . . 2.0 112.529 179.62 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 75.6 m -83.96 -14.05 51.84 Favored 'General case' 0 CA--C 1.591 2.54 0 N-CA-C 114.525 1.305 . . . . 2.0 114.525 179.268 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -161.49 77.92 0.55 Allowed 'General case' 0 N--CA 1.499 2.023 0 O-C-N 119.408 -2.058 . . . . 2.0 108.302 179.855 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 2.4 mm? -46.32 -79.99 0.01 OUTLIER 'General case' 0 CA--C 1.576 1.944 1 N-CA-C 123.532 4.642 . . . . 2.0 123.532 -179.399 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 31' ' ' THR . . . . . . . . . . . . 0.337 14.6 t -19.75 -52.44 0.01 OUTLIER 'General case' 0 N--CA 1.508 2.453 1 N-CA-C 122.941 4.423 . . . . 2.0 122.941 -179.689 . . . . . . . . 3 2 . 1 . 007 nuclear build full ' A' A ' 32' ' ' ILE . . . . . . . . . . . . . 1.8 mp -97.86 106.94 37.36 Favored Pre-proline 0 CA--C 1.591 2.523 0 N-CA-C 101.617 -3.475 . . . . 2.0 101.617 179.545 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 33' ' ' PRO . . . . . . . . . . . . . 3.1 Cg_endo -65.3 167.47 16.47 Favored 'Trans proline' 0 CA--C 1.559 1.772 1 N-CA-C 122.63 4.05 . . . . 2.0 122.63 -179.659 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 34' ' ' VAL . . . . . . . . . . . . . 96.5 t -75.38 -53.37 16.26 Favored 'Isoleucine or valine' 0 CA--C 1.591 2.531 0 N-CA-C 104.546 -2.39 . . . . 2.0 104.546 178.965 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 35' ' ' LYS . . . . . 0.45 ' H ' ' HB3' ' A' ' 24' ' ' MET . 97.6 mttt -149.13 117.82 6.61 Favored 'General case' 0 CA--C 1.552 1.055 0 C-N-CA 125.494 1.518 . . . . 2.0 110.795 179.63 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 36' ' ' ARG . . . . . . . . . . . . 0.358 28.1 ttp180 -88.63 109.59 20.23 Favored 'General case' 0 CA--C 1.594 2.653 0 N-CA-C 101.715 -3.439 . . . . 2.0 101.715 179.689 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . -141.04 -135.81 3.22 Favored Glycine 0 N--CA 1.497 2.764 0 N-CA-C 121.264 3.266 . . . . 2.0 121.264 -179.28 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 38' ' ' CYS . . . . . . . . . . . . . 29.7 p -125.73 141.8 51.83 Favored 'General case' 0 N--CA 1.491 1.598 0 N-CA-C 116.116 1.895 . . . . 2.0 116.116 -179.826 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 39' ' ' ILE . . . . . 0.435 HG12 ' CG ' ' A' ' 43' ' ' PRO . 2.4 tp -164.73 166.69 0.51 Allowed 'Isoleucine or valine' 0 CA--C 1.574 1.881 0 N-CA-C 114.465 1.283 . . . . 2.0 114.465 -179.906 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 40' ' ' ASP . . . . . . . . . . . . . 8.0 p-10 -82.74 -51.51 7.62 Favored 'General case' 0 N--CA 1.505 2.289 0 O-C-N 119.868 -1.77 . . . . 2.0 113.402 179.536 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 87.7 t -133.72 143.28 39.16 Favored 'Isoleucine or valine' 0 CA--C 1.563 1.474 0 N-CA-C 102.271 -3.233 . . . . 2.0 102.271 179.677 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 42' ' ' CYS . . . . . . . . . . . . . 1.0 OUTLIER -57.69 105.41 0.53 Allowed Pre-proline 0 CA--C 1.602 2.967 0 N-CA-C 101.872 -3.381 . . . . 2.0 101.872 179.638 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 43' ' ' PRO . . . . . 0.435 ' CG ' HG12 ' A' ' 39' ' ' ILE . 39.8 Cg_exo -48.41 174.17 0.03 OUTLIER 'Trans proline' 0 C--N 1.371 1.755 1 N-CA-C 126.201 5.423 . . . . 2.0 126.201 -178.638 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 57.2 mttp -72.81 89.22 1.36 Allowed 'General case' 0 CA--C 1.568 1.648 0 CA-C-N 112.889 -1.96 . . . . 2.0 105.927 179.597 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 45' ' ' ASN . . . . . . . . . . . . . 4.1 p-10 -63.62 154.54 32.49 Favored 'General case' 0 CA--C 1.567 1.601 0 N-CA-C 117.301 2.334 . . . . 2.0 117.301 -179.614 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 22.5 t -123.33 -173.18 2.67 Favored 'General case' 0 N--CA 1.485 1.286 0 N-CA-C 113.802 1.038 . . . . 2.0 113.802 179.993 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 47' ' ' LEU . . . . . . . . . . . . 0.35 1.0 OUTLIER -56.7 -15.54 4.75 Favored 'General case' 0 N--CA 1.508 2.463 0 N-CA-C 116.338 1.977 . . . . 2.0 116.338 179.63 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 88.8 mt -101.95 -2.43 29.77 Favored 'General case' 0 CA--C 1.588 2.436 0 C-N-CA 125.986 1.714 . . . . 2.0 111.809 179.138 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 49' ' ' VAL . . . . . . . . . . . . . 11.2 p -154.23 165.37 1.37 Allowed 'Isoleucine or valine' 0 CA--C 1.583 2.236 0 N-CA-C 117.254 2.316 . . . . 2.0 117.254 -179.522 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 61.7 tttp -159.14 93.55 1.15 Allowed 'General case' 0 CA--C 1.573 1.829 1 N-CA-C 99.759 -4.163 . . . . 2.0 99.759 179.394 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 83.8 m-85 -72.41 124.01 24.25 Favored 'General case' 0 CA--C 1.568 1.673 0 N-CA-C 121.363 3.838 . . . . 2.0 121.363 -179.309 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 52' ' ' VAL . . . . . . . . . . . . 0.283 78.9 t -100.01 156.7 4.04 Favored 'Isoleucine or valine' 0 CA--C 1.585 2.307 0 N-CA-C 102.816 -3.031 . . . . 2.0 102.816 179.101 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 53' ' ' CYS . . . . . . . . . . . . 0.324 1.4 p -164.86 160.63 19.63 Favored 'General case' 0 N--CA 1.5 2.04 0 O-C-N 117.33 -3.356 . . . . 2.0 119.329 -179.034 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 54' ' ' CYS . . . . . . . . . . . . 0.395 25.4 p -152.35 119.7 5.95 Favored 'General case' 0 CA--C 1.584 2.258 0 CA-C-O 122.85 1.31 . . . . 2.0 111.866 179.471 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 10.6 m120 -34.01 -9.55 0.0 OUTLIER 'General case' 0 N--CA 1.504 2.234 1 N-CA-C 129.839 6.977 . . . . 2.0 129.839 -179.54 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 56' ' ' THR . . . . . 0.535 ' O ' ' SG ' ' A' ' 21' ' ' CYS . 7.9 t -130.79 161.43 31.77 Favored 'General case' 0 N--CA 1.513 2.687 0 CA-C-N 124.861 3.482 . . . . 2.0 115.727 -179.81 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 57' ' ' ASP . . . . . . . . . . . . . 5.5 m-20 -48.22 120.89 3.86 Favored 'General case' 0 N--CA 1.497 1.902 0 N-CA-C 114.796 1.406 . . . . 2.0 114.796 -179.835 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 58' ' ' ARG . . . . . . . . . . . . 0.281 63.4 mtt180 70.92 9.92 6.87 Favored 'General case' 0 N--CA 1.502 2.141 0 N-CA-C 115.699 1.741 . . . . 2.0 115.699 -179.76 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 59' ' ' CYS . . . . . . . . . . . . . 35.7 t -61.57 -32.22 72.3 Favored 'General case' 0 CA--C 1.574 1.867 0 N-CA-C 115.632 1.716 . . . . 2.0 115.632 179.775 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 60' ' ' ASN . . . . . . . . . . . . . 47.9 p30 . . . . . 0 CA--C 1.567 1.602 0 CA-C-O 124.652 2.168 . . . . 2.0 112.848 179.813 . . . . . . . . 0 0 . 1 . 008 nuclear build full ' A' A ' 1' ' ' LEU . . . . . 0.524 HD13 ' SG ' ' A' ' 3' ' ' CYS . 0.5 OUTLIER . . . . . 0 CA--C 1.582 2.203 0 CA-C-O 122.467 1.127 . . . . 2.0 112.823 . . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 6.3 tmtt? -145.76 108.3 4.46 Favored 'General case' 0 N--CA 1.494 1.766 0 N-CA-C 101.076 -3.675 . . . . 2.0 101.076 179.855 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 3' ' ' CYS . . . . . 0.524 ' SG ' HD13 ' A' ' 1' ' ' LEU . 71.7 m -123.13 174.75 7.04 Favored 'General case' 0 N--CA 1.495 1.781 0 N-CA-C 119.126 3.01 . . . . 2.0 119.126 -179.474 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 18.0 m-20 -102.84 137.62 40.81 Favored 'General case' 0 CA--C 1.56 1.362 0 C-N-CA 124.193 0.997 . . . . 2.0 110.852 179.778 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 22.0 ptmt -84.84 -160.93 0.52 Allowed 'General case' 0 CA--C 1.593 2.631 0 CA-C-N 120.376 1.444 . . . . 2.0 108.113 179.224 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -46.0 -42.75 13.58 Favored 'General case' 0 N--CA 1.509 2.483 0 N-CA-C 119.136 3.013 . . . . 2.0 119.136 -179.996 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 7' ' ' ILE . . . . . . . . . . . . . 42.6 mm -65.88 138.77 96.54 Favored Pre-proline 0 CA--C 1.585 2.295 0 N-CA-C 115.542 1.682 . . . . 2.0 115.542 -179.74 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 80.0 Cg_exo -48.16 -40.55 34.55 Favored 'Trans proline' 0 CA--C 1.569 2.256 0 N-CA-C 121.063 3.447 . . . . 2.0 121.063 179.844 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 9' ' ' ILE . . . . . . . . . . . . . 34.4 mm -106.39 30.25 0.96 Allowed 'Isoleucine or valine' 0 CA--C 1.589 2.473 0 N-CA-C 114.169 1.174 . . . . 2.0 114.169 -179.817 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -74.52 160.63 30.66 Favored 'General case' 0 CA--C 1.574 1.9 0 O-C-N 118.108 -2.87 . . . . 2.0 117.205 -179.91 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 96.4 p -153.41 119.99 5.59 Favored 'General case' 0 N--CA 1.501 2.115 0 O-C-N 120.448 -1.407 . . . . 2.0 112.27 -179.919 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -148.49 138.69 22.5 Favored 'General case' 0 N--CA 1.497 1.888 0 O-C-N 120.801 -1.187 . . . . 2.0 113.41 -179.804 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 13' ' ' THR . . . . . . . . . . . . . 50.9 m -74.2 130.26 39.4 Favored 'General case' 0 N--CA 1.505 2.32 0 O-C-N 120.574 -1.329 . . . . 2.0 110.897 179.829 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 14' ' ' CYS . . . . . 0.465 ' SG ' ' HD2' ' A' ' 15' ' ' PRO 0.256 12.7 t -135.27 162.51 57.02 Favored Pre-proline 0 CA--C 1.594 2.641 0 N-CA-C 113.99 1.108 . . . . 2.0 113.99 -179.625 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 15' ' ' PRO . . . . . 0.465 ' HD2' ' SG ' ' A' ' 14' ' ' CYS . 68.4 Cg_exo -50.49 161.81 1.12 Allowed 'Trans proline' 0 CA--C 1.575 2.551 1 N-CA-C 125.538 5.169 . . . . 2.0 125.538 -179.822 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -84.36 171.83 12.31 Favored 'General case' 0 N--CA 1.498 1.954 0 C-N-CA 124.94 1.296 . . . . 2.0 111.757 179.581 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . 81.76 -46.93 3.56 Favored Glycine 1 N--CA 1.523 4.461 0 O-C-N 119.245 -2.159 . . . . 2.0 108.618 -178.938 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 72.8 mmtt -78.64 85.44 4.68 Favored 'General case' 0 CA--C 1.575 1.934 0 C-N-CA 129.017 2.927 . . . . 2.0 104.446 179.336 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 8.1 p30 -82.96 -23.97 33.19 Favored 'General case' 0 N--CA 1.496 1.832 0 N-CA-C 119.642 3.201 . . . . 2.0 119.642 -179.775 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 61.9 mt -88.66 121.71 31.32 Favored 'General case' 0 CA--C 1.551 0.998 0 C-N-CA 123.96 0.904 . . . . 2.0 113.11 -179.966 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 1.3 m -82.26 97.42 8.27 Favored 'General case' 0 CA--C 1.577 1.999 1 N-CA-C 99.001 -4.444 . . . . 2.0 99.001 179.064 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 22' ' ' TYR . . . . . . . . . . . . 0.263 0.0 OUTLIER -82.69 153.55 25.29 Favored 'General case' 0 N--CA 1.482 1.163 0 N-CA-C 118.795 2.887 . . . . 2.0 118.795 -179.429 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 13.4 ptmt -126.32 96.65 4.77 Favored 'General case' 0 CA--C 1.561 1.381 0 N-CA-C 103.938 -2.616 . . . . 2.0 103.938 179.629 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 24' ' ' MET . . . . . . . . . . . . 0.28 42.0 ttm -65.1 70.98 0.04 OUTLIER 'General case' 0 CA--C 1.57 1.742 0 C-N-CA 126.301 1.84 . . . . 2.0 113.911 -179.856 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 25' ' ' PHE . . . . . . . . . . . . . 4.0 m-30 -58.09 133.65 55.75 Favored 'General case' 0 N--CA 1.493 1.715 0 O-C-N 120.55 -1.344 . . . . 2.0 114.014 179.939 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 26' ' ' MET . . . . . . . . . . . . . 58.1 mtp -66.62 131.61 46.37 Favored 'General case' 0 N--CA 1.492 1.632 0 CA-C-O 118.609 -0.71 . . . . 2.0 111.948 179.941 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 27' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -54.06 -41.21 67.88 Favored 'General case' 0 N--CA 1.513 2.716 0 CA-C-N 120.702 1.592 . . . . 2.0 112.542 179.562 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 50.5 m -77.89 -35.26 50.99 Favored 'General case' 0 CA--C 1.585 2.299 0 N-CA-C 113.892 1.071 . . . . 2.0 113.892 179.475 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 11.8 t70 -141.19 82.17 1.82 Allowed 'General case' 0 CA--C 1.574 1.88 0 O-C-N 120.635 -1.29 . . . . 2.0 109.383 179.871 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 2.3 mm? -47.73 -71.42 0.07 Allowed 'General case' 0 CA--C 1.579 2.078 0 N-CA-C 119.876 3.287 . . . . 2.0 119.876 -179.671 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 31' ' ' THR . . . . . . . . . . . . . 56.2 p -15.18 -64.32 0.01 OUTLIER 'General case' 0 N--CA 1.511 2.587 0 N-CA-C 121.787 3.995 . . . . 2.0 121.787 -179.814 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 32' ' ' ILE . . . . . . . . . . . . . 1.8 mp -94.78 110.98 52.52 Favored Pre-proline 0 CA--C 1.587 2.392 0 N-CA-C 101.948 -3.353 . . . . 2.0 101.948 179.609 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 33' ' ' PRO . . . . . . . . . . . . . 5.2 Cg_exo -67.03 164.33 30.43 Favored 'Trans proline' 0 CA--C 1.557 1.665 0 N-CA-C 122.201 3.885 . . . . 2.0 122.201 -179.557 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 34' ' ' VAL . . . . . . . . . . . . . 58.7 t -70.74 -45.6 72.99 Favored 'Isoleucine or valine' 0 CA--C 1.595 2.679 0 N-CA-C 106.462 -1.681 . . . . 2.0 106.462 178.883 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 5.3 tptm -152.42 167.78 27.61 Favored 'General case' 0 CA--C 1.567 1.623 0 C-N-CA 126.626 1.97 . . . . 2.0 109.797 179.773 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 12.5 mtt180 -144.3 110.26 5.38 Favored 'General case' 0 CA--C 1.574 1.868 0 N-CA-C 104.196 -2.52 . . . . 2.0 104.196 179.495 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . -141.83 -135.53 3.13 Favored Glycine 0 N--CA 1.494 2.5 0 O-C-N 120.699 -1.25 . . . . 2.0 115.116 -179.872 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 38' ' ' CYS . . . . . . . . . . . . . 16.1 p -129.33 136.23 49.75 Favored 'General case' 0 N--CA 1.491 1.614 0 CA-C-N 118.174 0.987 . . . . 2.0 112.45 179.713 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 39' ' ' ILE . . . . . . . . . . . . . 3.3 tp -150.38 162.08 3.82 Favored 'Isoleucine or valine' 0 CA--C 1.577 2.003 0 N-CA-C 113.78 1.03 . . . . 2.0 113.78 -179.866 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 40' ' ' ASP . . . . . . . . . . . . . 8.1 p-10 -79.64 -49.84 11.53 Favored 'General case' 0 N--CA 1.513 2.713 0 O-C-N 119.139 -2.226 . . . . 2.0 114.504 179.753 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 70.3 t -134.47 143.72 37.1 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.415 0 N-CA-C 102.537 -3.135 . . . . 2.0 102.537 179.645 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 42' ' ' CYS . . . . . . . . . . . . 0.258 1.9 m -57.55 104.95 0.46 Allowed Pre-proline 0 CA--C 1.599 2.836 0 N-CA-C 102.032 -3.321 . . . . 2.0 102.032 179.67 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 43' ' ' PRO . . . . . . . . . . . . . 25.2 Cg_exo -50.75 179.87 0.02 OUTLIER 'Trans proline' 0 C--N 1.371 1.757 1 N-CA-C 125.466 5.141 . . . . 2.0 125.466 -178.693 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 29.9 mtpp -69.79 96.31 0.97 Allowed 'General case' 0 CA--C 1.565 1.522 0 N-CA-C 105.506 -2.035 . . . . 2.0 105.506 179.535 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 45' ' ' ASN . . . . . . . . . . . . 0.252 2.1 p-10 -62.62 112.91 2.69 Favored 'General case' 0 CA--C 1.567 1.604 0 N-CA-C 116.763 2.134 . . . . 2.0 116.763 -179.456 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 12.4 t -80.17 -179.8 7.25 Favored 'General case' 0 CA--C 1.567 1.604 0 N-CA-C 114.511 1.301 . . . . 2.0 114.511 179.943 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 47' ' ' LEU . . . . . . . . . . . . . 93.3 mt -49.77 -28.55 6.38 Favored 'General case' 0 N--CA 1.507 2.39 0 N-CA-C 116.708 2.114 . . . . 2.0 116.708 179.822 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 78.6 mt -102.54 12.73 36.01 Favored 'General case' 0 CA--C 1.579 2.082 0 C-N-CA 124.849 1.259 . . . . 2.0 114.06 179.655 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 49' ' ' VAL . . . . . . . . . . . . . 9.4 p -155.85 158.62 3.29 Favored 'Isoleucine or valine' 0 N--CA 1.502 2.168 0 N-CA-C 118.114 2.635 . . . . 2.0 118.114 -179.699 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 59.9 tttp -153.57 75.51 1.05 Allowed 'General case' 0 CA--C 1.581 2.135 0 N-CA-C 103.011 -2.959 . . . . 2.0 103.011 179.296 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 18.2 m-85 -50.38 120.79 4.88 Favored 'General case' 0 CA--C 1.572 1.806 0 N-CA-C 121.58 3.918 . . . . 2.0 121.58 -179.53 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 52' ' ' VAL . . . . . . . . . . . . 0.256 25.2 t -101.76 140.79 19.46 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.958 0 N-CA-C 101.968 -3.345 . . . . 2.0 101.968 179.294 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 53' ' ' CYS . . . . . . . . . . . . 0.425 6.8 p -155.71 158.95 39.08 Favored 'General case' 0 N--CA 1.493 1.702 0 N-CA-C 118.821 2.897 . . . . 2.0 118.821 -178.866 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 54' ' ' CYS . . . . . . . . . . . . 0.408 21.6 p -148.57 127.57 12.75 Favored 'General case' 0 CA--C 1.579 2.087 0 CA-C-O 122.606 1.193 . . . . 2.0 110.971 179.505 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 12.3 m120 -42.65 16.31 0.0 OUTLIER 'General case' 0 N--CA 1.504 2.262 1 N-CA-C 127.338 6.051 . . . . 2.0 127.338 -179.481 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 6.9 t -148.14 177.27 9.53 Favored 'General case' 0 N--CA 1.501 2.104 0 CA-C-N 123.179 2.718 . . . . 2.0 115.012 -179.935 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 57' ' ' ASP . . . . . . . . . . . . . 43.4 m-20 -62.86 124.03 19.99 Favored 'General case' 0 CA--C 1.56 1.362 0 C-N-CA 124.126 0.971 . . . . 2.0 112.792 -180.0 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 58' ' ' ARG . . . . . . . . . . . . . 71.3 mtp180 64.66 18.73 11.55 Favored 'General case' 0 N--CA 1.499 1.981 0 N-CA-C 117.01 2.226 . . . . 2.0 117.01 -179.962 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 59' ' ' CYS . . . . . . . . . . . . . 36.8 t -71.18 -19.56 62.39 Favored 'General case' 0 CA--C 1.579 2.078 0 N-CA-C 117.081 2.252 . . . . 2.0 117.081 179.902 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 60' ' ' ASN . . . . . . . . . . . . . 10.2 p30 . . . . . 0 CA--C 1.567 1.615 0 CA-C-O 125.21 2.433 . . . . 2.0 112.823 179.803 . . . . . . . . 0 0 . 1 . 009 nuclear build full ' A' A ' 1' ' ' LEU . . . . . . . . . . . . 0.301 0.3 OUTLIER . . . . . 0 CA--C 1.571 1.788 0 N-CA-C 114.117 1.154 . . . . 2.0 114.117 . . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 28.2 mttp -70.66 128.74 37.11 Favored 'General case' 0 N--CA 1.494 1.748 0 O-C-N 120.735 -1.228 . . . . 2.0 110.451 179.764 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 71.8 m -137.84 -176.52 4.45 Favored 'General case' 0 CA--C 1.566 1.562 0 CA-C-O 122.619 1.2 . . . . 2.0 113.323 -179.816 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 91.8 m-20 -122.86 97.42 5.44 Favored 'General case' 0 CA--C 1.554 1.102 0 C-N-CA 123.583 0.753 . . . . 2.0 111.739 179.957 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . 0.315 22.4 ptmt -56.15 164.14 1.37 Allowed 'General case' 0 CA--C 1.589 2.476 0 CA-C-N 120.396 1.453 . . . . 2.0 112.475 179.465 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 6' ' ' LEU . . . . . . . . . . . . 0.358 2.4 tm? -30.66 -49.52 0.12 Allowed 'General case' 0 N--CA 1.511 2.625 1 N-CA-C 122.648 4.314 . . . . 2.0 122.648 -179.139 . . . . . . . . 3 2 . 1 . 009 nuclear build full ' A' A ' 7' ' ' ILE . . . . . . . . . . . . . 49.0 mm -55.08 149.16 25.89 Favored Pre-proline 0 CA--C 1.594 2.649 0 N-CA-C 114.425 1.268 . . . . 2.0 114.425 179.889 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 97.3 Cg_exo -47.21 -54.16 5.42 Favored 'Trans proline' 0 CA--C 1.575 2.549 0 C-N-CA 123.059 2.506 . . . . 2.0 118.282 179.881 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 9' ' ' ILE . . . . . . . . . . . . 0.256 10.8 tp -74.65 -48.31 35.05 Favored 'Isoleucine or valine' 0 N--CA 1.507 2.42 0 N-CA-C 114.459 1.281 . . . . 2.0 114.459 179.684 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . 24.52 120.1 0.0 OUTLIER 'General case' 0 CA--C 1.58 2.114 1 N-CA-C 124.202 4.89 . . . . 2.0 124.202 179.739 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 94.1 p -112.18 100.59 8.95 Favored 'General case' 0 CA--C 1.568 1.668 0 N-CA-C 117.116 2.265 . . . . 2.0 117.116 -179.754 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 16.6 tppt? -117.35 127.3 53.92 Favored 'General case' 0 N--CA 1.495 1.805 0 N-CA-C 108.05 -1.092 . . . . 2.0 108.05 179.715 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 13' ' ' THR . . . . . . . . . . . . . 9.8 t -135.99 78.47 1.72 Allowed 'General case' 0 N--CA 1.503 2.185 0 O-C-N 120.782 -1.199 . . . . 2.0 111.398 -179.973 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 14' ' ' CYS . . . . . . . . . . . . 0.272 0.1 OUTLIER -103.88 170.87 5.64 Favored Pre-proline 0 CA--C 1.587 2.398 0 N-CA-C 115.364 1.616 . . . . 2.0 115.364 -179.939 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 15' ' ' PRO . . . . . . . . . . . . . 86.2 Cg_exo -55.72 164.82 4.08 Favored 'Trans proline' 0 N--CA 1.501 1.954 1 N-CA-C 126.197 5.422 . . . . 2.0 126.197 -179.617 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -70.19 175.91 4.24 Favored 'General case' 0 N--CA 1.498 1.946 0 C-N-CA 123.935 0.894 . . . . 2.0 109.437 179.398 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . 83.65 -53.2 4.83 Favored Glycine 1 N--CA 1.518 4.141 0 O-C-N 118.341 -2.724 . . . . 2.0 106.558 -179.101 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 18.3 mmtm -80.3 65.83 5.59 Favored 'General case' 0 CA--C 1.602 2.977 0 N-CA-C 103.113 -2.921 . . . . 2.0 103.113 178.926 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 9.8 p30 -64.67 -38.84 92.38 Favored 'General case' 0 N--CA 1.482 1.156 0 N-CA-C 120.69 3.589 . . . . 2.0 120.69 -179.475 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 89.4 mt -72.36 117.02 13.5 Favored 'General case' 0 CA--C 1.55 0.959 0 N-CA-C 115.704 1.742 . . . . 2.0 115.704 -179.764 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 1.5 m -84.79 91.9 8.1 Favored 'General case' 0 CA--C 1.576 1.978 1 N-CA-C 98.902 -4.481 . . . . 2.0 98.902 179.084 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 22' ' ' TYR . . . . . . . . . . . . 0.321 4.4 p90 -65.56 153.69 40.81 Favored 'General case' 0 N--CA 1.481 1.08 0 N-CA-C 119.674 3.212 . . . . 2.0 119.674 -179.368 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 29.5 ttpt -132.21 96.14 3.82 Favored 'General case' 0 CA--C 1.562 1.422 0 N-CA-C 104.171 -2.529 . . . . 2.0 104.171 179.857 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 24' ' ' MET . . . . . 0.489 ' SD ' ' HB3' ' A' ' 35' ' ' LYS . 15.0 ttt -68.12 86.05 0.25 Allowed 'General case' 0 CA--C 1.567 1.609 0 N-CA-C 114.356 1.243 . . . . 2.0 114.356 -179.722 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 25' ' ' PHE . . . . . . . . . . . . . 3.0 m-30 -81.76 108.51 15.35 Favored 'General case' 0 CA--C 1.569 1.696 0 N-CA-C 105.153 -2.166 . . . . 2.0 105.153 179.649 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 26' ' ' MET . . . . . . . . . . . . . 22.3 ttt -58.11 137.99 56.47 Favored 'General case' 0 N--CA 1.496 1.841 0 O-C-N 120.885 -1.134 . . . . 2.0 113.864 -179.864 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 27' ' ' MET . . . . . . . . . . . . . 2.2 mmt -48.21 -39.69 21.94 Favored 'General case' 0 N--CA 1.508 2.456 0 N-CA-C 115.359 1.614 . . . . 2.0 115.359 179.929 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 59.4 m -80.76 -38.91 27.79 Favored 'General case' 0 CA--C 1.584 2.275 0 C-N-CA 123.611 0.765 . . . . 2.0 112.932 179.538 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 59.0 t0 -132.63 99.44 4.64 Favored 'General case' 0 CA--C 1.572 1.825 0 N-CA-C 106.573 -1.64 . . . . 2.0 106.573 179.733 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 2.4 mm? -76.55 -77.35 0.14 Allowed 'General case' 0 CA--C 1.578 2.046 0 N-CA-C 117.59 2.441 . . . . 2.0 117.59 -179.658 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 31' ' ' THR . . . . . . . . . . . . . 56.5 p -14.24 -69.81 0.01 OUTLIER 'General case' 0 N--CA 1.511 2.58 0 N-CA-C 121.15 3.759 . . . . 2.0 121.15 -179.804 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 32' ' ' ILE . . . . . . . . . . . . . 2.0 mp -89.44 112.47 51.73 Favored Pre-proline 0 CA--C 1.589 2.451 1 N-CA-C 99.562 -4.236 . . . . 2.0 99.562 179.552 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 33' ' ' PRO . . . . . . . . . . . . . 6.0 Cg_exo -66.87 158.19 57.73 Favored 'Trans proline' 0 CA--C 1.554 1.512 0 N-CA-C 119.706 2.925 . . . . 2.0 119.706 -179.41 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 34' ' ' VAL . . . . . . . . . . . . 0.255 13.2 m -85.16 -37.18 12.0 Favored 'Isoleucine or valine' 0 CA--C 1.585 2.315 0 CA-C-O 121.627 0.727 . . . . 2.0 109.82 179.078 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 35' ' ' LYS . . . . . 0.489 ' HB3' ' SD ' ' A' ' 24' ' ' MET . 34.8 ttmt -145.66 163.87 33.53 Favored 'General case' 0 CA--C 1.569 1.706 0 CA-C-O 123.72 1.724 . . . . 2.0 109.293 179.59 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 14.4 mtp180 -145.39 132.22 20.11 Favored 'General case' 0 CA--C 1.576 1.964 0 N-CA-C 102.815 -3.031 . . . . 2.0 102.815 179.585 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . -153.21 -146.35 4.35 Favored Glycine 0 N--CA 1.488 2.162 0 O-C-N 119.797 -1.815 . . . . 2.0 117.61 -179.775 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 38' ' ' CYS . . . . . . . . . . . . . 10.5 p -129.33 132.5 47.12 Favored 'General case' 0 CA--C 1.571 1.765 0 C-N-CA 123.668 0.787 . . . . 2.0 111.481 179.944 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 39' ' ' ILE . . . . . 0.515 HG21 ' HD3' ' A' ' 43' ' ' PRO . 9.9 tp -158.98 172.66 0.39 Allowed 'Isoleucine or valine' 0 N--CA 1.503 2.198 0 O-C-N 120.692 -1.255 . . . . 2.0 113.08 -179.773 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 40' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -95.3 -46.39 6.75 Favored 'General case' 0 N--CA 1.498 1.945 0 O-C-N 119.858 -1.776 . . . . 2.0 114.173 179.724 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 69.0 t -130.87 25.82 1.63 Allowed 'Isoleucine or valine' 0 N--CA 1.512 2.631 0 N-CA-C 114.934 1.457 . . . . 2.0 114.934 -179.584 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 42' ' ' CYS . . . . . . . . . . . . 0.283 2.8 m 81.21 114.07 0.03 OUTLIER Pre-proline 0 N--CA 1.526 3.339 1 N-CA-C 96.337 -5.431 . . . . 2.0 96.337 -179.15 . . . . . . . . 3 2 . 1 . 009 nuclear build full ' A' A ' 43' ' ' PRO . . . . . 0.515 ' HD3' HG21 ' A' ' 39' ' ' ILE 0.472 31.5 Cg_exo -34.46 -96.52 0.0 OUTLIER 'Trans proline' 0 CA--C 1.565 2.027 1 N-CA-C 123.617 4.43 . . . . 2.0 123.617 -178.832 . . . . . . . . 4 3 . 1 . 009 nuclear build full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 44.7 mttm -159.28 95.86 1.27 Allowed 'General case' 0 CA--C 1.562 1.426 1 N-CA-C 98.706 -4.553 . . . . 2.0 98.706 179.696 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 45' ' ' ASN . . . . . . . . . . . . . 5.2 p-10 -72.91 -168.3 0.46 Allowed 'General case' 0 CA--C 1.572 1.812 0 N-CA-C 117.793 2.516 . . . . 2.0 117.793 -179.594 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 46' ' ' SER . . . . . . . . . . . . 0.349 5.5 t 80.79 -41.6 0.18 Allowed 'General case' 0 N--CA 1.491 1.605 0 N-CA-C 118.236 2.68 . . . . 2.0 118.236 179.907 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 47' ' ' LEU . . . . . . . . . . . . 0.252 2.7 pp -49.36 -51.1 36.83 Favored 'General case' 0 N--CA 1.508 2.473 0 CA-C-N 120.724 1.602 . . . . 2.0 113.07 179.696 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 92.3 mt -155.37 27.44 0.4 Allowed 'General case' 0 CA--C 1.589 2.444 0 C-N-CA 126.688 1.995 . . . . 2.0 108.269 179.428 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 49' ' ' VAL . . . . . 0.4 HG21 ' HG3' ' A' ' 24' ' ' MET . 14.5 p -169.33 168.24 0.27 Allowed 'Isoleucine or valine' 0 CA--C 1.582 2.201 0 N-CA-C 118.932 2.938 . . . . 2.0 118.932 -179.139 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 28.4 ttpt -146.92 74.26 1.34 Allowed 'General case' 0 CA--C 1.581 2.141 0 N-CA-C 102.251 -3.24 . . . . 2.0 102.251 178.977 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 54.3 m-85 -53.04 126.45 20.64 Favored 'General case' 0 CA--C 1.572 1.816 0 N-CA-C 120.187 3.403 . . . . 2.0 120.187 -179.41 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 52' ' ' VAL . . . . . . . . . . . . . 55.9 t -100.43 110.86 28.43 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.853 0 N-CA-C 101.176 -3.639 . . . . 2.0 101.176 179.371 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 53' ' ' CYS . . . . . . . . . . . . 0.312 1.4 p -123.68 136.61 54.57 Favored 'General case' 0 CA--C 1.569 1.709 0 N-CA-C 118.406 2.743 . . . . 2.0 118.406 -179.211 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 54' ' ' CYS . . . . . . . . . . . . 0.307 19.6 p -128.41 124.92 37.48 Favored 'General case' 0 CA--C 1.578 2.026 0 CA-C-O 122.722 1.248 . . . . 2.0 110.533 179.75 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 12.4 p-10 -52.9 32.36 0.0 OUTLIER 'General case' 0 N--CA 1.498 1.964 1 N-CA-C 127.675 6.176 . . . . 2.0 127.675 -179.544 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 56' ' ' THR . . . . . . . . . . . . 0.256 9.4 t -150.24 170.01 20.0 Favored 'General case' 0 N--CA 1.501 2.114 0 O-C-N 119.342 -2.098 . . . . 2.0 114.238 179.95 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 57' ' ' ASP . . . . . . . . . . . . . 39.5 m-20 -62.0 118.96 7.97 Favored 'General case' 0 N--CA 1.488 1.427 0 N-CA-C 113.894 1.072 . . . . 2.0 113.894 -179.925 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 58' ' ' ARG . . . . . . . . . . . . 0.277 21.5 mtt85 65.84 18.69 11.19 Favored 'General case' 0 N--CA 1.498 1.941 0 N-CA-C 117.403 2.372 . . . . 2.0 117.403 -179.881 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 59' ' ' CYS . . . . . . . . . . . . . 48.4 t -63.78 -32.47 73.98 Favored 'General case' 0 CA--C 1.577 1.999 0 N-CA-C 116.567 2.062 . . . . 2.0 116.567 179.899 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 60' ' ' ASN . . . . . . . . . . . . . 19.6 p30 . . . . . 0 CA--C 1.566 1.566 0 CA-C-O 124.993 2.33 . . . . 2.0 114.58 179.859 . . . . . . . . 0 0 . 1 . 010 nuclear build full ' A' A ' 1' ' ' LEU . . . . . 0.455 HD21 ' SG ' ' A' ' 21' ' ' CYS . 6.2 tp . . . . . 0 CA--C 1.572 1.824 0 N-CA-C 114.727 1.381 . . . . 2.0 114.727 . . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 15.8 mtmm -86.77 140.96 29.21 Favored 'General case' 0 CA--C 1.576 1.946 0 O-C-N 120.993 -1.067 . . . . 2.0 108.314 179.549 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 3' ' ' CYS . . . . . 0.429 ' SG ' ' HB2' ' A' ' 38' ' ' CYS . 85.7 m -137.39 174.41 10.63 Favored 'General case' 0 N--CA 1.499 1.988 0 O-C-N 119.339 -2.101 . . . . 2.0 115.251 -179.906 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 60.8 m-20 -123.65 103.41 8.4 Favored 'General case' 0 CA--C 1.574 1.868 0 N-CA-C 119.119 3.007 . . . . 2.0 119.119 -179.839 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 19.2 ptmt -59.23 170.62 0.9 Allowed 'General case' 0 CA--C 1.6 2.875 0 O-C-N 119.67 -1.893 . . . . 2.0 111.934 179.264 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 4.2 mm? -31.37 -49.99 0.16 Allowed 'General case' 0 N--CA 1.511 2.58 1 N-CA-C 122.234 4.161 . . . . 2.0 122.234 -179.758 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 7' ' ' ILE . . . . . . . . . . . . . 20.9 mt -69.57 148.11 96.81 Favored Pre-proline 0 CA--C 1.584 2.258 0 N-CA-C 115.256 1.576 . . . . 2.0 115.256 -179.816 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 82.6 Cg_exo -51.47 -48.3 21.97 Favored 'Trans proline' 0 CA--C 1.574 2.475 0 C-N-CA 123.154 2.57 . . . . 2.0 117.167 179.681 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 9' ' ' ILE . . . . . . . . . . . . 0.283 11.3 tp -61.85 -46.49 96.41 Favored 'Isoleucine or valine' 0 N--CA 1.511 2.593 0 CA-C-N 119.712 1.142 . . . . 2.0 112.444 179.521 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . 54.51 175.77 0.03 OUTLIER 'General case' 0 CA--C 1.579 2.091 1 N-CA-C 126.484 5.735 . . . . 2.0 126.484 179.336 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 8.7 t -68.68 -169.99 0.19 Allowed 'General case' 0 CA--C 1.58 2.099 0 N-CA-C 118.548 2.796 . . . . 2.0 118.548 -179.833 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . 0.297 2.5 tppp? -106.01 -90.66 0.41 Allowed 'General case' 0 CA--C 1.572 1.819 1 N-CA-C 122.967 4.432 . . . . 2.0 122.967 -179.545 . . . . . . . . 3 2 . 1 . 010 nuclear build full ' A' A ' 13' ' ' THR . . . . . . . . . . . . . 7.8 t -154.39 165.15 37.3 Favored 'General case' 0 N--CA 1.51 2.543 1 N-CA-C 121.903 4.038 . . . . 2.0 121.903 -179.116 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -132.62 170.15 12.12 Favored Pre-proline 0 CA--C 1.599 2.854 0 C-N-CA 126.119 1.767 . . . . 2.0 108.717 179.331 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 15' ' ' PRO . . . . . . . . . . . . . 61.0 Cg_exo -59.3 -179.11 0.16 Allowed 'Trans proline' 0 CA--C 1.574 2.488 1 N-CA-C 124.941 4.939 . . . . 2.0 124.941 -179.784 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -78.83 164.12 24.76 Favored 'General case' 0 N--CA 1.5 2.04 0 N-CA-C 106.174 -1.787 . . . . 2.0 106.174 179.278 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . 84.45 -48.58 4.08 Favored Glycine 1 N--CA 1.523 4.437 0 N-CA-C 105.714 -2.954 . . . . 2.0 105.714 -178.769 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 28.4 mmtm -81.69 63.9 6.16 Favored 'General case' 0 CA--C 1.596 2.731 0 N-CA-C 102.052 -3.314 . . . . 2.0 102.052 178.698 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 45.5 p-10 -84.09 -13.59 52.64 Favored 'General case' 0 N--CA 1.487 1.397 0 N-CA-C 121.034 3.716 . . . . 2.0 121.034 -179.451 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 76.8 mt -91.14 113.84 26.21 Favored 'General case' 0 CA--C 1.553 1.087 0 CA-C-N 119.083 0.856 . . . . 2.0 111.166 179.862 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 21' ' ' CYS . . . . . 0.455 ' SG ' HD21 ' A' ' 1' ' ' LEU . 1.8 m -80.32 94.12 6.06 Favored 'General case' 0 CA--C 1.574 1.9 0 N-CA-C 101.303 -3.592 . . . . 2.0 101.303 179.235 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 22' ' ' TYR . . . . . . . . . . . . 0.302 0.0 OUTLIER -72.26 148.13 45.77 Favored 'General case' 0 CA--C 1.551 0.993 0 N-CA-C 121.446 3.869 . . . . 2.0 121.446 -179.313 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 58.5 mttp -111.29 92.2 3.95 Favored 'General case' 0 CA--C 1.561 1.38 1 N-CA-C 99.233 -4.358 . . . . 2.0 99.233 179.249 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 24' ' ' MET . . . . . . . . . . . . . 27.9 ttt -72.24 67.99 0.72 Allowed 'General case' 0 CA--C 1.573 1.852 0 O-C-N 120.811 -1.181 . . . . 2.0 111.55 -179.873 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 25' ' ' PHE . . . . . . . . . . . . . 10.8 m-30 -57.64 131.19 49.48 Favored 'General case' 0 N--CA 1.486 1.362 0 N-CA-C 114.804 1.409 . . . . 2.0 114.804 -179.861 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 26' ' ' MET . . . . . . . . . . . . . 42.3 mtt -65.58 130.81 44.61 Favored 'General case' 0 N--CA 1.493 1.698 0 CA-C-O 118.536 -0.745 . . . . 2.0 110.74 179.778 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 27' ' ' MET . . . . . . . . . . . . . 8.6 tmm? -56.47 -35.24 67.72 Favored 'General case' 0 N--CA 1.51 2.543 0 CA-C-N 121.106 1.775 . . . . 2.0 112.131 179.561 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 49.2 m -76.32 -36.49 58.26 Favored 'General case' 0 CA--C 1.586 2.364 0 C-N-CA 124.276 1.031 . . . . 2.0 113.14 179.315 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 10.3 t0 -144.21 84.2 1.76 Allowed 'General case' 0 CA--C 1.577 1.992 0 O-C-N 120.692 -1.255 . . . . 2.0 107.766 179.794 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 1.9 mm? -48.46 -74.63 0.03 OUTLIER 'General case' 0 CA--C 1.574 1.887 0 N-CA-C 121.002 3.704 . . . . 2.0 121.002 -179.482 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 31' ' ' THR . . . . . . . . . . . . 0.283 12.2 t -18.41 -60.2 0.02 OUTLIER 'General case' 0 N--CA 1.508 2.44 0 N-CA-C 121.366 3.839 . . . . 2.0 121.366 -179.942 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 32' ' ' ILE . . . . . . . . . . . . . 1.8 mp -95.9 103.76 14.34 Favored Pre-proline 0 CA--C 1.59 2.491 0 N-CA-C 101.414 -3.551 . . . . 2.0 101.414 179.641 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 33' ' ' PRO . . . . . . . . . . . . . 55.6 Cg_endo -65.69 170.3 11.49 Favored 'Trans proline' 0 CA--C 1.56 1.791 1 N-CA-C 123.571 4.412 . . . . 2.0 123.571 -179.521 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 34' ' ' VAL . . . . . . . . . . . . . 54.9 t -73.04 -50.64 30.75 Favored 'Isoleucine or valine' 0 CA--C 1.594 2.642 0 N-CA-C 105.303 -2.11 . . . . 2.0 105.303 178.889 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 2.0 tptm -141.5 157.68 44.82 Favored 'General case' 0 CA--C 1.562 1.43 0 C-N-CA 126.618 1.967 . . . . 2.0 109.007 179.654 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 36' ' ' ARG . . . . . . . . . . . . 0.333 45.2 ttp180 -132.61 67.54 1.53 Allowed 'General case' 0 N--CA 1.498 1.937 0 N-CA-C 104.069 -2.567 . . . . 2.0 104.069 179.484 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . -94.23 -142.75 12.66 Favored Glycine 0 CA--C 1.545 1.924 1 N-CA-C 124.788 4.675 . . . . 2.0 124.788 -179.439 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 38' ' ' CYS . . . . . 0.429 ' HB2' ' SG ' ' A' ' 3' ' ' CYS 0.275 40.3 t -129.86 131.65 46.17 Favored 'General case' 0 CA--C 1.567 1.6 0 C-N-CA 125.23 1.412 . . . . 2.0 113.588 -179.575 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 39' ' ' ILE . . . . . . . . . . . . . 4.4 tp -153.75 172.95 0.68 Allowed 'Isoleucine or valine' 0 N--CA 1.504 2.23 0 N-CA-C 115.079 1.511 . . . . 2.0 115.079 -179.72 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 40' ' ' ASP . . . . . . . . . . . . . 10.1 p-10 -84.67 -54.98 4.35 Favored 'General case' 0 N--CA 1.513 2.677 0 O-C-N 119.315 -2.116 . . . . 2.0 113.683 179.694 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 73.5 t -128.34 148.39 32.83 Favored 'Isoleucine or valine' 0 CA--C 1.564 1.51 0 N-CA-C 103.16 -2.904 . . . . 2.0 103.16 179.522 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 42' ' ' CYS . . . . . . . . . . . . . 1.0 OUTLIER -61.42 105.22 0.56 Allowed Pre-proline 0 CA--C 1.603 2.988 1 N-CA-C 99.936 -4.098 . . . . 2.0 99.936 179.456 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 43' ' ' PRO . . . . . . . . . . . . 0.257 25.9 Cg_exo -49.6 175.93 0.03 OUTLIER 'Trans proline' 0 C--N 1.372 1.77 1 N-CA-C 125.23 5.05 . . . . 2.0 125.23 -178.555 . . . . . . . . 3 2 . 1 . 010 nuclear build full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 97.3 mttt -72.72 92.5 1.56 Allowed 'General case' 0 CA--C 1.569 1.684 0 N-CA-C 106.388 -1.708 . . . . 2.0 106.388 179.579 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 45' ' ' ASN . . . . . . . . . . . . . 2.6 p-10 -65.53 156.89 31.19 Favored 'General case' 0 CA--C 1.565 1.531 0 N-CA-C 116.429 2.011 . . . . 2.0 116.429 -179.607 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 11.3 t -132.44 -170.45 2.43 Favored 'General case' 0 N--CA 1.487 1.394 0 N-CA-C 113.614 0.968 . . . . 2.0 113.614 179.896 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 47' ' ' LEU . . . . . . . . . . . . 0.285 3.9 pp -58.41 -10.99 2.41 Favored 'General case' 0 N--CA 1.507 2.388 0 N-CA-C 117.125 2.268 . . . . 2.0 117.125 179.836 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 85.3 mt -104.57 -7.64 19.57 Favored 'General case' 0 CA--C 1.584 2.253 0 C-N-CA 126.281 1.833 . . . . 2.0 112.418 179.437 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 49' ' ' VAL . . . . . . . . . . . . . 8.1 p -156.17 164.33 1.27 Allowed 'Isoleucine or valine' 0 CA--C 1.579 2.085 0 N-CA-C 116.906 2.187 . . . . 2.0 116.906 -179.615 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 58.0 tttp -159.04 76.09 0.7 Allowed 'General case' 0 CA--C 1.577 2.015 0 N-CA-C 104.585 -2.376 . . . . 2.0 104.585 179.32 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 33.4 m-85 -51.76 126.04 16.73 Favored 'General case' 0 CA--C 1.571 1.755 1 N-CA-C 123.162 4.504 . . . . 2.0 123.162 -179.509 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 52' ' ' VAL . . . . . . . . . . . . 0.294 14.7 t -104.86 154.58 6.36 Favored 'Isoleucine or valine' 0 CA--C 1.581 2.143 0 N-CA-C 102.642 -3.095 . . . . 2.0 102.642 179.016 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 53' ' ' CYS . . . . . . . . . . . . . 1.3 p -153.0 159.94 42.96 Favored 'General case' 0 N--CA 1.496 1.857 0 O-C-N 117.851 -3.031 . . . . 2.0 118.277 -179.16 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 54' ' ' CYS . . . . . . . . . . . . . 27.6 p -145.23 120.66 10.32 Favored 'General case' 0 CA--C 1.574 1.879 0 C-N-CA 123.801 0.84 . . . . 2.0 110.358 179.784 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 16.0 m120 -55.18 12.26 0.0 OUTLIER 'General case' 0 N--CA 1.508 2.46 1 N-CA-C 124.719 5.081 . . . . 2.0 124.719 -179.618 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 56' ' ' THR . . . . . . . . . . . . 0.253 5.5 t -137.88 176.93 8.27 Favored 'General case' 0 N--CA 1.505 2.29 0 CA-C-N 123.078 2.672 . . . . 2.0 116.071 -179.91 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 57' ' ' ASP . . . . . . . . . . . . . 72.1 m-20 -63.68 121.11 13.16 Favored 'General case' 0 CA--C 1.567 1.633 0 N-CA-C 115.528 1.677 . . . . 2.0 115.528 -179.788 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 58' ' ' ARG . . . . . . . . . . . . 0.29 23.4 mtt180 59.65 14.76 4.21 Favored 'General case' 0 N--CA 1.503 2.203 0 N-CA-C 117.959 2.577 . . . . 2.0 117.959 -179.901 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 59' ' ' CYS . . . . . . . . . . . . . 29.3 p -68.0 -14.22 62.8 Favored 'General case' 0 N--CA 1.496 1.864 0 N-CA-C 118.349 2.722 . . . . 2.0 118.349 179.947 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 60' ' ' ASN . . . . . . . . . . . . . 32.5 p-10 . . . . . 0 CA--C 1.56 1.346 0 CA-C-O 125.216 2.436 . . . . 2.0 111.598 179.848 . . . . . . . . 0 0 . 1 . 011 nuclear build full ' A' A ' 1' ' ' LEU . . . . . 0.63 HD13 ' SG ' ' A' ' 3' ' ' CYS . 0.4 OUTLIER . . . . . 0 CA--C 1.576 1.953 0 CA-C-O 122.51 1.148 . . . . 2.0 111.639 . . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 2.7 mppt? -145.0 97.74 3.06 Favored 'General case' 0 N--CA 1.486 1.371 0 N-CA-C 101.855 -3.387 . . . . 2.0 101.855 179.533 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 3' ' ' CYS . . . . . 0.63 ' SG ' HD13 ' A' ' 1' ' ' LEU . 72.6 m -105.48 -166.48 1.22 Allowed 'General case' 0 N--CA 1.49 1.562 0 N-CA-C 115.416 1.636 . . . . 2.0 115.416 -179.691 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 78.3 m-20 -126.68 121.42 32.05 Favored 'General case' 0 CA--C 1.559 1.3 0 CA-C-O 116.751 -1.595 . . . . 2.0 108.951 179.778 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 5' ' ' LYS . . . . . 0.414 ' HG2' ' H ' ' A' ' 11' ' ' SER . 0.0 OUTLIER -71.61 178.64 3.44 Favored 'General case' 0 CA--C 1.588 2.427 0 CA-C-N 123.579 2.9 . . . . 2.0 110.756 179.452 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 68.1 tp -58.41 -54.14 50.38 Favored 'General case' 0 N--CA 1.506 2.344 0 O-C-N 118.944 -2.347 . . . . 2.0 116.614 -179.768 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 7' ' ' ILE . . . . . . . . . . . . . 53.9 mt -52.21 141.71 30.31 Favored Pre-proline 0 CA--C 1.586 2.357 0 CA-C-O 117.175 -1.393 . . . . 2.0 114.515 -179.838 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 63.1 Cg_exo -39.03 -47.26 2.9 Favored 'Trans proline' 0 C--N 1.378 2.094 0 N-CA-C 120.271 3.143 . . . . 2.0 120.271 179.901 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 9' ' ' ILE . . . . . . . . . . . . . 11.3 tp -60.74 -39.55 82.08 Favored 'Isoleucine or valine' 0 N--CA 1.507 2.402 0 N-CA-C 113.932 1.086 . . . . 2.0 113.932 179.617 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . 48.55 111.34 0.0 OUTLIER 'General case' 0 CA--C 1.579 2.06 1 N-CA-C 123.97 4.804 . . . . 2.0 123.97 179.384 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 11' ' ' SER . . . . . 0.414 ' H ' ' HG2' ' A' ' 5' ' ' LYS . 98.2 p -58.05 153.45 14.57 Favored 'General case' 0 N--CA 1.501 2.082 0 C-N-CA 124.605 1.162 . . . . 2.0 114.117 179.689 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . 0.279 81.4 tttt -90.93 -93.32 0.13 Allowed 'General case' 0 CA--C 1.581 2.165 0 N-CA-C 121.493 3.886 . . . . 2.0 121.493 -179.544 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 13' ' ' THR . . . . . . . . . . . . . 33.4 m -41.91 136.81 1.95 Allowed 'General case' 0 N--CA 1.498 1.974 0 N-CA-C 120.47 3.507 . . . . 2.0 120.47 -179.567 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 4.1 t -153.19 153.75 29.92 Favored Pre-proline 0 CA--C 1.601 2.934 0 C-N-CA 124.793 1.237 . . . . 2.0 111.226 -179.959 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 15' ' ' PRO . . . . . . . . . . . . . 65.7 Cg_exo -45.27 160.36 0.14 Allowed 'Trans proline' 0 CA--C 1.579 2.741 1 N-CA-C 126.083 5.378 . . . . 2.0 126.083 -179.819 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -82.27 168.22 17.82 Favored 'General case' 0 N--CA 1.5 2.064 0 C-N-CA 125.177 1.391 . . . . 2.0 112.944 179.731 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . 82.96 -49.65 4.26 Favored Glycine 1 N--CA 1.522 4.374 0 N-CA-C 108.162 -1.975 . . . . 2.0 108.162 -179.01 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 30.1 mmtm -72.41 94.8 1.68 Allowed 'General case' 0 CA--C 1.575 1.915 0 C-N-CA 129.32 3.048 . . . . 2.0 105.898 179.354 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 10.2 p30 -94.11 -25.03 17.33 Favored 'General case' 0 N--CA 1.498 1.932 0 N-CA-C 117.212 2.301 . . . . 2.0 117.212 179.913 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 70.2 mt -84.05 111.22 19.11 Favored 'General case' 0 CA--C 1.558 1.28 0 C-N-CA 125.596 1.558 . . . . 2.0 113.617 179.968 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 21' ' ' CYS . . . . . 0.428 ' SG ' HD22 ' A' ' 1' ' ' LEU . 2.0 m -81.25 101.31 9.64 Favored 'General case' 0 CA--C 1.578 2.026 1 N-CA-C 99.621 -4.214 . . . . 2.0 99.621 179.158 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 22' ' ' TYR . . . . . . . . . . . . . 5.8 p90 -83.66 164.26 19.78 Favored 'General case' 0 N--CA 1.48 1.074 0 N-CA-C 120.843 3.646 . . . . 2.0 120.843 -179.31 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . 0.303 10.6 ptpp? -137.66 101.87 4.59 Favored 'General case' 0 CA--C 1.566 1.577 0 N-CA-C 104.389 -2.448 . . . . 2.0 104.389 179.306 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 24' ' ' MET . . . . . . . . . . . . . 4.7 ttt -65.41 92.8 0.13 Allowed 'General case' 0 CA--C 1.563 1.442 0 C-N-CA 125.149 1.38 . . . . 2.0 114.07 -179.803 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 25' ' ' PHE . . . . . . . . . . . . . 5.3 m-30 -81.61 104.14 11.82 Favored 'General case' 0 CA--C 1.568 1.636 0 N-CA-C 103.853 -2.647 . . . . 2.0 103.853 179.491 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 26' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -57.09 127.72 33.37 Favored 'General case' 0 N--CA 1.494 1.753 0 O-C-N 120.797 -1.189 . . . . 2.0 112.279 -179.809 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 27' ' ' MET . . . . . . . . . . . . . 0.1 OUTLIER -48.82 -32.74 9.24 Favored 'General case' 0 N--CA 1.509 2.496 0 N-CA-C 116.613 2.079 . . . . 2.0 116.613 -179.944 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 50.5 m -75.03 -30.61 61.13 Favored 'General case' 0 CA--C 1.592 2.594 0 O-C-N 121.512 -0.743 . . . . 2.0 112.238 179.162 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 56.5 t0 -151.04 92.2 1.79 Allowed 'General case' 0 CA--C 1.571 1.769 0 N-CA-C 105.083 -2.191 . . . . 2.0 105.083 179.687 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 3.2 mm? -65.56 -66.7 0.51 Allowed 'General case' 0 CA--C 1.571 1.769 0 N-CA-C 118.837 2.903 . . . . 2.0 118.837 -179.526 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 31' ' ' THR . . . . . . . . . . . . . 72.1 p -33.83 -48.44 0.29 Allowed 'General case' 0 N--CA 1.506 2.355 0 N-CA-C 120.457 3.503 . . . . 2.0 120.457 -179.704 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 32' ' ' ILE . . . . . . . . . . . . . 2.1 mp -93.96 107.27 26.88 Favored Pre-proline 0 CA--C 1.586 2.356 0 N-CA-C 101.606 -3.479 . . . . 2.0 101.606 179.554 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 33' ' ' PRO . . . . . . . . . . . . . 12.6 Cg_exo -68.79 149.08 72.55 Favored 'Trans proline' 0 CA--C 1.561 1.842 0 N-CA-C 118.383 2.417 . . . . 2.0 118.383 -179.602 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 34' ' ' VAL . . . . . . . . . . . . 0.283 24.5 t -86.75 -29.77 5.88 Favored 'Isoleucine or valine' 0 CA--C 1.583 2.249 0 C-N-CA 123.579 0.751 . . . . 2.0 111.543 179.421 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER -144.81 167.02 23.58 Favored 'General case' 0 CA--C 1.559 1.317 0 CA-C-O 123.602 1.668 . . . . 2.0 110.067 179.453 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 6.6 mtp180 -150.69 108.89 3.75 Favored 'General case' 0 CA--C 1.571 1.773 0 N-CA-C 104.814 -2.291 . . . . 2.0 104.814 -179.867 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . -140.97 -144.58 4.46 Favored Glycine 0 N--CA 1.498 2.824 0 N-CA-C 118.393 2.117 . . . . 2.0 118.393 -179.697 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 38' ' ' CYS . . . . . . . . . . . . . 20.8 p -130.93 131.99 44.81 Favored 'General case' 0 N--CA 1.494 1.738 0 N-CA-C 113.653 0.983 . . . . 2.0 113.653 179.99 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 39' ' ' ILE . . . . . 0.488 HG21 ' HD3' ' A' ' 43' ' ' PRO . 9.6 tp -152.85 175.83 0.58 Allowed 'Isoleucine or valine' 0 N--CA 1.498 1.969 0 C-N-CA 124.182 0.993 . . . . 2.0 112.751 -179.839 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 40' ' ' ASP . . . . . 0.428 ' H ' HG13 ' A' ' 39' ' ' ILE . 13.3 p-10 -108.02 -28.88 9.3 Favored 'General case' 0 N--CA 1.497 1.908 0 O-C-N 119.527 -1.983 . . . . 2.0 113.53 179.354 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 8.0 t -140.35 27.54 0.48 Allowed 'Isoleucine or valine' 0 N--CA 1.506 2.334 0 CA-C-N 120.134 1.334 . . . . 2.0 112.649 179.952 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 42' ' ' CYS . . . . . . . . . . . . 0.359 2.8 m 77.11 115.75 0.03 OUTLIER Pre-proline 0 CA--C 1.615 3.469 1 N-CA-C 97.03 -5.174 . . . . 2.0 97.03 -179.221 . . . . . . . . 3 2 . 1 . 011 nuclear build full ' A' A ' 43' ' ' PRO . . . . . 0.488 ' HD3' HG21 ' A' ' 39' ' ' ILE 0.45 80.0 Cg_exo -30.06 -60.06 0.13 Allowed 'Trans proline' 0 C--N 1.371 1.745 1 N-CA-C 127.799 6.038 . . . . 2.0 127.799 -178.484 . . . . . . . . 4 3 . 1 . 011 nuclear build full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 9.1 mtmm 160.78 91.14 0.0 OUTLIER 'General case' 0 CA--C 1.561 1.373 1 N-CA-C 98.512 -4.625 . . . . 2.0 98.512 -179.879 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 45' ' ' ASN . . . . . . . . . . . . . 4.6 p-10 -66.02 113.76 4.68 Favored 'General case' 0 CA--C 1.572 1.798 0 N-CA-C 114.759 1.392 . . . . 2.0 114.759 -179.713 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 10.8 t -113.02 -169.96 1.58 Allowed 'General case' 0 N--CA 1.492 1.669 0 N-CA-C 114.09 1.145 . . . . 2.0 114.09 -179.947 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 47' ' ' LEU . . . . . . . . . . . . . 6.7 mp -54.77 -16.33 2.5 Favored 'General case' 0 N--CA 1.509 2.492 0 N-CA-C 116.984 2.216 . . . . 2.0 116.984 179.803 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 74.6 mt -103.98 -3.49 24.59 Favored 'General case' 0 CA--C 1.578 2.046 0 C-N-CA 125.577 1.551 . . . . 2.0 112.366 179.456 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 49' ' ' VAL . . . . . . . . . . . . . 7.2 p -166.91 150.78 1.56 Allowed 'Isoleucine or valine' 0 N--CA 1.5 2.071 0 N-CA-C 118.114 2.635 . . . . 2.0 118.114 -179.645 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 55.7 tttp -134.1 111.06 10.03 Favored 'General case' 0 CA--C 1.571 1.781 1 N-CA-C 98.259 -4.719 . . . . 2.0 98.259 179.391 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 86.8 m-85 -92.3 122.31 34.65 Favored 'General case' 0 N--CA 1.497 1.917 0 N-CA-C 118.573 2.805 . . . . 2.0 118.573 -179.353 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 52' ' ' VAL . . . . . . . . . . . . . 53.3 t -92.6 106.25 17.64 Favored 'Isoleucine or valine' 0 N--CA 1.503 2.208 0 N-CA-C 102.982 -2.97 . . . . 2.0 102.982 179.522 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 53' ' ' CYS . . . . . . . . . . . . 0.261 0.7 OUTLIER -108.16 139.32 43.01 Favored 'General case' 0 CA--C 1.575 1.923 0 N-CA-C 118.988 2.958 . . . . 2.0 118.988 -179.323 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 54' ' ' CYS . . . . . . . . . . . . . 30.0 p -127.71 118.83 24.54 Favored 'General case' 0 CA--C 1.575 1.922 0 C-N-CA 124.035 0.934 . . . . 2.0 110.834 179.821 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 4.8 p-10 -57.11 37.61 0.0 OUTLIER 'General case' 0 N--CA 1.508 2.463 1 N-CA-C 124.981 5.178 . . . . 2.0 124.981 -179.584 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 6.3 t -158.55 174.33 15.24 Favored 'General case' 0 N--CA 1.503 2.21 0 O-C-N 119.326 -2.109 . . . . 2.0 114.168 179.939 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 57' ' ' ASP . . . . . . . . . . . . . 69.4 m-20 -66.94 129.56 40.28 Favored 'General case' 0 CA--C 1.571 1.782 0 O-C-N 120.325 -1.485 . . . . 2.0 114.82 179.932 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 58' ' ' ARG . . . . . . . . . . . . 0.332 40.1 mtp85 52.19 24.71 2.91 Favored 'General case' 0 N--CA 1.499 2.008 0 N-CA-C 118.726 2.862 . . . . 2.0 118.726 179.917 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 59' ' ' CYS . . . . . . . . . . . . . 29.2 p -77.37 -19.89 55.57 Favored 'General case' 0 CA--C 1.579 2.06 0 O-C-N 120.668 -1.27 . . . . 2.0 114.352 179.608 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 60' ' ' ASN . . . . . . . . . . . . . 34.9 p-10 . . . . . 0 CA--C 1.563 1.473 0 CA-C-O 124.392 2.044 . . . . 2.0 113.525 179.881 . . . . . . . . 0 0 . 1 . 001 nuclear nobuild core ' A' A ' 1' ' ' LEU . . . . . 0.466 ' C ' ' H ' ' A' ' 14' ' ' CYS . 3.4 tm? . . . . . 0 N--CA 1.495 1.782 0 CA-C-O 117.023 -1.465 . . . . 2.0 111.804 . . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 54.7 tptt -119.84 -55.31 2.1 Favored 'General case' 0 N--CA 1.514 2.757 0 CA-C-N 121.886 2.13 . . . . 2.0 109.181 179.656 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 3' ' ' CYS . . . . . . . . . . . . 0.312 1.9 m 76.6 -172.87 0.09 Allowed 'General case' 0 CA--C 1.563 1.471 0 N-CA-C 114.38 1.252 . . . . 2.0 114.38 -179.9 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 79.5 m-20 -91.05 152.48 20.63 Favored 'General case' 0 CA--C 1.55 0.955 0 N-CA-C 115.312 1.597 . . . . 2.0 115.312 -179.803 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 18.3 ptpt -90.84 -156.91 0.46 Allowed 'General case' 0 CA--C 1.579 2.087 0 N-CA-C 104.913 -2.254 . . . . 2.0 104.913 179.103 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 3.8 mm? -54.9 -34.0 62.6 Favored 'General case' 0 N--CA 1.512 2.637 0 O-C-N 117.679 -3.138 . . . . 2.0 115.154 179.665 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 7' ' ' ILE . . . . . . . . . . . . . 35.1 mt -75.74 141.43 72.21 Favored Pre-proline 0 CA--C 1.586 2.329 0 C-N-CA 125.312 1.445 . . . . 2.0 112.426 179.871 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 77.4 Cg_exo -55.94 -40.13 86.92 Favored 'Trans proline' 0 CA--C 1.57 2.321 0 C-N-CA 122.836 2.357 . . . . 2.0 117.964 179.596 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 9' ' ' ILE . . . . . . . . . . . . . 10.7 tp -97.75 93.04 3.13 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.726 0 C-N-CA 124.144 0.977 . . . . 2.0 111.083 179.969 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 10' ' ' ALA . . . . . . . . . . . . 0.466 . . -133.71 -166.97 1.86 Allowed 'General case' 0 CA--C 1.583 2.223 0 N-CA-C 114.828 1.418 . . . . 2.0 114.828 179.991 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 11' ' ' SER . . . . . . . . . . . . 0.368 2.0 t -43.66 165.69 0.01 OUTLIER 'General case' 0 CA--C 1.586 2.34 1 N-CA-C 127.027 5.936 . . . . 2.0 127.027 -179.351 . . . . . . . . 3 2 . 1 . 001 nuclear nobuild core ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 1.6 ttmp? -105.99 -74.96 0.64 Allowed 'General case' 0 CA--C 1.577 2.008 0 N-CA-C 121.475 3.88 . . . . 2.0 121.475 -179.545 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 13' ' ' THR . . . . . . . . . . . . . 14.9 t -135.22 124.32 24.37 Favored 'General case' 0 N--CA 1.506 2.33 0 N-CA-C 121.741 3.978 . . . . 2.0 121.741 -179.374 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 14' ' ' CYS . . . . . 0.554 ' SG ' ' HD2' ' A' ' 18' ' ' LYS . 0.5 OUTLIER -106.5 171.94 4.33 Favored Pre-proline 0 CA--C 1.599 2.863 0 C-N-CA 126.613 1.965 . . . . 2.0 108.938 179.493 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 15' ' ' PRO . . . . . . . . . . . . . 83.5 Cg_exo -49.04 174.63 0.03 OUTLIER 'Trans proline' 0 CA--C 1.57 2.288 1 N-CA-C 124.474 4.759 . . . . 2.0 124.474 -179.722 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . 32.82 -172.87 0.0 OUTLIER 'General case' 0 N--CA 1.5 2.065 1 N-CA-C 123.558 4.651 . . . . 2.0 123.558 179.734 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . -82.59 38.71 2.65 Favored Glycine 0 N--CA 1.502 3.092 0 O-C-N 120.296 -1.503 . . . . 2.0 113.861 179.459 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 18' ' ' LYS . . . . . 0.554 ' HD2' ' SG ' ' A' ' 14' ' ' CYS . 0.1 OUTLIER -82.91 74.63 9.85 Favored 'General case' 0 CA--C 1.566 1.573 0 C-N-CA 125.546 1.538 . . . . 2.0 109.059 179.902 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 7.8 p30 -57.18 -36.65 71.06 Favored 'General case' 0 N--CA 1.487 1.403 1 N-CA-C 122.821 4.378 . . . . 2.0 122.821 -179.626 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 88.2 mt -70.18 122.96 20.48 Favored 'General case' 0 CA--C 1.558 1.251 0 N-CA-C 117.209 2.3 . . . . 2.0 117.209 -179.801 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 21' ' ' CYS . . . . . 0.562 ' SG ' ' O ' ' A' ' 56' ' ' THR . 32.1 m -82.91 95.34 7.94 Favored 'General case' 0 CA--C 1.566 1.565 0 N-CA-C 102.516 -3.142 . . . . 2.0 102.516 179.314 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 22' ' ' TYR . . . . . . . . . . . . 0.442 0.0 OUTLIER -61.57 153.17 28.44 Favored 'General case' 0 CA--C 1.554 1.12 0 N-CA-C 118.018 2.599 . . . . 2.0 118.018 -179.478 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 39.2 ttmt -133.98 76.67 1.67 Allowed 'General case' 0 CA--C 1.563 1.442 0 N-CA-C 103.373 -2.825 . . . . 2.0 103.373 179.584 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 24' ' ' MET . . . . . . . . . . . . 0.262 5.9 ttt -63.17 78.67 0.02 OUTLIER 'General case' 0 CA--C 1.567 1.609 0 C-N-CA 126.037 1.735 . . . . 2.0 113.968 -179.838 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 25' ' ' PHE . . . . . . . . . . . . . 13.9 m-85 -72.35 147.37 46.35 Favored 'General case' 0 N--CA 1.485 1.318 0 N-CA-C 113.784 1.031 . . . . 2.0 113.784 179.976 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 26' ' ' MET . . . . . . . . . . . . . 73.4 mtp -72.04 127.16 31.68 Favored 'General case' 0 N--CA 1.493 1.696 0 O-C-N 121.307 -0.871 . . . . 2.0 108.85 179.51 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 27' ' ' MET . . . . . . . . . . . . . 27.9 ttt -55.76 -36.45 67.32 Favored 'General case' 0 N--CA 1.513 2.708 0 CA-C-N 121.621 2.01 . . . . 2.0 111.717 179.365 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 73.2 m -76.85 -29.6 55.93 Favored 'General case' 0 CA--C 1.585 2.308 0 N-CA-C 114.163 1.172 . . . . 2.0 114.163 179.324 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 8.9 t70 -150.76 81.12 1.34 Allowed 'General case' 0 CA--C 1.57 1.748 0 O-C-N 120.174 -1.579 . . . . 2.0 108.558 179.695 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 1.8 mm? -45.79 -75.98 0.03 OUTLIER 'General case' 0 CA--C 1.575 1.927 0 N-CA-C 120.688 3.588 . . . . 2.0 120.688 -179.507 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 31' ' ' THR . . . . . . . . . . . . 0.259 43.4 p -6.71 -66.87 0.0 OUTLIER 'General case' 0 N--CA 1.506 2.341 1 N-CA-C 122.511 4.263 . . . . 2.0 122.511 -179.735 . . . . . . . . 3 2 . 1 . 001 nuclear nobuild core ' A' A ' 32' ' ' ILE . . . . . . . . . . . . . 2.0 mp -99.04 106.89 40.96 Favored Pre-proline 0 CA--C 1.584 2.265 0 N-CA-C 102.173 -3.269 . . . . 2.0 102.173 179.726 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 33' ' ' PRO . . . . . . . . . . . . . 21.5 Cg_exo -59.39 166.02 8.34 Favored 'Trans proline' 0 CA--C 1.559 1.753 1 N-CA-C 123.744 4.478 . . . . 2.0 123.744 -179.658 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 34' ' ' VAL . . . . . . . . . . . . . 78.7 t -76.14 -51.67 19.47 Favored 'Isoleucine or valine' 0 CA--C 1.592 2.57 0 N-CA-C 103.125 -2.917 . . . . 2.0 103.125 178.637 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 59.9 mttm -143.43 167.52 21.99 Favored 'General case' 0 CA--C 1.564 1.494 0 CA-C-O 125.574 2.606 . . . . 2.0 108.652 179.451 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 9.1 mtp180 -142.88 119.56 11.13 Favored 'General case' 0 CA--C 1.582 2.191 1 N-CA-C 98.184 -4.747 . . . . 2.0 98.184 179.7 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . -157.8 -134.84 1.8 Allowed Glycine 0 N--CA 1.488 2.107 0 O-C-N 118.942 -2.349 . . . . 2.0 118.891 -179.44 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 38' ' ' CYS . . . . . . . . . . . . . 26.9 p -123.23 138.92 54.52 Favored 'General case' 0 N--CA 1.489 1.51 0 N-CA-C 117.421 2.378 . . . . 2.0 117.421 -179.821 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 39' ' ' ILE . . . . . 0.443 HG12 ' CG ' ' A' ' 43' ' ' PRO . 2.2 tp -164.65 159.01 1.29 Allowed 'Isoleucine or valine' 0 CA--C 1.576 1.959 0 N-CA-C 115.312 1.597 . . . . 2.0 115.312 -179.909 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 40' ' ' ASP . . . . . . . . . . . . . 9.3 p-10 -78.69 -48.14 15.58 Favored 'General case' 0 N--CA 1.506 2.363 0 O-C-N 119.751 -1.843 . . . . 2.0 114.313 179.595 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 91.2 t -135.83 144.02 34.7 Favored 'Isoleucine or valine' 0 CA--C 1.56 1.346 0 N-CA-C 102.972 -2.973 . . . . 2.0 102.972 179.703 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 42' ' ' CYS . . . . . . . . . . . . . 0.8 OUTLIER -58.37 105.49 0.55 Allowed Pre-proline 0 CA--C 1.603 3.01 0 N-CA-C 101.401 -3.555 . . . . 2.0 101.401 179.578 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 43' ' ' PRO . . . . . 0.443 ' CG ' HG12 ' A' ' 39' ' ' ILE . 24.7 Cg_exo -50.18 177.92 0.03 OUTLIER 'Trans proline' 0 C--N 1.372 1.811 1 N-CA-C 125.105 5.002 . . . . 2.0 125.105 -178.571 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 9.7 mtmp? -70.14 92.22 0.74 Allowed 'General case' 0 CA--C 1.566 1.589 0 N-CA-C 105.511 -2.033 . . . . 2.0 105.511 179.534 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 45' ' ' ASN . . . . . . . . . . . . . 2.5 p-10 -60.06 114.05 2.65 Favored 'General case' 0 CA--C 1.567 1.601 0 N-CA-C 116.73 2.122 . . . . 2.0 116.73 -179.402 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 7.8 t -80.09 -178.03 6.33 Favored 'General case' 0 CA--C 1.567 1.608 0 N-CA-C 114.667 1.358 . . . . 2.0 114.667 179.968 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 47' ' ' LEU . . . . . . . . . . . . . 97.4 mt -51.74 -28.34 14.8 Favored 'General case' 0 N--CA 1.505 2.309 0 N-CA-C 115.955 1.835 . . . . 2.0 115.955 179.777 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 79.1 mt -101.84 7.44 41.64 Favored 'General case' 0 CA--C 1.581 2.14 0 N-CA-C 114.518 1.303 . . . . 2.0 114.518 179.735 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 49' ' ' VAL . . . . . . . . . . . . . 13.9 p -148.14 159.67 7.4 Favored 'Isoleucine or valine' 0 N--CA 1.5 2.067 0 CA-C-N 122.195 2.27 . . . . 2.0 117.127 -179.518 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 13.3 tmtt? -155.27 86.65 1.09 Allowed 'General case' 0 CA--C 1.573 1.84 0 N-CA-C 101.625 -3.472 . . . . 2.0 101.625 179.562 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 36.7 m-85 -69.56 127.32 32.58 Favored 'General case' 0 CA--C 1.57 1.735 0 N-CA-C 121.442 3.867 . . . . 2.0 121.442 -179.297 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 52' ' ' VAL . . . . . . . . . . . . 0.323 8.6 t -99.51 162.51 2.98 Favored 'Isoleucine or valine' 0 CA--C 1.586 2.349 0 N-CA-C 102.574 -3.121 . . . . 2.0 102.574 178.881 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 53' ' ' CYS . . . . . . . . . . . . 0.318 1.2 p -166.2 153.47 9.83 Favored 'General case' 0 N--CA 1.495 1.801 0 O-C-N 117.388 -3.32 . . . . 2.0 117.993 -179.046 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 54' ' ' CYS . . . . . . . . . . . . 0.389 23.2 p -151.13 117.61 5.71 Favored 'General case' 0 CA--C 1.583 2.25 0 CA-C-O 122.946 1.355 . . . . 2.0 111.694 179.412 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 9.7 m120 -30.27 -0.8 0.0 OUTLIER 'General case' 0 CA--C 1.582 2.19 1 N-CA-C 129.681 6.919 . . . . 2.0 129.681 -179.596 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 56' ' ' THR . . . . . 0.562 ' O ' ' SG ' ' A' ' 21' ' ' CYS . 7.2 t -143.46 160.85 39.83 Favored 'General case' 0 N--CA 1.515 2.782 0 CA-C-N 125.564 3.802 . . . . 2.0 116.225 -179.747 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 57' ' ' ASP . . . . . . . . . . . . . 44.1 m-20 -46.27 104.07 0.05 OUTLIER 'General case' 0 N--CA 1.503 2.203 0 N-CA-C 118.416 2.747 . . . . 2.0 118.416 -179.783 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 58' ' ' ARG . . . . . . . . . . . . 0.315 27.7 mtm180 82.27 16.8 0.39 Allowed 'General case' 0 N--CA 1.507 2.405 0 C-N-CA 125.481 1.512 . . . . 2.0 115.057 -179.695 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 59' ' ' CYS . . . . . . . . . . . . . 34.0 t -63.84 -26.34 68.57 Favored 'General case' 0 CA--C 1.58 2.11 0 N-CA-C 115.148 1.536 . . . . 2.0 115.148 179.689 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 60' ' ' ASN . . . . . . . . . . . . . 51.2 p30 . . . . . 0 CA--C 1.568 1.652 0 CA-C-O 124.309 2.004 . . . . 2.0 114.975 179.837 . . . . . . . . 0 0 . 1 . 002 nuclear nobuild core ' A' A ' 1' ' ' LEU . . . . . 0.436 HD23 ' SG ' ' A' ' 3' ' ' CYS . 14.2 tp . . . . . 0 CA--C 1.567 1.597 0 N-CA-C 113.883 1.068 . . . . 2.0 113.883 . . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 27.5 mtpt -89.87 130.33 36.11 Favored 'General case' 0 CA--C 1.571 1.776 0 N-CA-C 106.118 -1.808 . . . . 2.0 106.118 179.399 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 3' ' ' CYS . . . . . 0.436 ' SG ' HD23 ' A' ' 1' ' ' LEU . 90.8 m -131.75 -171.44 2.62 Favored 'General case' 0 N--CA 1.499 2.012 0 O-C-N 119.374 -2.079 . . . . 2.0 113.935 -179.84 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 77.9 m-20 -135.83 118.92 16.46 Favored 'General case' 0 CA--C 1.558 1.262 0 C-N-CA 123.562 0.745 . . . . 2.0 112.789 179.943 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -71.14 177.12 3.96 Favored 'General case' 0 CA--C 1.594 2.65 0 CA-C-N 120.34 1.427 . . . . 2.0 110.438 179.209 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 32.1 mt -48.72 -43.45 37.31 Favored 'General case' 0 N--CA 1.514 2.758 0 N-CA-C 119.394 3.109 . . . . 2.0 119.394 -179.84 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 7' ' ' ILE . . . . . . . . . . . . . 46.4 mm -35.62 139.11 0.39 Allowed Pre-proline 0 CA--C 1.583 2.214 0 N-CA-C 116.636 2.088 . . . . 2.0 116.636 -179.87 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 49.4 Cg_exo -37.39 -51.94 1.56 Allowed 'Trans proline' 0 CA--C 1.565 2.055 0 C-N-CA 123.673 2.916 . . . . 2.0 118.729 -179.961 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 9' ' ' ILE . . . . . . . . . . . . 0.31 17.4 tt -84.63 -71.69 0.41 Allowed 'Isoleucine or valine' 0 N--CA 1.496 1.852 0 N-CA-C 107.745 -1.206 . . . . 2.0 107.745 179.471 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . 58.76 137.55 0.01 OUTLIER 'General case' 0 CA--C 1.574 1.887 0 N-CA-C 119.447 3.128 . . . . 2.0 119.447 179.639 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 38.8 t -147.99 -143.61 0.14 Allowed 'General case' 0 CA--C 1.581 2.158 0 O-C-N 120.32 -1.487 . . . . 2.0 111.644 -179.943 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 12' ' ' LYS . . . . . . . . . . . . 0.369 3.9 ttmt 92.14 174.98 0.02 OUTLIER 'General case' 0 N--CA 1.503 2.188 0 C-N-CA 126.061 1.745 . . . . 2.0 115.172 -179.915 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 13' ' ' THR . . . . . . . . . . . . . 84.9 m -152.66 149.59 28.58 Favored 'General case' 0 N--CA 1.495 1.807 0 N-CA-C 114.007 1.114 . . . . 2.0 114.007 -179.689 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 14' ' ' CYS . . . . . . . . . . . . 0.295 0.1 OUTLIER -134.16 176.97 2.48 Favored Pre-proline 0 CA--C 1.599 2.85 0 C-N-CA 124.545 1.138 . . . . 2.0 109.625 179.398 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 15' ' ' PRO . . . . . . . . . . . . . 88.0 Cg_exo -52.99 172.2 0.2 Allowed 'Trans proline' 0 CA--C 1.572 2.422 1 N-CA-C 126.232 5.435 . . . . 2.0 126.232 -179.64 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -78.56 169.97 17.4 Favored 'General case' 0 N--CA 1.498 1.938 0 N-CA-C 107.965 -1.124 . . . . 2.0 107.965 179.247 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . 83.79 -50.41 4.4 Favored Glycine 1 N--CA 1.519 4.201 0 O-C-N 118.295 -2.753 . . . . 2.0 106.942 -178.953 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 73.9 mmtt -78.76 71.62 5.23 Favored 'General case' 0 CA--C 1.581 2.168 0 N-CA-C 104.259 -2.497 . . . . 2.0 104.259 179.105 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 8.5 p30 -82.15 -21.48 36.56 Favored 'General case' 0 N--CA 1.49 1.571 1 N-CA-C 121.928 4.047 . . . . 2.0 121.928 -179.513 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 86.0 mt -88.16 119.54 28.65 Favored 'General case' 0 CA--C 1.553 1.087 0 N-CA-C 113.298 0.851 . . . . 2.0 113.298 -179.934 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 21' ' ' CYS . . . . . 0.407 ' SG ' HD21 ' A' ' 1' ' ' LEU . 4.5 m -83.96 100.82 11.28 Favored 'General case' 0 CA--C 1.58 2.131 1 N-CA-C 99.664 -4.198 . . . . 2.0 99.664 179.198 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 22' ' ' TYR . . . . . . . . . . . . . 4.7 p90 -75.45 159.58 31.19 Favored 'General case' 0 CA--C 1.556 1.181 0 N-CA-C 119.505 3.15 . . . . 2.0 119.505 -179.349 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 29.4 ttpt -139.03 98.65 3.58 Favored 'General case' 0 CA--C 1.565 1.556 0 N-CA-C 103.219 -2.882 . . . . 2.0 103.219 179.567 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 24' ' ' MET . . . . . 0.526 ' SD ' ' HB2' ' A' ' 35' ' ' LYS . 13.6 ttm -69.73 74.93 0.43 Allowed 'General case' 0 CA--C 1.57 1.737 0 N-CA-C 114.805 1.409 . . . . 2.0 114.805 -179.76 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 25' ' ' PHE . . . . . . . . . . . . . 4.5 m-30 -62.48 128.09 34.36 Favored 'General case' 0 N--CA 1.497 1.917 0 O-C-N 120.431 -1.418 . . . . 2.0 112.121 179.821 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 26' ' ' MET . . . . . . . . . . . . . 76.5 mtp -57.31 129.32 41.25 Favored 'General case' 0 N--CA 1.497 1.886 0 N-CA-C 114.305 1.224 . . . . 2.0 114.305 179.895 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 27' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -59.09 -39.42 82.12 Favored 'General case' 0 N--CA 1.512 2.644 0 CA-C-N 120.985 1.72 . . . . 2.0 110.742 179.381 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 48.9 m -68.75 -34.35 75.44 Favored 'General case' 0 CA--C 1.584 2.281 0 N-CA-C 113.647 0.981 . . . . 2.0 113.647 179.368 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 8.9 t70 -155.47 84.49 1.05 Allowed 'General case' 0 CA--C 1.572 1.794 0 O-C-N 120.631 -1.293 . . . . 2.0 109.343 179.671 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 30' ' ' LEU . . . . . 0.471 ' H ' HD22 ' A' ' 30' ' ' LEU . 2.3 mm? -44.43 -41.51 6.3 Favored 'General case' 0 CA--C 1.574 1.887 0 N-CA-C 120.76 3.615 . . . . 2.0 120.76 -179.776 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 31' ' ' THR . . . . . . . . . . . . . 43.3 p -41.06 -54.82 2.73 Favored 'General case' 0 N--CA 1.502 2.138 0 N-CA-C 119.587 3.18 . . . . 2.0 119.587 -179.784 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 32' ' ' ILE . . . . . . . . . . . . . 2.1 mp -96.61 114.63 64.81 Favored Pre-proline 0 CA--C 1.586 2.34 0 N-CA-C 106.7 -1.593 . . . . 2.0 106.7 179.914 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 33' ' ' PRO . . . . . . . . . . . . . 13.3 Cg_exo -70.29 151.0 65.84 Favored 'Trans proline' 0 CA--C 1.572 2.422 0 N-CA-C 119.261 2.754 . . . . 2.0 119.261 -179.871 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 34' ' ' VAL . . . . . . . . . . . . . 60.9 t -79.14 -38.75 20.63 Favored 'Isoleucine or valine' 0 N--CA 1.509 2.489 0 C-N-CA 124.397 1.079 . . . . 2.0 111.119 179.445 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 35' ' ' LYS . . . . . 0.526 ' HB2' ' SD ' ' A' ' 24' ' ' MET . 18.1 tptt -147.93 170.32 17.95 Favored 'General case' 0 CA--C 1.559 1.295 0 CA-C-O 123.986 1.85 . . . . 2.0 110.151 179.817 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 36' ' ' ARG . . . . . . . . . . . . 0.269 7.2 ttp180 -148.21 114.27 5.81 Favored 'General case' 0 CA--C 1.575 1.939 0 N-CA-C 101.423 -3.547 . . . . 2.0 101.423 -179.906 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . -145.65 -148.99 4.91 Favored Glycine 0 N--CA 1.496 2.694 0 N-CA-C 119.793 2.677 . . . . 2.0 119.793 -179.561 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 38' ' ' CYS . . . . . . . . . . . . . 13.6 p -126.42 137.27 53.4 Favored 'General case' 0 CA--C 1.571 1.752 0 C-N-CA 123.89 0.876 . . . . 2.0 112.064 179.933 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 39' ' ' ILE . . . . . 0.841 HG21 ' HD3' ' A' ' 43' ' ' PRO . 10.5 tp -165.03 165.77 0.55 Allowed 'Isoleucine or valine' 0 N--CA 1.509 2.494 0 O-C-N 120.595 -1.316 . . . . 2.0 113.997 -179.703 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 40' ' ' ASP . . . . . . . . . . . . . 7.9 p-10 -79.31 -46.95 16.7 Favored 'General case' 0 N--CA 1.505 2.29 0 O-C-N 119.283 -2.136 . . . . 2.0 114.471 179.493 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 80.5 t -130.75 152.03 36.87 Favored 'Isoleucine or valine' 0 CA--C 1.576 1.965 0 C-N-CA 127.134 2.174 . . . . 2.0 105.275 179.644 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 42' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -52.59 111.01 2.23 Favored Pre-proline 0 N--CA 1.526 3.332 0 N-CA-C 102.745 -3.057 . . . . 2.0 102.745 179.359 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 43' ' ' PRO . . . . . 0.841 ' HD3' HG21 ' A' ' 39' ' ' ILE 0.548 71.7 Cg_exo -11.94 -109.4 0.0 OUTLIER 'Trans proline' 0 C--N 1.378 2.079 2 C-N-CA 125.799 4.332 . . . . 2.0 123.02 -178.408 . . . . . . . . 4 3 . 1 . 002 nuclear nobuild core ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 6.0 mtmp? -159.8 95.28 1.18 Allowed 'General case' 0 CA--C 1.556 1.183 1 N-CA-C 96.68 -5.304 . . . . 2.0 96.68 179.691 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 45' ' ' ASN . . . . . . . . . . . . . 2.8 p-10 -62.66 97.47 0.1 Allowed 'General case' 0 CA--C 1.575 1.912 0 N-CA-C 116.404 2.001 . . . . 2.0 116.404 -179.522 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 13.7 t -79.64 -179.18 6.74 Favored 'General case' 0 CA--C 1.567 1.615 0 N-CA-C 114.35 1.241 . . . . 2.0 114.35 179.981 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 47' ' ' LEU . . . . . . . . . . . . 0.385 1.3 pp -54.52 -15.66 1.88 Allowed 'General case' 0 N--CA 1.509 2.521 0 N-CA-C 117.938 2.57 . . . . 2.0 117.938 179.819 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 84.5 mt -104.29 3.49 32.64 Favored 'General case' 0 CA--C 1.59 2.501 0 C-N-CA 125.463 1.505 . . . . 2.0 111.471 179.133 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 49' ' ' VAL . . . . . . . . . . . . . 6.7 p -157.7 156.09 4.43 Favored 'Isoleucine or valine' 0 CA--C 1.579 2.082 0 N-CA-C 118.439 2.755 . . . . 2.0 118.439 -179.584 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -145.81 72.37 1.3 Allowed 'General case' 0 CA--C 1.584 2.258 0 N-CA-C 103.143 -2.91 . . . . 2.0 103.143 179.097 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 97.2 m-85 -44.88 133.72 6.09 Favored 'General case' 0 CA--C 1.574 1.896 0 N-CA-C 120.402 3.482 . . . . 2.0 120.402 -179.498 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 52' ' ' VAL . . . . . . . . . . . . . 40.6 t -115.9 103.02 14.55 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.897 0 N-CA-C 103.081 -2.933 . . . . 2.0 103.081 179.726 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 53' ' ' CYS . . . . . . . . . . . . 0.255 4.2 m -121.11 153.65 37.19 Favored 'General case' 0 CA--C 1.569 1.695 0 N-CA-C 117.881 2.548 . . . . 2.0 117.881 -179.6 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 54' ' ' CYS . . . . . . . . . . . . 0.351 8.6 p -141.73 127.69 19.46 Favored 'General case' 0 CA--C 1.577 2.019 0 CA-C-O 122.427 1.108 . . . . 2.0 111.065 179.703 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 4.7 p-10 -53.15 36.24 0.0 OUTLIER 'General case' 0 N--CA 1.5 2.062 1 N-CA-C 125.8 5.481 . . . . 2.0 125.8 -179.56 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 56' ' ' THR . . . . . . . . . . . . 0.253 7.2 t -153.8 170.88 19.9 Favored 'General case' 0 N--CA 1.499 2.022 0 O-C-N 119.443 -2.035 . . . . 2.0 114.424 179.968 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 57' ' ' ASP . . . . . . . . . . . . . 73.3 m-20 -60.98 117.96 6.13 Favored 'General case' 0 CA--C 1.563 1.444 0 N-CA-C 114.487 1.291 . . . . 2.0 114.487 -179.807 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 58' ' ' ARG . . . . . . . . . . . . . 78.0 mtt85 64.09 20.51 12.22 Favored 'General case' 0 N--CA 1.5 2.075 0 N-CA-C 116.222 1.934 . . . . 2.0 116.222 -179.834 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 59' ' ' CYS . . . . . . . . . . . . . 49.3 t -62.84 -28.82 70.28 Favored 'General case' 0 CA--C 1.575 1.94 0 N-CA-C 116.7 2.111 . . . . 2.0 116.7 179.912 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 60' ' ' ASN . . . . . . . . . . . . . 41.3 p-10 . . . . . 0 CA--C 1.572 1.793 0 CA-C-O 124.252 1.977 . . . . 2.0 115.46 179.846 . . . . . . . . 0 0 . 1 . 003 nuclear nobuild core ' A' A ' 1' ' ' LEU . . . . . 0.548 HD13 ' SG ' ' A' ' 3' ' ' CYS . 0.5 OUTLIER . . . . . 0 CA--C 1.579 2.058 0 CA-C-O 123.065 1.412 . . . . 2.0 112.51 . . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 53.9 mttp -145.2 111.28 5.56 Favored 'General case' 0 CA--C 1.566 1.559 0 N-CA-C 100.801 -3.777 . . . . 2.0 100.801 179.427 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 3' ' ' CYS . . . . . 0.548 ' SG ' HD13 ' A' ' 1' ' ' LEU . 90.7 m -133.02 156.85 46.6 Favored 'General case' 0 N--CA 1.491 1.588 0 O-C-N 120.335 -1.478 . . . . 2.0 113.909 -179.722 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 29.6 m-20 -105.63 117.18 33.35 Favored 'General case' 0 N--CA 1.487 1.415 0 N-CA-C 114.259 1.207 . . . . 2.0 114.259 -179.768 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 5' ' ' LYS . . . . . . . . . . . . 0.301 1.1 pttt -64.63 -179.9 0.55 Allowed 'General case' 0 CA--C 1.58 2.133 0 O-C-N 120.518 -1.364 . . . . 2.0 112.686 179.634 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -41.75 -43.82 3.03 Favored 'General case' 0 N--CA 1.502 2.171 1 N-CA-C 121.94 4.052 . . . . 2.0 121.94 -179.691 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 7' ' ' ILE . . . . . . . . . . . . . 35.8 mt -55.39 142.15 60.67 Favored Pre-proline 0 CA--C 1.588 2.416 0 CA-C-O 116.882 -1.532 . . . . 2.0 113.227 179.878 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 65.3 Cg_exo -35.54 -54.04 0.77 Allowed 'Trans proline' 0 CA--C 1.57 2.321 0 C-N-CA 123.914 3.076 . . . . 2.0 118.78 179.977 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 9' ' ' ILE . . . . . . . . . . . . . 1.6 pp -126.44 75.27 0.51 Allowed 'Isoleucine or valine' 0 CA--C 1.575 1.924 0 N-CA-C 107.253 -1.388 . . . . 2.0 107.253 179.658 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -80.23 -163.32 0.54 Allowed 'General case' 0 CA--C 1.579 2.087 0 N-CA-C 119.19 3.033 . . . . 2.0 119.19 -179.749 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 8.8 t -57.12 -178.94 0.03 OUTLIER 'General case' 0 CA--C 1.582 2.201 0 N-CA-C 118.091 2.626 . . . . 2.0 118.091 -179.845 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 12' ' ' LYS . . . . . . . . . . . . 0.25 37.1 ttpt -120.97 -93.5 0.52 Allowed 'General case' 0 CA--C 1.578 2.021 0 N-CA-C 118.324 2.712 . . . . 2.0 118.324 -179.64 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 13' ' ' THR . . . . . . . . . . . . . 32.6 m -46.59 134.56 9.36 Favored 'General case' 0 N--CA 1.501 2.087 0 N-CA-C 120.259 3.429 . . . . 2.0 120.259 -179.454 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 3.9 t -149.47 154.57 38.51 Favored Pre-proline 0 CA--C 1.598 2.823 0 C-N-CA 124.616 1.166 . . . . 2.0 111.174 -179.932 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 15' ' ' PRO . . . . . . . . . . . . . 58.4 Cg_exo -43.25 157.63 0.1 Allowed 'Trans proline' 0 CA--C 1.575 2.535 1 N-CA-C 126.659 5.6 . . . . 2.0 126.659 -179.66 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -79.76 168.92 18.68 Favored 'General case' 0 N--CA 1.499 1.981 0 C-N-CA 124.87 1.268 . . . . 2.0 111.385 179.642 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . 83.75 -51.59 4.59 Favored Glycine 1 N--CA 1.519 4.197 0 O-C-N 119.381 -2.074 . . . . 2.0 108.215 -179.049 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 21.1 mmtm -71.87 101.44 2.64 Favored 'General case' 0 CA--C 1.572 1.803 0 C-N-CA 129.048 2.939 . . . . 2.0 106.764 179.386 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 19' ' ' ASN . . . . . . . . . . . . 0.34 0.2 OUTLIER -106.94 -8.11 16.76 Favored 'General case' 0 N--CA 1.499 2.012 0 N-CA-C 117.406 2.372 . . . . 2.0 117.406 179.862 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 89.0 mt -100.2 113.97 27.04 Favored 'General case' 0 CA--C 1.563 1.471 0 C-N-CA 126.141 1.776 . . . . 2.0 109.593 179.605 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 1.3 m -80.23 101.05 8.63 Favored 'General case' 0 CA--C 1.577 1.996 0 N-CA-C 101.457 -3.535 . . . . 2.0 101.457 179.226 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 22' ' ' TYR . . . . . . . . . . . . 0.37 13.2 p90 -75.91 160.29 30.06 Favored 'General case' 0 N--CA 1.484 1.23 0 N-CA-C 119.145 3.016 . . . . 2.0 119.145 -179.509 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 60.2 tttt -135.98 87.31 2.3 Favored 'General case' 0 CA--C 1.565 1.527 0 N-CA-C 103.125 -2.917 . . . . 2.0 103.125 179.846 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 24' ' ' MET . . . . . 0.575 ' HB3' ' H ' ' A' ' 35' ' ' LYS . 24.2 ttt -61.89 76.75 0.02 OUTLIER 'General case' 0 N--CA 1.492 1.659 0 N-CA-C 118.242 2.682 . . . . 2.0 118.242 -179.58 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 25' ' ' PHE . . . . . . . . . . . . . 12.5 m-30 -69.53 128.0 34.96 Favored 'General case' 0 CA--C 1.568 1.656 0 O-C-N 120.598 -1.313 . . . . 2.0 112.328 179.839 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 26' ' ' MET . . . . . . . . . . . . . 32.2 mtm -64.16 132.02 49.17 Favored 'General case' 0 N--CA 1.501 2.087 0 O-C-N 120.308 -1.495 . . . . 2.0 108.524 179.619 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 27' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -53.48 -31.12 44.45 Favored 'General case' 0 N--CA 1.511 2.58 0 CA-C-N 121.772 2.078 . . . . 2.0 114.045 179.775 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 50.3 m -83.73 -39.77 19.7 Favored 'General case' 0 CA--C 1.587 2.371 0 C-N-CA 124.634 1.174 . . . . 2.0 112.004 179.218 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 38.6 t70 -131.66 88.32 2.56 Favored 'General case' 0 CA--C 1.572 1.789 0 N-CA-C 107.08 -1.452 . . . . 2.0 107.08 179.773 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 2.2 mm? -60.57 -82.66 0.02 OUTLIER 'General case' 0 CA--C 1.578 2.022 0 N-CA-C 121.078 3.733 . . . . 2.0 121.078 -179.413 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 31' ' ' THR . . . . . . . . . . . . 0.344 13.9 t -19.13 -52.22 0.01 OUTLIER 'General case' 0 N--CA 1.51 2.543 1 N-CA-C 123.257 4.54 . . . . 2.0 123.257 -179.643 . . . . . . . . 3 2 . 1 . 003 nuclear nobuild core ' A' A ' 32' ' ' ILE . . . . . . . . . . . . . 1.7 mp -97.28 105.93 28.5 Favored Pre-proline 0 CA--C 1.59 2.518 1 N-CA-C 99.314 -4.328 . . . . 2.0 99.314 179.432 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 33' ' ' PRO . . . . . . . . . . . . . 5.5 Cg_endo -73.14 178.23 6.81 Favored 'Trans proline' 0 CA--C 1.568 2.19 0 N-CA-C 120.323 3.163 . . . . 2.0 120.323 -179.446 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 34' ' ' VAL . . . . . . . . . . . . . 56.0 t -85.79 -63.05 1.33 Allowed 'Isoleucine or valine' 0 CA--C 1.585 2.292 0 N-CA-C 106.865 -1.531 . . . . 2.0 106.865 179.309 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 35' ' ' LYS . . . . . 0.575 ' H ' ' HB3' ' A' ' 24' ' ' MET . 38.9 ttmt -139.34 113.62 8.92 Favored 'General case' 0 CA--C 1.558 1.281 0 C-N-CA 124.419 1.088 . . . . 2.0 113.609 -179.9 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 36' ' ' ARG . . . . . . . . . . . . 0.345 51.8 ttp180 -85.69 73.27 10.45 Favored 'General case' 0 CA--C 1.59 2.485 0 O-C-N 120.257 -1.527 . . . . 2.0 110.319 179.971 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . -98.44 -145.84 19.48 Favored Glycine 0 N--CA 1.501 2.976 1 N-CA-C 123.535 4.174 . . . . 2.0 123.535 -179.507 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 38' ' ' CYS . . . . . . . . . . . . . 14.6 p -126.64 132.99 51.1 Favored 'General case' 0 N--CA 1.498 1.955 0 N-CA-C 114.887 1.44 . . . . 2.0 114.887 179.921 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 39' ' ' ILE . . . . . 0.596 HG13 ' H ' ' A' ' 40' ' ' ASP . 6.2 tp -152.81 -174.8 0.18 Allowed 'Isoleucine or valine' 0 N--CA 1.502 2.174 0 C-N-CA 124.7 1.2 . . . . 2.0 111.598 -179.93 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 40' ' ' ASP . . . . . 0.596 ' H ' HG13 ' A' ' 39' ' ' ILE . 4.0 p30 -119.55 -25.94 5.87 Favored 'General case' 0 N--CA 1.5 2.046 0 O-C-N 119.339 -2.101 . . . . 2.0 113.075 179.212 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 54.9 t -137.14 16.53 0.84 Allowed 'Isoleucine or valine' 0 N--CA 1.504 2.235 0 CA-C-N 120.546 1.521 . . . . 2.0 113.001 179.853 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 42' ' ' CYS . . . . . . . . . . . . 0.314 3.1 m 81.59 111.91 0.03 OUTLIER Pre-proline 0 CA--C 1.61 3.271 1 N-CA-C 95.454 -5.758 . . . . 2.0 95.454 -178.972 . . . . . . . . 3 2 . 1 . 003 nuclear nobuild core ' A' A ' 43' ' ' PRO . . . . . 0.496 ' HD3' HG21 ' A' ' 39' ' ' ILE 0.498 41.5 Cg_exo -22.03 -75.27 0.02 OUTLIER 'Trans proline' 0 C--N 1.376 1.998 1 N-CA-C 125.061 4.985 . . . . 2.0 125.061 -178.635 . . . . . . . . 4 3 . 1 . 003 nuclear nobuild core ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 3.4 mtpp -179.74 101.64 0.03 OUTLIER 'General case' 0 CA--C 1.564 1.489 1 N-CA-C 99.881 -4.118 . . . . 2.0 99.881 179.832 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 45' ' ' ASN . . . . . . . . . . . . . 2.5 p-10 -73.82 139.69 45.29 Favored 'General case' 0 N--CA 1.492 1.661 0 O-C-N 120.268 -1.52 . . . . 2.0 114.573 -179.811 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 12.3 t -148.34 -173.48 4.33 Favored 'General case' 0 N--CA 1.49 1.551 0 N-CA-C 112.896 0.702 . . . . 2.0 112.896 179.936 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 47' ' ' LEU . . . . . . . . . . . . . 2.6 pp -57.76 -15.34 7.78 Favored 'General case' 0 N--CA 1.508 2.439 0 N-CA-C 116.578 2.066 . . . . 2.0 116.578 179.572 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 10.0 tp -96.78 -27.0 14.93 Favored 'General case' 0 CA--C 1.579 2.064 0 C-N-CA 126.513 1.925 . . . . 2.0 112.049 179.374 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 49' ' ' VAL . . . . . . . . . . . . . 10.9 p -154.15 146.9 13.87 Favored 'Isoleucine or valine' 0 CA--C 1.579 2.059 0 N-CA-C 119.021 2.971 . . . . 2.0 119.021 -179.522 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 18.9 ttpt -132.18 120.64 22.52 Favored 'General case' 0 CA--C 1.572 1.819 0 N-CA-C 101.7 -3.444 . . . . 2.0 101.7 179.526 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -103.05 135.27 45.04 Favored 'General case' 0 N--CA 1.506 2.34 0 O-C-N 118.393 -2.692 . . . . 2.0 117.635 -179.293 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 52' ' ' VAL . . . . . . . . . . . . . 25.4 t -102.22 97.39 5.59 Favored 'Isoleucine or valine' 0 CA--C 1.575 1.91 0 N-CA-C 104.012 -2.588 . . . . 2.0 104.012 179.588 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 53' ' ' CYS . . . . . . . . . . . . . 0.8 OUTLIER -100.22 132.56 45.51 Favored 'General case' 0 CA--C 1.576 1.966 0 N-CA-C 119.975 3.324 . . . . 2.0 119.975 -179.331 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 54' ' ' CYS . . . . . . . . . . . . . 51.4 t -117.14 124.76 49.97 Favored 'General case' 0 N--CA 1.495 1.82 0 C-N-CA 124.401 1.081 . . . . 2.0 110.305 179.909 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 2.6 t30 -67.54 49.03 0.05 OUTLIER 'General case' 0 N--CA 1.503 2.204 1 N-CA-C 124.22 4.896 . . . . 2.0 124.22 -179.368 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 56' ' ' THR . . . . . . . . . . . . 0.332 5.9 t -163.17 171.12 16.77 Favored 'General case' 0 N--CA 1.503 2.208 0 O-C-N 119.673 -1.892 . . . . 2.0 113.346 179.663 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 57' ' ' ASP . . . . . . . . . . . . . 20.0 m-20 -70.32 107.47 3.78 Favored 'General case' 0 CA--C 1.57 1.722 0 N-CA-C 115.661 1.726 . . . . 2.0 115.661 -179.8 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 58' ' ' ARG . . . . . . . . . . . . 0.278 74.7 mtm180 78.2 13.14 1.61 Allowed 'General case' 0 N--CA 1.502 2.162 0 N-CA-C 116.52 2.044 . . . . 2.0 116.52 179.833 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 59' ' ' CYS . . . . . . . . . . . . . 44.3 t -69.33 -10.79 59.51 Favored 'General case' 0 CA--C 1.577 2.019 0 N-CA-C 117.253 2.316 . . . . 2.0 117.253 179.742 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 60' ' ' ASN . . . . . . . . . . . . . 45.4 p30 . . . . . 0 CA--C 1.561 1.403 0 CA-C-O 125.537 2.589 . . . . 2.0 113.737 179.953 . . . . . . . . 0 0 . 1 . 004 nuclear nobuild core ' A' A ' 1' ' ' LEU . . . . . . . . . . . . 0.313 0.3 OUTLIER . . . . . 0 CA--C 1.57 1.734 0 N-CA-C 113.798 1.036 . . . . 2.0 113.798 . . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 4.1 mmmm -69.09 130.24 42.17 Favored 'General case' 0 N--CA 1.494 1.748 0 O-C-N 120.736 -1.227 . . . . 2.0 110.626 179.833 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 70.7 m -135.1 -169.95 2.48 Favored 'General case' 0 CA--C 1.572 1.792 0 O-C-N 120.493 -1.379 . . . . 2.0 114.364 -179.855 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER -129.8 132.9 46.66 Favored 'General case' 0 N--CA 1.49 1.567 0 C-N-CA 124.98 1.312 . . . . 2.0 110.23 179.909 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 5' ' ' LYS . . . . . 0.447 ' H ' ' HB1' ' A' ' 10' ' ' ALA . 11.9 ptmt -83.84 172.57 12.02 Favored 'General case' 0 CA--C 1.591 2.534 0 CA-C-N 120.183 1.356 . . . . 2.0 107.671 179.088 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 52.1 mt -42.49 -43.69 3.78 Favored 'General case' 0 N--CA 1.514 2.726 0 N-CA-C 119.336 3.087 . . . . 2.0 119.336 -179.758 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 7' ' ' ILE . . . . . . . . . . . . . 43.8 mm -48.02 131.44 12.09 Favored Pre-proline 0 CA--C 1.583 2.213 0 CA-C-O 115.975 -1.964 . . . . 2.0 112.088 179.968 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 8' ' ' PRO . . . . . . . . . . . . 0.323 13.9 Cg_exo -16.01 -68.75 0.01 OUTLIER 'Trans proline' 0 CA--C 1.563 1.965 0 C-N-CA 124.758 3.639 . . . . 2.0 121.547 -179.751 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 9' ' ' ILE . . . . . . . . . . . . 0.298 15.1 tt -88.18 -72.01 0.46 Allowed 'Isoleucine or valine' 0 CA--C 1.573 1.862 0 CA-C-O 118.824 -0.608 . . . . 2.0 109.517 179.72 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 10' ' ' ALA . . . . . 0.447 ' HB1' ' H ' ' A' ' 5' ' ' LYS . . . 52.77 152.02 0.0 OUTLIER 'General case' 0 CA--C 1.576 1.949 1 N-CA-C 121.972 4.064 . . . . 2.0 121.972 179.711 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 20.2 t -148.46 135.27 19.92 Favored 'General case' 0 N--CA 1.492 1.64 0 O-C-N 120.469 -1.394 . . . . 2.0 114.133 -179.97 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 78.1 tttt -135.75 135.16 39.74 Favored 'General case' 0 N--CA 1.493 1.709 0 C-N-CA 125.201 1.4 . . . . 2.0 107.759 179.782 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 13' ' ' THR . . . . . . . . . . . . . 14.3 t -117.12 104.4 11.19 Favored 'General case' 0 N--CA 1.504 2.235 0 CA-C-N 120.845 1.657 . . . . 2.0 111.108 179.962 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 14' ' ' CYS . . . . . . . . . . . . 0.294 0.0 OUTLIER -123.64 168.24 13.02 Favored Pre-proline 0 CA--C 1.588 2.435 0 O-C-N 121.077 -1.014 . . . . 2.0 113.376 179.925 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 15' ' ' PRO . . . . . . . . . . . . . 53.5 Cg_exo -62.78 166.99 12.65 Favored 'Trans proline' 0 N--CA 1.505 2.152 1 N-CA-C 124.989 4.957 . . . . 2.0 124.989 -179.631 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -69.45 173.69 5.65 Favored 'General case' 0 N--CA 1.498 1.958 0 C-N-CA 123.661 0.784 . . . . 2.0 109.14 179.382 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . 84.55 -52.58 4.72 Favored Glycine 0 N--CA 1.516 3.978 0 O-C-N 118.36 -2.712 . . . . 2.0 106.669 -178.963 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 39.4 mmtt -78.74 61.01 2.92 Favored 'General case' 0 CA--C 1.598 2.79 0 N-CA-C 105.224 -2.139 . . . . 2.0 105.224 179.08 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 7.4 p30 -60.96 -41.92 97.27 Favored 'General case' 0 N--CA 1.481 1.123 0 N-CA-C 119.627 3.195 . . . . 2.0 119.627 -179.582 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 97.4 mt -71.93 112.24 7.86 Favored 'General case' 0 CA--C 1.554 1.113 0 N-CA-C 115.44 1.644 . . . . 2.0 115.44 -179.87 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 1.4 m -82.62 97.85 8.71 Favored 'General case' 0 CA--C 1.577 1.994 0 N-CA-C 100.323 -3.954 . . . . 2.0 100.323 179.255 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 22' ' ' TYR . . . . . . . . . . . . 0.381 1.2 p90 -64.87 161.12 18.97 Favored 'General case' 0 CA--C 1.562 1.43 0 N-CA-C 120.65 3.574 . . . . 2.0 120.65 -179.347 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 7.3 tppt? -138.3 98.32 3.58 Favored 'General case' 0 CA--C 1.568 1.665 0 N-CA-C 102.546 -3.131 . . . . 2.0 102.546 179.86 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 24' ' ' MET . . . . . 0.439 ' SD ' ' HB2' ' A' ' 35' ' ' LYS . 10.0 ttt -72.59 85.86 1.18 Allowed 'General case' 0 CA--C 1.565 1.525 0 O-C-N 120.498 -1.377 . . . . 2.0 112.17 -179.892 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 25' ' ' PHE . . . . . . . . . . . . . 2.4 m-30 -76.91 117.68 18.75 Favored 'General case' 0 CA--C 1.569 1.69 0 N-CA-C 106.675 -1.602 . . . . 2.0 106.675 179.632 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 26' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -56.52 129.05 39.17 Favored 'General case' 0 N--CA 1.497 1.912 0 O-C-N 121.047 -1.033 . . . . 2.0 113.668 -179.781 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 27' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -42.83 -44.01 4.28 Favored 'General case' 0 N--CA 1.506 2.331 0 N-CA-C 117.326 2.343 . . . . 2.0 117.326 -179.787 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 53.1 m -76.13 -42.29 47.35 Favored 'General case' 0 CA--C 1.581 2.161 0 N-CA-C 113.287 0.847 . . . . 2.0 113.287 179.566 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 64.4 t0 -133.34 96.28 3.69 Favored 'General case' 0 CA--C 1.568 1.663 0 N-CA-C 105.705 -1.961 . . . . 2.0 105.705 179.712 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 2.8 mm? -64.95 -63.41 1.12 Allowed 'General case' 0 CA--C 1.568 1.669 0 N-CA-C 118.602 2.815 . . . . 2.0 118.602 -179.601 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 31' ' ' THR . . . . . . . . . . . . . 81.3 p -33.41 -46.68 0.19 Allowed 'General case' 0 N--CA 1.508 2.44 0 N-CA-C 120.426 3.491 . . . . 2.0 120.426 -179.673 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 32' ' ' ILE . . . . . . . . . . . . . 2.2 mp -87.39 111.35 40.8 Favored Pre-proline 0 CA--C 1.589 2.444 0 N-CA-C 103.756 -2.683 . . . . 2.0 103.756 179.649 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 33' ' ' PRO . . . . . . . . . . . . . 6.1 Cg_exo -71.42 144.68 46.06 Favored 'Trans proline' 0 CA--C 1.565 2.06 0 N-CA-C 118.214 2.351 . . . . 2.0 118.214 -179.764 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 34' ' ' VAL . . . . . . . . . . . . 0.314 14.3 m -98.0 -14.65 7.69 Favored 'Isoleucine or valine' 0 N--CA 1.508 2.459 0 N-CA-C 113.762 1.023 . . . . 2.0 113.762 179.456 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 35' ' ' LYS . . . . . 0.439 ' HB2' ' SD ' ' A' ' 24' ' ' MET 0.276 3.1 tmtt? -161.93 155.45 21.14 Favored 'General case' 0 CA--C 1.568 1.658 0 C-N-CA 126.332 1.853 . . . . 2.0 108.623 179.472 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 36' ' ' ARG . . . . . . . . . . . . 0.305 13.1 ttp180 -140.64 105.52 4.95 Favored 'General case' 0 CA--C 1.581 2.154 0 N-CA-C 103.024 -2.954 . . . . 2.0 103.024 -180.0 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . -134.14 -139.96 4.22 Favored Glycine 0 N--CA 1.502 3.066 0 N-CA-C 121.622 3.409 . . . . 2.0 121.622 -179.502 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 38' ' ' CYS . . . . . . . . . . . . . 0.8 OUTLIER -135.24 142.4 45.96 Favored 'General case' 0 N--CA 1.498 1.967 0 N-CA-C 113.645 0.98 . . . . 2.0 113.645 -179.971 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 39' ' ' ILE . . . . . 0.502 HG21 ' HD3' ' A' ' 43' ' ' PRO . 8.2 tp -166.57 171.36 0.21 Allowed 'Isoleucine or valine' 0 N--CA 1.507 2.4 0 O-C-N 120.777 -1.202 . . . . 2.0 114.085 -179.623 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 40' ' ' ASP . . . . . . . . . . . . . 20.6 m-20 -87.46 -52.67 5.23 Favored 'General case' 0 CA--C 1.577 1.992 0 O-C-N 120.131 -1.606 . . . . 2.0 112.163 179.364 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 95.7 t -132.8 39.58 0.7 Allowed 'Isoleucine or valine' 0 N--CA 1.51 2.537 0 N-CA-C 114.131 1.16 . . . . 2.0 114.131 -179.624 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 42' ' ' CYS . . . . . . . . . . . . 0.257 2.5 m 73.28 114.89 0.03 OUTLIER Pre-proline 0 N--CA 1.515 2.818 0 N-CA-C 103.278 -2.86 . . . . 2.0 103.278 -179.579 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 43' ' ' PRO . . . . . 0.502 ' HD3' HG21 ' A' ' 39' ' ' ILE . 12.7 Cg_exo -58.7 170.58 2.5 Favored 'Trans proline' 0 C--N 1.373 1.844 0 CA-C-N 127.039 3.549 . . . . 2.0 118.796 -179.318 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 56.4 mtmt -64.45 99.11 0.28 Allowed 'General case' 0 CA--C 1.574 1.887 0 CA-C-O 123.558 1.647 . . . . 2.0 108.023 179.719 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 45' ' ' ASN . . . . . . . . . . . . 0.276 4.0 p-10 -71.89 -157.87 0.04 OUTLIER 'General case' 0 CA--C 1.569 1.702 0 N-CA-C 118.215 2.672 . . . . 2.0 118.215 -179.555 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 46' ' ' SER . . . . . . . . . . . . 0.315 6.3 t 78.11 -43.46 0.38 Allowed 'General case' 0 N--CA 1.489 1.48 0 N-CA-C 117.519 2.414 . . . . 2.0 117.519 179.945 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 47' ' ' LEU . . . . . . . . . . . . . 2.6 pp -47.6 -49.83 25.84 Favored 'General case' 0 N--CA 1.507 2.417 0 CA-C-N 120.348 1.431 . . . . 2.0 113.264 179.643 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 90.3 mt -156.34 25.68 0.35 Allowed 'General case' 0 CA--C 1.586 2.335 0 C-N-CA 126.947 2.099 . . . . 2.0 109.031 179.434 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 49' ' ' VAL . . . . . . . . . . . . . 3.7 p -168.07 171.24 0.18 Allowed 'Isoleucine or valine' 0 CA--C 1.587 2.38 0 N-CA-C 119.425 3.12 . . . . 2.0 119.425 -178.902 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 23.1 ttpt -151.62 75.1 1.15 Allowed 'General case' 0 CA--C 1.583 2.245 0 N-CA-C 101.501 -3.518 . . . . 2.0 101.501 178.954 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 99.0 m-85 -51.37 131.85 28.9 Favored 'General case' 0 CA--C 1.565 1.531 1 N-CA-C 123.17 4.507 . . . . 2.0 123.17 -179.241 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 52' ' ' VAL . . . . . . . . . . . . . 7.0 t -100.46 139.92 20.72 Favored 'Isoleucine or valine' 0 CA--C 1.577 2.018 1 N-CA-C 99.297 -4.334 . . . . 2.0 99.297 179.023 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 53' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -145.45 143.68 30.17 Favored 'General case' 0 CA--C 1.568 1.643 0 O-C-N 118.509 -2.619 . . . . 2.0 115.683 -179.148 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 54' ' ' CYS . . . . . . . . . . . . . 25.7 p -126.78 120.46 29.39 Favored 'General case' 0 CA--C 1.572 1.821 0 C-N-CA 123.448 0.699 . . . . 2.0 110.314 179.905 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 9.0 m120 -51.27 6.81 0.0 OUTLIER 'General case' 0 N--CA 1.506 2.367 1 N-CA-C 125.471 5.36 . . . . 2.0 125.471 -179.506 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 56' ' ' THR . . . . . . . . . . . . 0.252 5.5 t -137.6 175.98 9.12 Favored 'General case' 0 N--CA 1.504 2.233 0 CA-C-N 123.31 2.777 . . . . 2.0 117.315 -179.758 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 57' ' ' ASP . . . . . . . . . . . . . 38.1 m-20 -61.4 116.2 4.47 Favored 'General case' 0 N--CA 1.487 1.415 0 N-CA-C 115.366 1.617 . . . . 2.0 115.366 -179.931 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 58' ' ' ARG . . . . . . . . . . . . 0.315 38.2 mtp180 62.37 21.26 12.43 Favored 'General case' 0 CA--C 1.578 2.046 0 N-CA-C 117.999 2.592 . . . . 2.0 117.999 -179.969 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 59' ' ' CYS . . . . . . . . . . . . . 29.1 p -72.96 -24.7 60.82 Favored 'General case' 0 CA--C 1.573 1.862 0 N-CA-C 116.816 2.154 . . . . 2.0 116.816 179.829 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 60' ' ' ASN . . . . . . . . . . . . . 41.2 p-10 . . . . . 0 CA--C 1.56 1.334 0 CA-C-O 124.161 1.934 . . . . 2.0 112.229 179.849 . . . . . . . . 0 0 . 1 . 005 nuclear nobuild core ' A' A ' 1' ' ' LEU . . . . . 0.438 HD23 ' SG ' ' A' ' 3' ' ' CYS . 6.0 tp . . . . . 0 CA--C 1.57 1.721 0 N-CA-C 113.497 0.925 . . . . 2.0 113.497 . . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -85.66 137.36 32.89 Favored 'General case' 0 CA--C 1.571 1.779 0 N-CA-C 107.886 -1.153 . . . . 2.0 107.886 179.711 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 3' ' ' CYS . . . . . 0.438 ' SG ' HD23 ' A' ' 1' ' ' LEU . 88.2 m -139.59 167.38 22.23 Favored 'General case' 0 N--CA 1.494 1.772 0 O-C-N 119.653 -1.904 . . . . 2.0 114.216 -179.89 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 69.4 m-80 -111.36 138.28 48.04 Favored 'General case' 0 CA--C 1.563 1.48 0 N-CA-C 116.969 2.211 . . . . 2.0 116.969 -179.858 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 5' ' ' LYS . . . . . 0.402 ' H ' ' HB1' ' A' ' 10' ' ' ALA 0.26 14.8 ptpt -87.56 172.17 9.95 Favored 'General case' 0 CA--C 1.587 2.396 0 CA-C-N 120.223 1.374 . . . . 2.0 107.481 178.912 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 1.5 mm? -39.98 -49.34 2.48 Favored 'General case' 0 N--CA 1.506 2.369 0 N-CA-C 120.897 3.665 . . . . 2.0 120.897 -179.835 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 7' ' ' ILE . . . . . . . . . . . . . 21.5 mt -73.7 147.11 86.5 Favored Pre-proline 0 CA--C 1.585 2.325 0 N-CA-C 114.2 1.185 . . . . 2.0 114.2 -179.79 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 70.6 Cg_exo -44.79 -45.54 13.53 Favored 'Trans proline' 0 CA--C 1.567 2.164 0 N-CA-C 119.864 2.986 . . . . 2.0 119.864 179.827 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 9' ' ' ILE . . . . . . . . . . . . 0.297 0.2 OUTLIER -59.37 -46.96 92.15 Favored 'Isoleucine or valine' 0 N--CA 1.514 2.726 0 CA-C-N 120.571 1.532 . . . . 2.0 112.356 179.611 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 10' ' ' ALA . . . . . 0.402 ' HB1' ' H ' ' A' ' 5' ' ' LYS . . . 55.97 159.2 0.01 OUTLIER 'General case' 0 CA--C 1.578 2.032 1 N-CA-C 123.918 4.784 . . . . 2.0 123.918 179.345 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 8.2 t -66.3 -174.31 0.26 Allowed 'General case' 0 CA--C 1.58 2.103 0 N-CA-C 117.763 2.505 . . . . 2.0 117.763 -179.902 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 12' ' ' LYS . . . . . . . . . . . . 0.309 50.4 tptt -98.23 -90.56 0.28 Allowed 'General case' 0 CA--C 1.572 1.801 1 N-CA-C 123.304 4.557 . . . . 2.0 123.304 -179.485 . . . . . . . . 3 2 . 1 . 005 nuclear nobuild core ' A' A ' 13' ' ' THR . . . . . . . . . . . . . 8.4 t -156.92 170.81 21.64 Favored 'General case' 0 N--CA 1.506 2.351 0 N-CA-C 120.108 3.373 . . . . 2.0 120.108 -179.143 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 14' ' ' CYS . . . . . . . . . . . . 0.419 0.5 OUTLIER -146.4 168.44 11.59 Favored Pre-proline 0 CA--C 1.6 2.902 0 C-N-CA 126.104 1.761 . . . . 2.0 108.713 179.215 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 15' ' ' PRO . . . . . . . . . . . . . 92.2 Cg_exo -45.07 171.37 0.02 OUTLIER 'Trans proline' 0 CA--C 1.571 2.347 1 N-CA-C 128.673 6.374 . . . . 2.0 128.673 -179.488 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -78.72 165.36 23.69 Favored 'General case' 0 N--CA 1.499 1.986 0 N-CA-C 104.506 -2.405 . . . . 2.0 104.506 178.944 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . 85.34 -47.94 3.93 Favored Glycine 1 N--CA 1.524 4.512 0 O-C-N 117.082 -3.511 . . . . 2.0 105.37 -178.642 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 39.9 mmtm -83.3 63.78 7.42 Favored 'General case' 0 CA--C 1.604 3.031 1 N-CA-C 99.939 -4.097 . . . . 2.0 99.939 178.493 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 37.3 p-10 -80.85 -20.49 42.23 Favored 'General case' 0 N--CA 1.483 1.18 0 N-CA-C 121.527 3.899 . . . . 2.0 121.527 -179.261 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 70.7 mt -88.59 112.95 23.64 Favored 'General case' 0 CA--C 1.555 1.136 0 CA-C-N 119.284 0.947 . . . . 2.0 110.586 179.771 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 21' ' ' CYS . . . . . 0.425 ' SG ' HD21 ' A' ' 1' ' ' LEU . 1.7 m -79.91 95.4 6.08 Favored 'General case' 0 CA--C 1.576 1.947 0 N-CA-C 100.389 -3.93 . . . . 2.0 100.389 179.257 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 22' ' ' TYR . . . . . . . . . . . . 0.266 0.0 OUTLIER -76.14 154.72 35.24 Favored 'General case' 0 CA--C 1.552 1.054 0 N-CA-C 121.008 3.707 . . . . 2.0 121.008 -179.35 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 31.8 mtmt -117.73 92.2 3.77 Favored 'General case' 0 CA--C 1.559 1.317 1 N-CA-C 99.626 -4.212 . . . . 2.0 99.626 179.311 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 24' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -71.13 72.97 0.63 Allowed 'General case' 0 CA--C 1.578 2.027 0 C-N-CA 124.374 1.07 . . . . 2.0 108.719 179.912 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 25' ' ' PHE . . . . . . . . . . . . . 9.6 m-30 -62.1 133.23 54.99 Favored 'General case' 0 N--CA 1.486 1.367 0 O-C-N 120.709 -1.245 . . . . 2.0 113.152 -179.856 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 26' ' ' MET . . . . . . . . . . . . . 34.4 mtp -64.48 131.2 46.44 Favored 'General case' 0 N--CA 1.489 1.503 0 N-CA-C 113.131 0.789 . . . . 2.0 113.131 -179.995 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 27' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -54.22 -38.83 66.15 Favored 'General case' 0 N--CA 1.514 2.731 0 CA-C-N 120.779 1.627 . . . . 2.0 112.164 179.461 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 50.4 m -79.73 -32.52 41.15 Favored 'General case' 0 CA--C 1.586 2.337 0 N-CA-C 114.062 1.134 . . . . 2.0 114.062 179.418 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 52.7 t0 -146.86 84.31 1.6 Allowed 'General case' 0 CA--C 1.573 1.85 0 O-C-N 120.599 -1.313 . . . . 2.0 109.723 179.871 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 1.6 mm? -51.18 -67.52 0.24 Allowed 'General case' 0 CA--C 1.576 1.972 0 N-CA-C 120.763 3.616 . . . . 2.0 120.763 -179.496 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 31' ' ' THR . . . . . . . . . . . . 0.337 15.3 t -19.22 -61.97 0.02 OUTLIER 'General case' 0 N--CA 1.51 2.538 1 N-CA-C 121.825 4.009 . . . . 2.0 121.825 -179.793 . . . . . . . . 3 2 . 1 . 005 nuclear nobuild core ' A' A ' 32' ' ' ILE . . . . . . . . . . . . . 1.8 mp -100.71 103.68 26.02 Favored Pre-proline 0 CA--C 1.589 2.468 1 N-CA-C 99.661 -4.2 . . . . 2.0 99.661 179.577 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 33' ' ' PRO . . . . . . . . . . . . . 14.5 Cg_endo -62.8 171.1 6.28 Favored 'Trans proline' 0 CA--C 1.561 1.862 1 N-CA-C 123.372 4.335 . . . . 2.0 123.372 -179.512 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 34' ' ' VAL . . . . . . . . . . . . . 97.8 t -73.66 -55.57 12.05 Favored 'Isoleucine or valine' 0 CA--C 1.59 2.49 0 N-CA-C 104.467 -2.42 . . . . 2.0 104.467 178.963 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 36.7 tttm -136.35 162.17 33.75 Favored 'General case' 0 CA--C 1.564 1.496 0 CA-C-O 124.449 2.071 . . . . 2.0 108.963 179.601 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 36' ' ' ARG . . . . . . . . . . . . 0.346 40.2 ttp180 -138.26 108.61 6.49 Favored 'General case' 0 CA--C 1.574 1.866 1 N-CA-C 98.495 -4.631 . . . . 2.0 98.495 179.533 . . . . . . . . 3 2 . 1 . 005 nuclear nobuild core ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . -145.04 -147.77 4.7 Favored Glycine 0 N--CA 1.489 2.21 0 O-C-N 119.053 -2.279 . . . . 2.0 118.387 -179.56 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 38' ' ' CYS . . . . . . . . . . . . . 19.1 p -115.47 137.51 51.98 Favored 'General case' 0 CA--C 1.562 1.421 0 C-N-CA 123.723 0.809 . . . . 2.0 111.587 179.959 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 39' ' ' ILE . . . . . . . . . . . . . 3.4 tp -160.23 166.12 0.73 Allowed 'Isoleucine or valine' 0 N--CA 1.495 1.809 0 O-C-N 120.879 -1.138 . . . . 2.0 113.838 -179.906 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 40' ' ' ASP . . . . . . . . . . . . . 9.6 p30 -80.87 -102.05 0.03 OUTLIER 'General case' 0 N--CA 1.507 2.406 0 N-CA-C 103.736 -2.69 . . . . 2.0 103.736 179.435 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 87.7 t -85.98 162.12 2.87 Favored 'Isoleucine or valine' 0 CA--C 1.58 2.126 0 N-CA-C 104.595 -2.372 . . . . 2.0 104.595 178.982 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 42' ' ' CYS . . . . . . . . . . . . . 1.7 m -63.78 107.24 1.19 Allowed Pre-proline 0 CA--C 1.605 3.068 1 N-CA-C 100.007 -4.071 . . . . 2.0 100.007 179.554 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 43' ' ' PRO . . . . . . . . . . . . . 26.4 Cg_exo -50.37 -178.02 0.01 OUTLIER 'Trans proline' 0 C--N 1.372 1.791 1 N-CA-C 125.088 4.996 . . . . 2.0 125.088 -178.709 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 96.7 mttt -73.08 103.15 3.74 Favored 'General case' 0 CA--C 1.568 1.639 0 N-CA-C 104.187 -2.523 . . . . 2.0 104.187 179.386 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 45' ' ' ASN . . . . . . . . . . . . 0.25 2.0 p-10 -67.6 117.45 9.56 Favored 'General case' 0 CA--C 1.563 1.466 0 N-CA-C 117.174 2.287 . . . . 2.0 117.174 -179.358 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 14.9 t -82.73 179.27 7.83 Favored 'General case' 0 CA--C 1.565 1.54 0 N-CA-C 113.776 1.028 . . . . 2.0 113.776 179.962 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 47' ' ' LEU . . . . . . . . . . . . . 88.8 mt -51.55 -25.01 5.97 Favored 'General case' 0 N--CA 1.507 2.391 0 N-CA-C 116.424 2.009 . . . . 2.0 116.424 179.768 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 78.7 mt -102.51 7.33 40.2 Favored 'General case' 0 CA--C 1.579 2.093 0 C-N-CA 125.131 1.372 . . . . 2.0 114.636 179.591 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 49' ' ' VAL . . . . . . . . . . . . . 9.0 p -153.93 159.24 3.37 Favored 'Isoleucine or valine' 0 N--CA 1.502 2.13 0 N-CA-C 117.505 2.409 . . . . 2.0 117.505 -179.644 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER -153.78 78.47 1.13 Allowed 'General case' 0 CA--C 1.576 1.967 0 N-CA-C 102.752 -3.055 . . . . 2.0 102.752 179.343 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER -58.69 128.81 39.05 Favored 'General case' 0 CA--C 1.569 1.697 1 N-CA-C 122.7 4.333 . . . . 2.0 122.7 -179.341 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 52' ' ' VAL . . . . . . . . . . . . 0.284 14.1 t -103.13 151.88 6.11 Favored 'Isoleucine or valine' 0 CA--C 1.578 2.047 0 N-CA-C 102.107 -3.294 . . . . 2.0 102.107 179.047 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 53' ' ' CYS . . . . . . . . . . . . 0.261 0.8 OUTLIER -147.5 160.82 42.17 Favored 'General case' 0 CA--C 1.568 1.65 0 N-CA-C 119.178 3.029 . . . . 2.0 119.178 -179.026 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 54' ' ' CYS . . . . . . . . . . . . . 29.0 p -143.34 120.69 11.61 Favored 'General case' 0 CA--C 1.574 1.895 0 C-N-CA 123.928 0.891 . . . . 2.0 110.342 179.78 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 14.8 m120 -55.45 12.01 0.0 OUTLIER 'General case' 0 N--CA 1.508 2.467 1 N-CA-C 124.518 5.007 . . . . 2.0 124.518 -179.674 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 56' ' ' THR . . . . . . . . . . . . 0.274 4.9 t -138.26 177.82 7.59 Favored 'General case' 0 N--CA 1.502 2.134 0 CA-C-N 123.077 2.671 . . . . 2.0 116.794 -179.839 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 57' ' ' ASP . . . . . . . . . . . . . 69.9 m-20 -65.11 120.76 13.27 Favored 'General case' 0 CA--C 1.565 1.541 0 N-CA-C 115.779 1.77 . . . . 2.0 115.779 -179.755 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 58' ' ' ARG . . . . . . . . . . . . . 10.7 mmm180 56.45 31.19 18.39 Favored 'General case' 0 CA--C 1.586 2.348 0 N-CA-C 115.193 1.553 . . . . 2.0 115.193 -179.919 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 59' ' ' CYS . . . . . . . . . . . . . 29.7 p -83.77 -21.13 32.3 Favored 'General case' 0 N--CA 1.495 1.813 0 N-CA-C 116.432 2.012 . . . . 2.0 116.432 179.848 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 60' ' ' ASN . . . . . . . . . . . . . 25.3 p-10 . . . . . 0 CA--C 1.56 1.34 0 CA-C-O 124.967 2.318 . . . . 2.0 113.079 179.886 . . . . . . . . 0 0 . 1 . 006 nuclear nobuild core ' A' A ' 1' ' ' LEU . . . . . 0.603 HD13 ' SG ' ' A' ' 3' ' ' CYS . 0.7 OUTLIER . . . . . 0 CA--C 1.576 1.944 0 CA-C-O 123.257 1.503 . . . . 2.0 113.785 . . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 1.6 mptp? -151.87 108.41 3.47 Favored 'General case' 0 CA--C 1.565 1.523 0 N-CA-C 101.15 -3.648 . . . . 2.0 101.15 179.631 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 3' ' ' CYS . . . . . 0.603 ' SG ' HD13 ' A' ' 1' ' ' LEU . 90.7 m -114.01 -168.38 1.35 Allowed 'General case' 0 N--CA 1.499 1.979 0 CA-C-N 122.131 2.241 . . . . 2.0 115.941 -179.926 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 80.4 m-20 -139.4 113.35 8.68 Favored 'General case' 0 CA--C 1.56 1.329 0 C-N-CA 123.843 0.857 . . . . 2.0 110.547 179.911 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 5' ' ' LYS . . . . . 0.429 ' H ' ' HB1' ' A' ' 10' ' ' ALA . 0.3 OUTLIER -66.74 -179.03 0.8 Allowed 'General case' 0 CA--C 1.583 2.243 0 CA-C-N 121.202 1.819 . . . . 2.0 111.44 179.416 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -45.03 -41.87 7.9 Favored 'General case' 0 N--CA 1.509 2.493 0 N-CA-C 120.86 3.652 . . . . 2.0 120.86 -179.704 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 7' ' ' ILE . . . . . . . . . . . . . 38.5 mt -57.03 144.13 69.74 Favored Pre-proline 0 CA--C 1.586 2.348 0 C-N-CA 124.602 1.161 . . . . 2.0 113.53 179.861 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 90.1 Cg_exo -46.48 -42.6 22.99 Favored 'Trans proline' 0 CA--C 1.572 2.382 0 N-CA-C 118.901 2.616 . . . . 2.0 118.901 179.828 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 9' ' ' ILE . . . . . . . . . . . . 0.264 9.5 pt -88.37 -67.49 0.73 Allowed 'Isoleucine or valine' 0 N--CA 1.499 2.018 0 C-N-CA 123.799 0.84 . . . . 2.0 112.125 179.669 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 10' ' ' ALA . . . . . 0.429 ' HB1' ' H ' ' A' ' 5' ' ' LYS 0.259 . . 63.61 166.45 0.14 Allowed 'General case' 0 CA--C 1.581 2.166 0 N-CA-C 120.149 3.388 . . . . 2.0 120.149 179.818 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 15.8 t -87.01 149.86 24.46 Favored 'General case' 0 N--CA 1.495 1.819 0 O-C-N 121.099 -1.0 . . . . 2.0 113.437 179.984 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 12' ' ' LYS . . . . . 0.416 ' HG3' ' H ' ' A' ' 13' ' ' THR 0.388 9.0 ptpp? -84.21 -98.03 0.06 Allowed 'General case' 0 CA--C 1.584 2.287 1 N-CA-C 123.523 4.638 . . . . 2.0 123.523 -179.431 . . . . . . . . 4 3 . 1 . 006 nuclear nobuild core ' A' A ' 13' ' ' THR . . . . . 0.416 ' H ' ' HG3' ' A' ' 12' ' ' LYS . 35.7 m -22.58 129.56 0.02 OUTLIER 'General case' 0 N--CA 1.505 2.285 1 N-CA-C 123.494 4.627 . . . . 2.0 123.494 -179.558 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 52.9 t -156.34 146.05 15.47 Favored Pre-proline 0 CA--C 1.594 2.665 0 C-N-CA 125.525 1.53 . . . . 2.0 110.095 179.72 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 15' ' ' PRO . . . . . . . . . . . . . 44.2 Cg_exo -47.76 169.91 0.06 OUTLIER 'Trans proline' 0 CA--C 1.576 2.606 1 N-CA-C 126.042 5.362 . . . . 2.0 126.042 -179.836 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -78.02 165.77 23.64 Favored 'General case' 0 N--CA 1.496 1.865 0 C-N-CA 124.8 1.24 . . . . 2.0 110.236 179.532 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . 82.86 -48.37 4.0 Favored Glycine 1 N--CA 1.517 4.039 0 O-C-N 119.049 -2.282 . . . . 2.0 109.256 -179.106 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 35.7 mmtm -77.34 91.99 3.88 Favored 'General case' 0 CA--C 1.573 1.858 0 N-CA-C 101.953 -3.351 . . . . 2.0 101.953 179.262 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 9.9 p30 -98.38 -27.23 14.19 Favored 'General case' 0 N--CA 1.491 1.612 0 N-CA-C 117.369 2.359 . . . . 2.0 117.369 -179.85 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 76.6 mt -83.7 114.12 21.35 Favored 'General case' 0 CA--C 1.557 1.233 0 N-CA-C 116.148 1.907 . . . . 2.0 116.148 -179.849 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 21' ' ' CYS . . . . . 0.441 ' SG ' HD22 ' A' ' 1' ' ' LEU . 5.2 m -84.45 91.44 7.83 Favored 'General case' 0 CA--C 1.578 2.031 1 N-CA-C 99.989 -4.078 . . . . 2.0 99.989 179.152 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 22' ' ' TYR . . . . . . . . . . . . . 8.1 p90 -75.47 158.89 31.98 Favored 'General case' 0 CA--C 1.552 1.036 0 N-CA-C 120.461 3.504 . . . . 2.0 120.461 -179.311 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 19.0 ptpt -133.21 101.55 5.24 Favored 'General case' 0 CA--C 1.562 1.406 0 N-CA-C 104.952 -2.24 . . . . 2.0 104.952 179.491 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 24' ' ' MET . . . . . . . . . . . . . 0.1 OUTLIER -68.81 86.92 0.34 Allowed 'General case' 0 N--CA 1.485 1.285 0 C-N-CA 125.438 1.495 . . . . 2.0 112.542 179.949 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 25' ' ' PHE . . . . . . . . . . . . . 8.2 m-30 -78.28 108.33 11.54 Favored 'General case' 0 CA--C 1.563 1.444 0 N-CA-C 104.601 -2.37 . . . . 2.0 104.601 179.568 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 26' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -58.27 128.5 37.43 Favored 'General case' 0 CA--C 1.57 1.712 0 CA-C-O 117.869 -1.062 . . . . 2.0 110.806 179.999 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 27' ' ' MET . . . . . . . . . . . . . 31.0 mtp -41.59 -36.73 0.98 Allowed 'General case' 0 N--CA 1.51 2.54 0 N-CA-C 117.949 2.574 . . . . 2.0 117.949 -179.891 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 67.3 m -89.23 -32.57 17.36 Favored 'General case' 0 CA--C 1.588 2.424 0 C-N-CA 124.189 0.996 . . . . 2.0 112.151 179.293 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 15.9 m-20 -130.44 87.61 2.53 Favored 'General case' 0 CA--C 1.576 1.945 0 O-C-N 119.424 -2.047 . . . . 2.0 105.592 179.748 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 1.5 mm? -74.26 -75.22 0.16 Allowed 'General case' 0 CA--C 1.578 2.022 0 N-CA-C 119.652 3.205 . . . . 2.0 119.652 -179.528 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 31' ' ' THR . . . . . . . . . . . . 0.257 80.7 p -17.92 -68.27 0.02 OUTLIER 'General case' 0 N--CA 1.508 2.47 0 N-CA-C 121.065 3.728 . . . . 2.0 121.065 -179.588 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 32' ' ' ILE . . . . . . . . . . . . . 1.9 mp -90.79 108.02 24.68 Favored Pre-proline 0 CA--C 1.585 2.315 1 N-CA-C 99.714 -4.18 . . . . 2.0 99.714 179.503 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 33' ' ' PRO . . . . . . . . . . . . . 43.1 Cg_endo -61.7 162.85 20.19 Favored 'Trans proline' 0 CA--C 1.56 1.787 0 N-CA-C 119.012 2.659 . . . . 2.0 119.012 -179.659 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 34' ' ' VAL . . . . . . . . . . . . . 14.2 t -88.19 -47.74 15.35 Favored 'Isoleucine or valine' 0 N--CA 1.503 2.2 0 N-CA-C 107.011 -1.477 . . . . 2.0 107.011 179.148 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 4.6 tptp -124.78 155.27 39.63 Favored 'General case' 0 CA--C 1.564 1.505 0 CA-C-O 124.159 1.933 . . . . 2.0 108.559 179.605 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 2.9 mtp180 -141.74 110.85 6.29 Favored 'General case' 0 CA--C 1.566 1.576 0 N-CA-C 100.495 -3.891 . . . . 2.0 100.495 179.782 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . -141.94 -152.74 5.77 Favored Glycine 0 N--CA 1.487 2.035 0 N-CA-C 118.8 2.28 . . . . 2.0 118.8 -179.7 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 38' ' ' CYS . . . . . 0.42 ' HB3' ' SG ' ' A' ' 3' ' ' CYS . 25.7 p -127.66 126.69 42.43 Favored 'General case' 0 CA--C 1.562 1.441 0 C-N-CA 123.581 0.752 . . . . 2.0 112.401 179.902 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 39' ' ' ILE . . . . . 0.424 HG21 ' HD3' ' A' ' 43' ' ' PRO . 8.2 tp -147.81 179.22 0.8 Allowed 'Isoleucine or valine' 0 N--CA 1.497 1.878 0 C-N-CA 124.007 0.923 . . . . 2.0 112.858 -179.702 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 40' ' ' ASP . . . . . 0.412 ' H ' HG13 ' A' ' 39' ' ' ILE . 18.0 p-10 -102.91 -43.86 5.41 Favored 'General case' 0 CA--C 1.569 1.702 0 O-C-N 120.267 -1.521 . . . . 2.0 113.539 179.707 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 4.3 t -137.2 35.94 0.56 Allowed 'Isoleucine or valine' 0 N--CA 1.509 2.496 0 CA-C-N 120.086 1.312 . . . . 2.0 112.459 179.975 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 42' ' ' CYS . . . . . . . . . . . . 0.349 2.7 m 75.31 122.03 0.03 OUTLIER Pre-proline 0 CA--C 1.614 3.415 1 N-CA-C 99.919 -4.104 . . . . 2.0 99.919 -179.26 . . . . . . . . 3 2 . 1 . 006 nuclear nobuild core ' A' A ' 43' ' ' PRO . . . . . 0.424 ' HD3' HG21 ' A' ' 39' ' ' ILE . 27.4 Cg_exo -55.01 -4.08 0.34 Allowed 'Trans proline' 0 N--CA 1.503 2.077 1 N-CA-C 129.512 6.697 . . . . 2.0 129.512 -178.851 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 44' ' ' LYS . . . . . . . . . . . . 0.331 69.3 mttt 110.1 104.66 0.0 OUTLIER 'General case' 0 N--CA 1.494 1.738 0 N-CA-C 100.685 -3.82 . . . . 2.0 100.685 -179.446 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 45' ' ' ASN . . . . . . . . . . . . . 4.0 p-10 -72.77 101.34 3.08 Favored 'General case' 0 CA--C 1.566 1.592 0 N-CA-C 116.449 2.018 . . . . 2.0 116.449 -179.393 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 14.1 t -81.64 178.43 8.34 Favored 'General case' 0 CA--C 1.567 1.625 0 N-CA-C 113.245 0.832 . . . . 2.0 113.245 179.888 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 47' ' ' LEU . . . . . . . . . . . . 0.392 3.4 pp -57.3 -12.78 2.64 Favored 'General case' 0 N--CA 1.508 2.466 0 N-CA-C 117.072 2.249 . . . . 2.0 117.072 179.729 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 77.3 mt -106.61 4.22 27.75 Favored 'General case' 0 CA--C 1.584 2.253 0 C-N-CA 125.549 1.54 . . . . 2.0 111.867 179.209 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 49' ' ' VAL . . . . . . . . . . . . . 14.4 p -157.44 149.33 9.78 Favored 'Isoleucine or valine' 0 N--CA 1.501 2.11 0 CA-C-N 123.378 2.808 . . . . 2.0 116.988 -179.604 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 17.3 ttpt -141.51 73.18 1.41 Allowed 'General case' 0 CA--C 1.58 2.112 0 N-CA-C 104.173 -2.529 . . . . 2.0 104.173 179.539 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER -59.85 130.15 45.35 Favored 'General case' 0 N--CA 1.494 1.755 0 N-CA-C 120.819 3.637 . . . . 2.0 120.819 -179.367 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 52' ' ' VAL . . . . . . . . . . . . . 18.7 t -99.69 121.17 50.04 Favored 'Isoleucine or valine' 0 CA--C 1.574 1.891 1 N-CA-C 100.091 -4.04 . . . . 2.0 100.091 179.244 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 53' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -121.42 135.57 55.05 Favored 'General case' 0 CA--C 1.574 1.896 0 N-CA-C 117.715 2.487 . . . . 2.0 117.715 -179.198 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 54' ' ' CYS . . . . . . . . . . . . . 31.2 p -118.17 120.14 36.81 Favored 'General case' 0 N--CA 1.495 1.788 0 C-N-CA 124.112 0.965 . . . . 2.0 111.96 179.835 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 25.0 p-10 -63.06 40.5 0.01 OUTLIER 'General case' 0 N--CA 1.506 2.36 1 N-CA-C 123.028 4.455 . . . . 2.0 123.028 -179.509 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 5.9 t -155.16 172.57 17.92 Favored 'General case' 0 N--CA 1.497 1.911 0 O-C-N 119.656 -1.902 . . . . 2.0 113.999 179.946 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 57' ' ' ASP . . . . . . . . . . . . . 85.5 m-20 -67.46 122.44 17.97 Favored 'General case' 0 CA--C 1.568 1.648 0 N-CA-C 116.538 2.051 . . . . 2.0 116.538 -179.851 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 58' ' ' ARG . . . . . . . . . . . . 0.254 37.5 mtm105 56.35 28.81 14.03 Favored 'General case' 0 CA--C 1.574 1.901 0 N-CA-C 117.935 2.568 . . . . 2.0 117.935 179.802 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 59' ' ' CYS . . . . . . . . . . . . . 30.2 p -86.14 14.63 6.07 Favored 'General case' 0 CA--C 1.579 2.074 0 N-CA-C 117.191 2.293 . . . . 2.0 117.191 179.893 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 60' ' ' ASN . . . . . . . . . . . . . 35.7 p-10 . . . . . 0 CA--C 1.561 1.369 0 CA-C-O 124.012 1.863 . . . . 2.0 112.541 -179.948 . . . . . . . . 0 0 . 1 . 007 nuclear nobuild core ' A' A ' 1' ' ' LEU . . . . . 0.514 HD21 ' SG ' ' A' ' 3' ' ' CYS . 6.7 tt . . . . . 0 N--CA 1.502 2.175 0 CA-C-O 116.779 -1.581 . . . . 2.0 110.926 . . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 26.3 tttp -111.62 -47.31 3.17 Favored 'General case' 0 N--CA 1.521 3.08 0 CA-C-N 122.72 2.509 . . . . 2.0 113.798 -179.831 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 3' ' ' CYS . . . . . 0.514 ' SG ' HD21 ' A' ' 1' ' ' LEU 0.454 1.9 m 83.09 -136.65 0.01 OUTLIER 'General case' 0 CA--C 1.564 1.518 0 N-CA-C 119.483 3.142 . . . . 2.0 119.483 179.786 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 35.7 m-20 -131.67 131.54 43.21 Favored 'General case' 0 N--CA 1.484 1.242 0 N-CA-C 116.363 1.986 . . . . 2.0 116.363 -179.448 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 19.8 ptmt -76.11 -164.35 0.37 Allowed 'General case' 0 N--CA 1.501 2.077 0 CA-C-N 119.746 1.157 . . . . 2.0 108.398 179.193 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 4.5 mm? -52.65 -30.54 32.25 Favored 'General case' 0 N--CA 1.514 2.753 0 O-C-N 117.617 -3.177 . . . . 2.0 114.586 179.666 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 7' ' ' ILE . . . . . . . . . . . . . 51.2 mm -66.72 132.76 94.05 Favored Pre-proline 0 CA--C 1.587 2.365 0 C-N-CA 125.356 1.462 . . . . 2.0 109.784 179.562 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 8' ' ' PRO . . . . . . . . . . . . 0.314 20.5 Cg_exo -18.61 -71.76 0.02 OUTLIER 'Trans proline' 0 CA--C 1.568 2.225 1 N-CA-C 123.136 4.244 . . . . 2.0 123.136 -179.859 . . . . . . . . 3 2 . 1 . 007 nuclear nobuild core ' A' A ' 9' ' ' ILE . . . . . . . . . . . . . 17.2 tt -135.37 73.12 0.36 Allowed 'Isoleucine or valine' 0 N--CA 1.503 2.191 0 CA-C-O 122.183 0.992 . . . . 2.0 109.15 179.966 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 10' ' ' ALA . . . . . . . . . . . . 0.359 . . -71.46 -101.11 0.01 OUTLIER 'General case' 0 CA--C 1.583 2.223 1 N-CA-C 125.576 5.399 . . . . 2.0 125.576 -179.433 . . . . . . . . 3 2 . 1 . 007 nuclear nobuild core ' A' A ' 11' ' ' SER . . . . . . . . . . . . 0.253 4.9 t -63.21 -169.76 0.03 OUTLIER 'General case' 0 CA--C 1.581 2.154 1 N-CA-C 123.356 4.576 . . . . 2.0 123.356 -179.255 . . . . . . . . 3 2 . 1 . 007 nuclear nobuild core ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 6.7 tptp -132.19 -79.55 0.5 Allowed 'General case' 0 CA--C 1.582 2.191 0 N-CA-C 118.921 2.934 . . . . 2.0 118.921 -179.788 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 13' ' ' THR . . . . . . . . . . . . . 8.1 t -134.15 118.5 17.75 Favored 'General case' 0 N--CA 1.511 2.583 0 N-CA-C 120.286 3.439 . . . . 2.0 120.286 -179.615 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 14' ' ' CYS . . . . . 0.581 ' SG ' ' HD2' ' A' ' 18' ' ' LYS . 0.5 OUTLIER -101.56 179.86 0.93 Allowed Pre-proline 0 CA--C 1.596 2.74 0 C-N-CA 125.663 1.585 . . . . 2.0 110.555 179.604 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 15' ' ' PRO . . . . . . . . . . . . . 87.8 Cg_exo -51.26 177.05 0.04 OUTLIER 'Trans proline' 0 CA--C 1.572 2.406 1 N-CA-C 123.606 4.426 . . . . 2.0 123.606 -179.876 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 16' ' ' ALA . . . . . . . . . . . . 0.253 . . 19.06 -164.96 0.0 OUTLIER 'General case' 0 N--CA 1.5 2.075 1 N-CA-C 124.009 4.818 . . . . 2.0 124.009 179.768 . . . . . . . . 3 2 . 1 . 007 nuclear nobuild core ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . -81.95 37.03 2.51 Favored Glycine 0 N--CA 1.502 3.059 0 O-C-N 119.886 -1.758 . . . . 2.0 113.636 179.503 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 18' ' ' LYS . . . . . 0.581 ' HD2' ' SG ' ' A' ' 14' ' ' CYS . 0.1 OUTLIER -83.51 82.26 8.37 Favored 'General case' 0 CA--C 1.563 1.469 0 C-N-CA 125.613 1.565 . . . . 2.0 106.886 179.937 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 8.5 p30 -69.34 -34.15 74.19 Favored 'General case' 0 CA--C 1.558 1.278 1 N-CA-C 122.715 4.339 . . . . 2.0 122.715 -179.542 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 49.4 mt -68.91 118.36 11.75 Favored 'General case' 0 CA--C 1.56 1.344 0 N-CA-C 115.951 1.834 . . . . 2.0 115.951 -179.844 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 21' ' ' CYS . . . . . 0.535 ' SG ' ' O ' ' A' ' 56' ' ' THR . 34.4 m -81.88 96.39 7.63 Favored 'General case' 0 CA--C 1.572 1.808 0 N-CA-C 103.143 -2.91 . . . . 2.0 103.143 179.304 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 22' ' ' TYR . . . . . . . . . . . . 0.4 0.0 OUTLIER -68.45 158.21 34.2 Favored 'General case' 0 CA--C 1.56 1.34 0 N-CA-C 119.716 3.228 . . . . 2.0 119.716 -179.515 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 29.4 mtmt -131.36 89.36 2.71 Favored 'General case' 0 CA--C 1.557 1.246 1 N-CA-C 99.664 -4.198 . . . . 2.0 99.664 179.466 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 24' ' ' MET . . . . . 0.45 ' HB3' ' H ' ' A' ' 35' ' ' LYS . 20.4 ttt -71.24 68.31 0.5 Allowed 'General case' 0 CA--C 1.571 1.755 0 O-C-N 121.171 -0.956 . . . . 2.0 111.688 -179.842 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 25' ' ' PHE . . . . . . . . . . . . . 11.3 m-30 -59.0 127.18 30.93 Favored 'General case' 0 N--CA 1.486 1.339 0 O-C-N 120.798 -1.189 . . . . 2.0 113.292 -179.932 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 26' ' ' MET . . . . . . . . . . . . . 84.5 mtp -59.95 128.77 38.51 Favored 'General case' 0 N--CA 1.493 1.689 0 CA-C-O 118.048 -0.977 . . . . 2.0 111.577 179.877 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 27' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -54.44 -35.99 63.56 Favored 'General case' 0 N--CA 1.511 2.604 0 CA-C-N 121.474 1.943 . . . . 2.0 112.529 179.62 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 75.6 m -83.96 -14.05 51.84 Favored 'General case' 0 CA--C 1.591 2.54 0 N-CA-C 114.525 1.305 . . . . 2.0 114.525 179.268 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -161.49 77.92 0.55 Allowed 'General case' 0 N--CA 1.499 2.023 0 O-C-N 119.408 -2.058 . . . . 2.0 108.302 179.855 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 2.4 mm? -46.32 -79.99 0.01 OUTLIER 'General case' 0 CA--C 1.576 1.944 1 N-CA-C 123.532 4.642 . . . . 2.0 123.532 -179.399 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 31' ' ' THR . . . . . . . . . . . . 0.337 14.6 t -19.75 -52.44 0.01 OUTLIER 'General case' 0 N--CA 1.508 2.453 1 N-CA-C 122.941 4.423 . . . . 2.0 122.941 -179.689 . . . . . . . . 3 2 . 1 . 007 nuclear nobuild core ' A' A ' 32' ' ' ILE . . . . . . . . . . . . . 1.8 mp -97.86 106.94 37.36 Favored Pre-proline 0 CA--C 1.591 2.523 0 N-CA-C 101.617 -3.475 . . . . 2.0 101.617 179.545 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 33' ' ' PRO . . . . . . . . . . . . . 3.1 Cg_endo -65.3 167.47 16.47 Favored 'Trans proline' 0 CA--C 1.559 1.772 1 N-CA-C 122.63 4.05 . . . . 2.0 122.63 -179.659 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 34' ' ' VAL . . . . . . . . . . . . . 96.5 t -75.38 -53.37 16.26 Favored 'Isoleucine or valine' 0 CA--C 1.591 2.531 0 N-CA-C 104.546 -2.39 . . . . 2.0 104.546 178.965 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 35' ' ' LYS . . . . . 0.45 ' H ' ' HB3' ' A' ' 24' ' ' MET . 97.6 mttt -149.13 117.82 6.61 Favored 'General case' 0 CA--C 1.552 1.055 0 C-N-CA 125.494 1.518 . . . . 2.0 110.795 179.63 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 36' ' ' ARG . . . . . . . . . . . . 0.358 28.1 ttp180 -88.63 109.59 20.23 Favored 'General case' 0 CA--C 1.594 2.653 0 N-CA-C 101.715 -3.439 . . . . 2.0 101.715 179.689 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . -141.04 -135.81 3.22 Favored Glycine 0 N--CA 1.497 2.764 0 N-CA-C 121.264 3.266 . . . . 2.0 121.264 -179.28 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 38' ' ' CYS . . . . . . . . . . . . . 29.7 p -125.73 141.8 51.83 Favored 'General case' 0 N--CA 1.491 1.598 0 N-CA-C 116.116 1.895 . . . . 2.0 116.116 -179.826 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 39' ' ' ILE . . . . . 0.435 HG12 ' CG ' ' A' ' 43' ' ' PRO . 2.4 tp -164.73 166.69 0.51 Allowed 'Isoleucine or valine' 0 CA--C 1.574 1.881 0 N-CA-C 114.465 1.283 . . . . 2.0 114.465 -179.906 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 40' ' ' ASP . . . . . . . . . . . . . 8.0 p-10 -82.74 -51.51 7.62 Favored 'General case' 0 N--CA 1.505 2.289 0 O-C-N 119.868 -1.77 . . . . 2.0 113.402 179.536 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 87.7 t -133.72 143.28 39.16 Favored 'Isoleucine or valine' 0 CA--C 1.563 1.474 0 N-CA-C 102.271 -3.233 . . . . 2.0 102.271 179.677 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 42' ' ' CYS . . . . . . . . . . . . . 1.0 OUTLIER -57.69 105.41 0.53 Allowed Pre-proline 0 CA--C 1.602 2.967 0 N-CA-C 101.872 -3.381 . . . . 2.0 101.872 179.638 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 43' ' ' PRO . . . . . 0.435 ' CG ' HG12 ' A' ' 39' ' ' ILE . 39.8 Cg_exo -48.41 174.17 0.03 OUTLIER 'Trans proline' 0 C--N 1.371 1.755 1 N-CA-C 126.201 5.423 . . . . 2.0 126.201 -178.638 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 57.2 mttp -72.81 89.22 1.36 Allowed 'General case' 0 CA--C 1.568 1.648 0 CA-C-N 112.889 -1.96 . . . . 2.0 105.927 179.597 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 45' ' ' ASN . . . . . . . . . . . . . 4.1 p-10 -63.62 154.54 32.49 Favored 'General case' 0 CA--C 1.567 1.601 0 N-CA-C 117.301 2.334 . . . . 2.0 117.301 -179.614 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 22.5 t -123.33 -173.18 2.67 Favored 'General case' 0 N--CA 1.485 1.286 0 N-CA-C 113.802 1.038 . . . . 2.0 113.802 179.993 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 47' ' ' LEU . . . . . . . . . . . . 0.35 1.0 OUTLIER -56.7 -15.54 4.75 Favored 'General case' 0 N--CA 1.508 2.463 0 N-CA-C 116.338 1.977 . . . . 2.0 116.338 179.63 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 88.8 mt -101.95 -2.43 29.77 Favored 'General case' 0 CA--C 1.588 2.436 0 C-N-CA 125.986 1.714 . . . . 2.0 111.809 179.138 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 49' ' ' VAL . . . . . . . . . . . . . 11.2 p -154.23 165.37 1.37 Allowed 'Isoleucine or valine' 0 CA--C 1.583 2.236 0 N-CA-C 117.254 2.316 . . . . 2.0 117.254 -179.522 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 61.7 tttp -159.14 93.55 1.15 Allowed 'General case' 0 CA--C 1.573 1.829 1 N-CA-C 99.759 -4.163 . . . . 2.0 99.759 179.394 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 83.8 m-85 -72.41 124.01 24.25 Favored 'General case' 0 CA--C 1.568 1.673 0 N-CA-C 121.363 3.838 . . . . 2.0 121.363 -179.309 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 52' ' ' VAL . . . . . . . . . . . . 0.283 78.9 t -100.01 156.7 4.04 Favored 'Isoleucine or valine' 0 CA--C 1.585 2.307 0 N-CA-C 102.816 -3.031 . . . . 2.0 102.816 179.101 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 53' ' ' CYS . . . . . . . . . . . . 0.324 1.4 p -164.86 160.63 19.63 Favored 'General case' 0 N--CA 1.5 2.04 0 O-C-N 117.33 -3.356 . . . . 2.0 119.329 -179.034 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 54' ' ' CYS . . . . . . . . . . . . 0.395 25.4 p -152.35 119.7 5.95 Favored 'General case' 0 CA--C 1.584 2.258 0 CA-C-O 122.85 1.31 . . . . 2.0 111.866 179.471 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 10.6 m120 -34.01 -9.55 0.0 OUTLIER 'General case' 0 N--CA 1.504 2.234 1 N-CA-C 129.839 6.977 . . . . 2.0 129.839 -179.54 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 56' ' ' THR . . . . . 0.535 ' O ' ' SG ' ' A' ' 21' ' ' CYS . 7.9 t -130.79 161.43 31.77 Favored 'General case' 0 N--CA 1.513 2.687 0 CA-C-N 124.861 3.482 . . . . 2.0 115.727 -179.81 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 57' ' ' ASP . . . . . . . . . . . . . 5.5 m-20 -48.22 120.89 3.86 Favored 'General case' 0 N--CA 1.497 1.902 0 N-CA-C 114.796 1.406 . . . . 2.0 114.796 -179.835 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 58' ' ' ARG . . . . . . . . . . . . 0.281 63.4 mtt180 70.92 9.92 6.87 Favored 'General case' 0 N--CA 1.502 2.141 0 N-CA-C 115.699 1.741 . . . . 2.0 115.699 -179.76 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 59' ' ' CYS . . . . . . . . . . . . . 35.7 t -61.57 -32.22 72.3 Favored 'General case' 0 CA--C 1.574 1.867 0 N-CA-C 115.632 1.716 . . . . 2.0 115.632 179.775 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 60' ' ' ASN . . . . . . . . . . . . . 47.9 p30 . . . . . 0 CA--C 1.567 1.602 0 CA-C-O 124.652 2.168 . . . . 2.0 112.848 179.813 . . . . . . . . 0 0 . 1 . 008 nuclear nobuild core ' A' A ' 1' ' ' LEU . . . . . 0.524 HD13 ' SG ' ' A' ' 3' ' ' CYS . 0.5 OUTLIER . . . . . 0 CA--C 1.582 2.203 0 CA-C-O 122.467 1.127 . . . . 2.0 112.823 . . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 6.3 tmtt? -145.76 108.3 4.46 Favored 'General case' 0 N--CA 1.494 1.766 0 N-CA-C 101.076 -3.675 . . . . 2.0 101.076 179.855 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 3' ' ' CYS . . . . . 0.524 ' SG ' HD13 ' A' ' 1' ' ' LEU . 71.7 m -123.13 174.75 7.04 Favored 'General case' 0 N--CA 1.495 1.781 0 N-CA-C 119.126 3.01 . . . . 2.0 119.126 -179.474 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 18.0 m-20 -102.84 137.62 40.81 Favored 'General case' 0 CA--C 1.56 1.362 0 C-N-CA 124.193 0.997 . . . . 2.0 110.852 179.778 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 22.0 ptmt -84.84 -160.93 0.52 Allowed 'General case' 0 CA--C 1.593 2.631 0 CA-C-N 120.376 1.444 . . . . 2.0 108.113 179.224 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -46.0 -42.75 13.58 Favored 'General case' 0 N--CA 1.509 2.483 0 N-CA-C 119.136 3.013 . . . . 2.0 119.136 -179.996 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 7' ' ' ILE . . . . . . . . . . . . . 42.6 mm -65.88 138.77 96.54 Favored Pre-proline 0 CA--C 1.585 2.295 0 N-CA-C 115.542 1.682 . . . . 2.0 115.542 -179.74 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 80.0 Cg_exo -48.16 -40.55 34.55 Favored 'Trans proline' 0 CA--C 1.569 2.256 0 N-CA-C 121.063 3.447 . . . . 2.0 121.063 179.844 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 9' ' ' ILE . . . . . . . . . . . . . 34.4 mm -106.39 30.25 0.96 Allowed 'Isoleucine or valine' 0 CA--C 1.589 2.473 0 N-CA-C 114.169 1.174 . . . . 2.0 114.169 -179.817 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -74.52 160.63 30.66 Favored 'General case' 0 CA--C 1.574 1.9 0 O-C-N 118.108 -2.87 . . . . 2.0 117.205 -179.91 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 96.4 p -153.41 119.99 5.59 Favored 'General case' 0 N--CA 1.501 2.115 0 O-C-N 120.448 -1.407 . . . . 2.0 112.27 -179.919 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -148.49 138.69 22.5 Favored 'General case' 0 N--CA 1.497 1.888 0 O-C-N 120.801 -1.187 . . . . 2.0 113.41 -179.804 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 13' ' ' THR . . . . . . . . . . . . . 50.9 m -74.2 130.26 39.4 Favored 'General case' 0 N--CA 1.505 2.32 0 O-C-N 120.574 -1.329 . . . . 2.0 110.897 179.829 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 14' ' ' CYS . . . . . 0.465 ' SG ' ' HD2' ' A' ' 15' ' ' PRO 0.256 12.7 t -135.27 162.51 57.02 Favored Pre-proline 0 CA--C 1.594 2.641 0 N-CA-C 113.99 1.108 . . . . 2.0 113.99 -179.625 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 15' ' ' PRO . . . . . 0.465 ' HD2' ' SG ' ' A' ' 14' ' ' CYS . 68.4 Cg_exo -50.49 161.81 1.12 Allowed 'Trans proline' 0 CA--C 1.575 2.551 1 N-CA-C 125.538 5.169 . . . . 2.0 125.538 -179.822 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -84.36 171.83 12.31 Favored 'General case' 0 N--CA 1.498 1.954 0 C-N-CA 124.94 1.296 . . . . 2.0 111.757 179.581 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . 81.76 -46.93 3.56 Favored Glycine 1 N--CA 1.523 4.461 0 O-C-N 119.245 -2.159 . . . . 2.0 108.618 -178.938 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 72.8 mmtt -78.64 85.44 4.68 Favored 'General case' 0 CA--C 1.575 1.934 0 C-N-CA 129.017 2.927 . . . . 2.0 104.446 179.336 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 8.1 p30 -82.96 -23.97 33.19 Favored 'General case' 0 N--CA 1.496 1.832 0 N-CA-C 119.642 3.201 . . . . 2.0 119.642 -179.775 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 61.9 mt -88.66 121.71 31.32 Favored 'General case' 0 CA--C 1.551 0.998 0 C-N-CA 123.96 0.904 . . . . 2.0 113.11 -179.966 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 1.3 m -82.26 97.42 8.27 Favored 'General case' 0 CA--C 1.577 1.999 1 N-CA-C 99.001 -4.444 . . . . 2.0 99.001 179.064 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 22' ' ' TYR . . . . . . . . . . . . 0.263 0.0 OUTLIER -82.69 153.55 25.29 Favored 'General case' 0 N--CA 1.482 1.163 0 N-CA-C 118.795 2.887 . . . . 2.0 118.795 -179.429 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 13.4 ptmt -126.32 96.65 4.77 Favored 'General case' 0 CA--C 1.561 1.381 0 N-CA-C 103.938 -2.616 . . . . 2.0 103.938 179.629 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 24' ' ' MET . . . . . . . . . . . . 0.28 42.0 ttm -65.1 70.98 0.04 OUTLIER 'General case' 0 CA--C 1.57 1.742 0 C-N-CA 126.301 1.84 . . . . 2.0 113.911 -179.856 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 25' ' ' PHE . . . . . . . . . . . . . 4.0 m-30 -58.09 133.65 55.75 Favored 'General case' 0 N--CA 1.493 1.715 0 O-C-N 120.55 -1.344 . . . . 2.0 114.014 179.939 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 26' ' ' MET . . . . . . . . . . . . . 58.1 mtp -66.62 131.61 46.37 Favored 'General case' 0 N--CA 1.492 1.632 0 CA-C-O 118.609 -0.71 . . . . 2.0 111.948 179.941 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 27' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -54.06 -41.21 67.88 Favored 'General case' 0 N--CA 1.513 2.716 0 CA-C-N 120.702 1.592 . . . . 2.0 112.542 179.562 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 50.5 m -77.89 -35.26 50.99 Favored 'General case' 0 CA--C 1.585 2.299 0 N-CA-C 113.892 1.071 . . . . 2.0 113.892 179.475 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 11.8 t70 -141.19 82.17 1.82 Allowed 'General case' 0 CA--C 1.574 1.88 0 O-C-N 120.635 -1.29 . . . . 2.0 109.383 179.871 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 2.3 mm? -47.73 -71.42 0.07 Allowed 'General case' 0 CA--C 1.579 2.078 0 N-CA-C 119.876 3.287 . . . . 2.0 119.876 -179.671 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 31' ' ' THR . . . . . . . . . . . . . 56.2 p -15.18 -64.32 0.01 OUTLIER 'General case' 0 N--CA 1.511 2.587 0 N-CA-C 121.787 3.995 . . . . 2.0 121.787 -179.814 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 32' ' ' ILE . . . . . . . . . . . . . 1.8 mp -94.78 110.98 52.52 Favored Pre-proline 0 CA--C 1.587 2.392 0 N-CA-C 101.948 -3.353 . . . . 2.0 101.948 179.609 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 33' ' ' PRO . . . . . . . . . . . . . 5.2 Cg_exo -67.03 164.33 30.43 Favored 'Trans proline' 0 CA--C 1.557 1.665 0 N-CA-C 122.201 3.885 . . . . 2.0 122.201 -179.557 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 34' ' ' VAL . . . . . . . . . . . . . 58.7 t -70.74 -45.6 72.99 Favored 'Isoleucine or valine' 0 CA--C 1.595 2.679 0 N-CA-C 106.462 -1.681 . . . . 2.0 106.462 178.883 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 5.3 tptm -152.42 167.78 27.61 Favored 'General case' 0 CA--C 1.567 1.623 0 C-N-CA 126.626 1.97 . . . . 2.0 109.797 179.773 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 12.5 mtt180 -144.3 110.26 5.38 Favored 'General case' 0 CA--C 1.574 1.868 0 N-CA-C 104.196 -2.52 . . . . 2.0 104.196 179.495 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . -141.83 -135.53 3.13 Favored Glycine 0 N--CA 1.494 2.5 0 O-C-N 120.699 -1.25 . . . . 2.0 115.116 -179.872 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 38' ' ' CYS . . . . . . . . . . . . . 16.1 p -129.33 136.23 49.75 Favored 'General case' 0 N--CA 1.491 1.614 0 CA-C-N 118.174 0.987 . . . . 2.0 112.45 179.713 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 39' ' ' ILE . . . . . . . . . . . . . 3.3 tp -150.38 162.08 3.82 Favored 'Isoleucine or valine' 0 CA--C 1.577 2.003 0 N-CA-C 113.78 1.03 . . . . 2.0 113.78 -179.866 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 40' ' ' ASP . . . . . . . . . . . . . 8.1 p-10 -79.64 -49.84 11.53 Favored 'General case' 0 N--CA 1.513 2.713 0 O-C-N 119.139 -2.226 . . . . 2.0 114.504 179.753 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 70.3 t -134.47 143.72 37.1 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.415 0 N-CA-C 102.537 -3.135 . . . . 2.0 102.537 179.645 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 42' ' ' CYS . . . . . . . . . . . . 0.258 1.9 m -57.55 104.95 0.46 Allowed Pre-proline 0 CA--C 1.599 2.836 0 N-CA-C 102.032 -3.321 . . . . 2.0 102.032 179.67 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 43' ' ' PRO . . . . . . . . . . . . . 25.2 Cg_exo -50.75 179.87 0.02 OUTLIER 'Trans proline' 0 C--N 1.371 1.757 1 N-CA-C 125.466 5.141 . . . . 2.0 125.466 -178.693 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 29.9 mtpp -69.79 96.31 0.97 Allowed 'General case' 0 CA--C 1.565 1.522 0 N-CA-C 105.506 -2.035 . . . . 2.0 105.506 179.535 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 45' ' ' ASN . . . . . . . . . . . . 0.252 2.1 p-10 -62.62 112.91 2.69 Favored 'General case' 0 CA--C 1.567 1.604 0 N-CA-C 116.763 2.134 . . . . 2.0 116.763 -179.456 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 12.4 t -80.17 -179.8 7.25 Favored 'General case' 0 CA--C 1.567 1.604 0 N-CA-C 114.511 1.301 . . . . 2.0 114.511 179.943 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 47' ' ' LEU . . . . . . . . . . . . . 93.3 mt -49.77 -28.55 6.38 Favored 'General case' 0 N--CA 1.507 2.39 0 N-CA-C 116.708 2.114 . . . . 2.0 116.708 179.822 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 78.6 mt -102.54 12.73 36.01 Favored 'General case' 0 CA--C 1.579 2.082 0 C-N-CA 124.849 1.259 . . . . 2.0 114.06 179.655 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 49' ' ' VAL . . . . . . . . . . . . . 9.4 p -155.85 158.62 3.29 Favored 'Isoleucine or valine' 0 N--CA 1.502 2.168 0 N-CA-C 118.114 2.635 . . . . 2.0 118.114 -179.699 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 59.9 tttp -153.57 75.51 1.05 Allowed 'General case' 0 CA--C 1.581 2.135 0 N-CA-C 103.011 -2.959 . . . . 2.0 103.011 179.296 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 18.2 m-85 -50.38 120.79 4.88 Favored 'General case' 0 CA--C 1.572 1.806 0 N-CA-C 121.58 3.918 . . . . 2.0 121.58 -179.53 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 52' ' ' VAL . . . . . . . . . . . . 0.256 25.2 t -101.76 140.79 19.46 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.958 0 N-CA-C 101.968 -3.345 . . . . 2.0 101.968 179.294 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 53' ' ' CYS . . . . . . . . . . . . 0.425 6.8 p -155.71 158.95 39.08 Favored 'General case' 0 N--CA 1.493 1.702 0 N-CA-C 118.821 2.897 . . . . 2.0 118.821 -178.866 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 54' ' ' CYS . . . . . . . . . . . . 0.408 21.6 p -148.57 127.57 12.75 Favored 'General case' 0 CA--C 1.579 2.087 0 CA-C-O 122.606 1.193 . . . . 2.0 110.971 179.505 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 12.3 m120 -42.65 16.31 0.0 OUTLIER 'General case' 0 N--CA 1.504 2.262 1 N-CA-C 127.338 6.051 . . . . 2.0 127.338 -179.481 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 6.9 t -148.14 177.27 9.53 Favored 'General case' 0 N--CA 1.501 2.104 0 CA-C-N 123.179 2.718 . . . . 2.0 115.012 -179.935 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 57' ' ' ASP . . . . . . . . . . . . . 43.4 m-20 -62.86 124.03 19.99 Favored 'General case' 0 CA--C 1.56 1.362 0 C-N-CA 124.126 0.971 . . . . 2.0 112.792 -180.0 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 58' ' ' ARG . . . . . . . . . . . . . 71.3 mtp180 64.66 18.73 11.55 Favored 'General case' 0 N--CA 1.499 1.981 0 N-CA-C 117.01 2.226 . . . . 2.0 117.01 -179.962 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 59' ' ' CYS . . . . . . . . . . . . . 36.8 t -71.18 -19.56 62.39 Favored 'General case' 0 CA--C 1.579 2.078 0 N-CA-C 117.081 2.252 . . . . 2.0 117.081 179.902 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 60' ' ' ASN . . . . . . . . . . . . . 10.2 p30 . . . . . 0 CA--C 1.567 1.615 0 CA-C-O 125.21 2.433 . . . . 2.0 112.823 179.803 . . . . . . . . 0 0 . 1 . 009 nuclear nobuild core ' A' A ' 1' ' ' LEU . . . . . . . . . . . . 0.301 0.3 OUTLIER . . . . . 0 CA--C 1.571 1.788 0 N-CA-C 114.117 1.154 . . . . 2.0 114.117 . . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 28.2 mttp -70.66 128.74 37.11 Favored 'General case' 0 N--CA 1.494 1.748 0 O-C-N 120.735 -1.228 . . . . 2.0 110.451 179.764 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 71.8 m -137.84 -176.52 4.45 Favored 'General case' 0 CA--C 1.566 1.562 0 CA-C-O 122.619 1.2 . . . . 2.0 113.323 -179.816 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 91.8 m-20 -122.86 97.42 5.44 Favored 'General case' 0 CA--C 1.554 1.102 0 C-N-CA 123.583 0.753 . . . . 2.0 111.739 179.957 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 5' ' ' LYS . . . . . . . . . . . . 0.315 22.4 ptmt -56.15 164.14 1.37 Allowed 'General case' 0 CA--C 1.589 2.476 0 CA-C-N 120.396 1.453 . . . . 2.0 112.475 179.465 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 6' ' ' LEU . . . . . . . . . . . . 0.358 2.4 tm? -30.66 -49.52 0.12 Allowed 'General case' 0 N--CA 1.511 2.625 1 N-CA-C 122.648 4.314 . . . . 2.0 122.648 -179.139 . . . . . . . . 3 2 . 1 . 009 nuclear nobuild core ' A' A ' 7' ' ' ILE . . . . . . . . . . . . . 49.0 mm -55.08 149.16 25.89 Favored Pre-proline 0 CA--C 1.594 2.649 0 N-CA-C 114.425 1.268 . . . . 2.0 114.425 179.889 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 97.3 Cg_exo -47.21 -54.16 5.42 Favored 'Trans proline' 0 CA--C 1.575 2.549 0 C-N-CA 123.059 2.506 . . . . 2.0 118.282 179.881 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 9' ' ' ILE . . . . . . . . . . . . 0.256 10.8 tp -74.65 -48.31 35.05 Favored 'Isoleucine or valine' 0 N--CA 1.507 2.42 0 N-CA-C 114.459 1.281 . . . . 2.0 114.459 179.684 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . 24.52 120.1 0.0 OUTLIER 'General case' 0 CA--C 1.58 2.114 1 N-CA-C 124.202 4.89 . . . . 2.0 124.202 179.739 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 94.1 p -112.18 100.59 8.95 Favored 'General case' 0 CA--C 1.568 1.668 0 N-CA-C 117.116 2.265 . . . . 2.0 117.116 -179.754 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 16.6 tppt? -117.35 127.3 53.92 Favored 'General case' 0 N--CA 1.495 1.805 0 N-CA-C 108.05 -1.092 . . . . 2.0 108.05 179.715 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 13' ' ' THR . . . . . . . . . . . . . 9.8 t -135.99 78.47 1.72 Allowed 'General case' 0 N--CA 1.503 2.185 0 O-C-N 120.782 -1.199 . . . . 2.0 111.398 -179.973 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 14' ' ' CYS . . . . . . . . . . . . 0.272 0.1 OUTLIER -103.88 170.87 5.64 Favored Pre-proline 0 CA--C 1.587 2.398 0 N-CA-C 115.364 1.616 . . . . 2.0 115.364 -179.939 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 15' ' ' PRO . . . . . . . . . . . . . 86.2 Cg_exo -55.72 164.82 4.08 Favored 'Trans proline' 0 N--CA 1.501 1.954 1 N-CA-C 126.197 5.422 . . . . 2.0 126.197 -179.617 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -70.19 175.91 4.24 Favored 'General case' 0 N--CA 1.498 1.946 0 C-N-CA 123.935 0.894 . . . . 2.0 109.437 179.398 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . 83.65 -53.2 4.83 Favored Glycine 1 N--CA 1.518 4.141 0 O-C-N 118.341 -2.724 . . . . 2.0 106.558 -179.101 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 18.3 mmtm -80.3 65.83 5.59 Favored 'General case' 0 CA--C 1.602 2.977 0 N-CA-C 103.113 -2.921 . . . . 2.0 103.113 178.926 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 9.8 p30 -64.67 -38.84 92.38 Favored 'General case' 0 N--CA 1.482 1.156 0 N-CA-C 120.69 3.589 . . . . 2.0 120.69 -179.475 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 89.4 mt -72.36 117.02 13.5 Favored 'General case' 0 CA--C 1.55 0.959 0 N-CA-C 115.704 1.742 . . . . 2.0 115.704 -179.764 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 1.5 m -84.79 91.9 8.1 Favored 'General case' 0 CA--C 1.576 1.978 1 N-CA-C 98.902 -4.481 . . . . 2.0 98.902 179.084 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 22' ' ' TYR . . . . . . . . . . . . 0.321 4.4 p90 -65.56 153.69 40.81 Favored 'General case' 0 N--CA 1.481 1.08 0 N-CA-C 119.674 3.212 . . . . 2.0 119.674 -179.368 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 29.5 ttpt -132.21 96.14 3.82 Favored 'General case' 0 CA--C 1.562 1.422 0 N-CA-C 104.171 -2.529 . . . . 2.0 104.171 179.857 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 24' ' ' MET . . . . . 0.489 ' SD ' ' HB3' ' A' ' 35' ' ' LYS . 15.0 ttt -68.12 86.05 0.25 Allowed 'General case' 0 CA--C 1.567 1.609 0 N-CA-C 114.356 1.243 . . . . 2.0 114.356 -179.722 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 25' ' ' PHE . . . . . . . . . . . . . 3.0 m-30 -81.76 108.51 15.35 Favored 'General case' 0 CA--C 1.569 1.696 0 N-CA-C 105.153 -2.166 . . . . 2.0 105.153 179.649 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 26' ' ' MET . . . . . . . . . . . . . 22.3 ttt -58.11 137.99 56.47 Favored 'General case' 0 N--CA 1.496 1.841 0 O-C-N 120.885 -1.134 . . . . 2.0 113.864 -179.864 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 27' ' ' MET . . . . . . . . . . . . . 2.2 mmt -48.21 -39.69 21.94 Favored 'General case' 0 N--CA 1.508 2.456 0 N-CA-C 115.359 1.614 . . . . 2.0 115.359 179.929 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 59.4 m -80.76 -38.91 27.79 Favored 'General case' 0 CA--C 1.584 2.275 0 C-N-CA 123.611 0.765 . . . . 2.0 112.932 179.538 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 59.0 t0 -132.63 99.44 4.64 Favored 'General case' 0 CA--C 1.572 1.825 0 N-CA-C 106.573 -1.64 . . . . 2.0 106.573 179.733 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 2.4 mm? -76.55 -77.35 0.14 Allowed 'General case' 0 CA--C 1.578 2.046 0 N-CA-C 117.59 2.441 . . . . 2.0 117.59 -179.658 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 31' ' ' THR . . . . . . . . . . . . . 56.5 p -14.24 -69.81 0.01 OUTLIER 'General case' 0 N--CA 1.511 2.58 0 N-CA-C 121.15 3.759 . . . . 2.0 121.15 -179.804 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 32' ' ' ILE . . . . . . . . . . . . . 2.0 mp -89.44 112.47 51.73 Favored Pre-proline 0 CA--C 1.589 2.451 1 N-CA-C 99.562 -4.236 . . . . 2.0 99.562 179.552 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 33' ' ' PRO . . . . . . . . . . . . . 6.0 Cg_exo -66.87 158.19 57.73 Favored 'Trans proline' 0 CA--C 1.554 1.512 0 N-CA-C 119.706 2.925 . . . . 2.0 119.706 -179.41 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 34' ' ' VAL . . . . . . . . . . . . 0.255 13.2 m -85.16 -37.18 12.0 Favored 'Isoleucine or valine' 0 CA--C 1.585 2.315 0 CA-C-O 121.627 0.727 . . . . 2.0 109.82 179.078 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 35' ' ' LYS . . . . . 0.489 ' HB3' ' SD ' ' A' ' 24' ' ' MET . 34.8 ttmt -145.66 163.87 33.53 Favored 'General case' 0 CA--C 1.569 1.706 0 CA-C-O 123.72 1.724 . . . . 2.0 109.293 179.59 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 14.4 mtp180 -145.39 132.22 20.11 Favored 'General case' 0 CA--C 1.576 1.964 0 N-CA-C 102.815 -3.031 . . . . 2.0 102.815 179.585 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . -153.21 -146.35 4.35 Favored Glycine 0 N--CA 1.488 2.162 0 O-C-N 119.797 -1.815 . . . . 2.0 117.61 -179.775 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 38' ' ' CYS . . . . . . . . . . . . . 10.5 p -129.33 132.5 47.12 Favored 'General case' 0 CA--C 1.571 1.765 0 C-N-CA 123.668 0.787 . . . . 2.0 111.481 179.944 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 39' ' ' ILE . . . . . 0.515 HG21 ' HD3' ' A' ' 43' ' ' PRO . 9.9 tp -158.98 172.66 0.39 Allowed 'Isoleucine or valine' 0 N--CA 1.503 2.198 0 O-C-N 120.692 -1.255 . . . . 2.0 113.08 -179.773 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 40' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -95.3 -46.39 6.75 Favored 'General case' 0 N--CA 1.498 1.945 0 O-C-N 119.858 -1.776 . . . . 2.0 114.173 179.724 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 69.0 t -130.87 25.82 1.63 Allowed 'Isoleucine or valine' 0 N--CA 1.512 2.631 0 N-CA-C 114.934 1.457 . . . . 2.0 114.934 -179.584 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 42' ' ' CYS . . . . . . . . . . . . 0.283 2.8 m 81.21 114.07 0.03 OUTLIER Pre-proline 0 N--CA 1.526 3.339 1 N-CA-C 96.337 -5.431 . . . . 2.0 96.337 -179.15 . . . . . . . . 3 2 . 1 . 009 nuclear nobuild core ' A' A ' 43' ' ' PRO . . . . . 0.515 ' HD3' HG21 ' A' ' 39' ' ' ILE 0.472 31.5 Cg_exo -34.46 -96.52 0.0 OUTLIER 'Trans proline' 0 CA--C 1.565 2.027 1 N-CA-C 123.617 4.43 . . . . 2.0 123.617 -178.832 . . . . . . . . 4 3 . 1 . 009 nuclear nobuild core ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 44.7 mttm -159.28 95.86 1.27 Allowed 'General case' 0 CA--C 1.562 1.426 1 N-CA-C 98.706 -4.553 . . . . 2.0 98.706 179.696 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 45' ' ' ASN . . . . . . . . . . . . . 5.2 p-10 -72.91 -168.3 0.46 Allowed 'General case' 0 CA--C 1.572 1.812 0 N-CA-C 117.793 2.516 . . . . 2.0 117.793 -179.594 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 46' ' ' SER . . . . . . . . . . . . 0.349 5.5 t 80.79 -41.6 0.18 Allowed 'General case' 0 N--CA 1.491 1.605 0 N-CA-C 118.236 2.68 . . . . 2.0 118.236 179.907 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 47' ' ' LEU . . . . . . . . . . . . 0.252 2.7 pp -49.36 -51.1 36.83 Favored 'General case' 0 N--CA 1.508 2.473 0 CA-C-N 120.724 1.602 . . . . 2.0 113.07 179.696 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 92.3 mt -155.37 27.44 0.4 Allowed 'General case' 0 CA--C 1.589 2.444 0 C-N-CA 126.688 1.995 . . . . 2.0 108.269 179.428 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 49' ' ' VAL . . . . . 0.4 HG21 ' HG3' ' A' ' 24' ' ' MET . 14.5 p -169.33 168.24 0.27 Allowed 'Isoleucine or valine' 0 CA--C 1.582 2.201 0 N-CA-C 118.932 2.938 . . . . 2.0 118.932 -179.139 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 28.4 ttpt -146.92 74.26 1.34 Allowed 'General case' 0 CA--C 1.581 2.141 0 N-CA-C 102.251 -3.24 . . . . 2.0 102.251 178.977 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 54.3 m-85 -53.04 126.45 20.64 Favored 'General case' 0 CA--C 1.572 1.816 0 N-CA-C 120.187 3.403 . . . . 2.0 120.187 -179.41 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 52' ' ' VAL . . . . . . . . . . . . . 55.9 t -100.43 110.86 28.43 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.853 0 N-CA-C 101.176 -3.639 . . . . 2.0 101.176 179.371 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 53' ' ' CYS . . . . . . . . . . . . 0.312 1.4 p -123.68 136.61 54.57 Favored 'General case' 0 CA--C 1.569 1.709 0 N-CA-C 118.406 2.743 . . . . 2.0 118.406 -179.211 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 54' ' ' CYS . . . . . . . . . . . . 0.307 19.6 p -128.41 124.92 37.48 Favored 'General case' 0 CA--C 1.578 2.026 0 CA-C-O 122.722 1.248 . . . . 2.0 110.533 179.75 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 12.4 p-10 -52.9 32.36 0.0 OUTLIER 'General case' 0 N--CA 1.498 1.964 1 N-CA-C 127.675 6.176 . . . . 2.0 127.675 -179.544 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 56' ' ' THR . . . . . . . . . . . . 0.256 9.4 t -150.24 170.01 20.0 Favored 'General case' 0 N--CA 1.501 2.114 0 O-C-N 119.342 -2.098 . . . . 2.0 114.238 179.95 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 57' ' ' ASP . . . . . . . . . . . . . 39.5 m-20 -62.0 118.96 7.97 Favored 'General case' 0 N--CA 1.488 1.427 0 N-CA-C 113.894 1.072 . . . . 2.0 113.894 -179.925 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 58' ' ' ARG . . . . . . . . . . . . 0.277 21.5 mtt85 65.84 18.69 11.19 Favored 'General case' 0 N--CA 1.498 1.941 0 N-CA-C 117.403 2.372 . . . . 2.0 117.403 -179.881 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 59' ' ' CYS . . . . . . . . . . . . . 48.4 t -63.78 -32.47 73.98 Favored 'General case' 0 CA--C 1.577 1.999 0 N-CA-C 116.567 2.062 . . . . 2.0 116.567 179.899 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 60' ' ' ASN . . . . . . . . . . . . . 19.6 p30 . . . . . 0 CA--C 1.566 1.566 0 CA-C-O 124.993 2.33 . . . . 2.0 114.58 179.859 . . . . . . . . 0 0 . 1 . 010 nuclear nobuild core ' A' A ' 1' ' ' LEU . . . . . 0.455 HD21 ' SG ' ' A' ' 21' ' ' CYS . 6.2 tp . . . . . 0 CA--C 1.572 1.824 0 N-CA-C 114.727 1.381 . . . . 2.0 114.727 . . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 15.8 mtmm -86.77 140.96 29.21 Favored 'General case' 0 CA--C 1.576 1.946 0 O-C-N 120.993 -1.067 . . . . 2.0 108.314 179.549 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 3' ' ' CYS . . . . . 0.429 ' SG ' ' HB2' ' A' ' 38' ' ' CYS . 85.7 m -137.39 174.41 10.63 Favored 'General case' 0 N--CA 1.499 1.988 0 O-C-N 119.339 -2.101 . . . . 2.0 115.251 -179.906 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 60.8 m-20 -123.65 103.41 8.4 Favored 'General case' 0 CA--C 1.574 1.868 0 N-CA-C 119.119 3.007 . . . . 2.0 119.119 -179.839 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 19.2 ptmt -59.23 170.62 0.9 Allowed 'General case' 0 CA--C 1.6 2.875 0 O-C-N 119.67 -1.893 . . . . 2.0 111.934 179.264 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 4.2 mm? -31.37 -49.99 0.16 Allowed 'General case' 0 N--CA 1.511 2.58 1 N-CA-C 122.234 4.161 . . . . 2.0 122.234 -179.758 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 7' ' ' ILE . . . . . . . . . . . . . 20.9 mt -69.57 148.11 96.81 Favored Pre-proline 0 CA--C 1.584 2.258 0 N-CA-C 115.256 1.576 . . . . 2.0 115.256 -179.816 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 82.6 Cg_exo -51.47 -48.3 21.97 Favored 'Trans proline' 0 CA--C 1.574 2.475 0 C-N-CA 123.154 2.57 . . . . 2.0 117.167 179.681 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 9' ' ' ILE . . . . . . . . . . . . 0.283 11.3 tp -61.85 -46.49 96.41 Favored 'Isoleucine or valine' 0 N--CA 1.511 2.593 0 CA-C-N 119.712 1.142 . . . . 2.0 112.444 179.521 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . 54.51 175.77 0.03 OUTLIER 'General case' 0 CA--C 1.579 2.091 1 N-CA-C 126.484 5.735 . . . . 2.0 126.484 179.336 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 8.7 t -68.68 -169.99 0.19 Allowed 'General case' 0 CA--C 1.58 2.099 0 N-CA-C 118.548 2.796 . . . . 2.0 118.548 -179.833 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 12' ' ' LYS . . . . . . . . . . . . 0.297 2.5 tppp? -106.01 -90.66 0.41 Allowed 'General case' 0 CA--C 1.572 1.819 1 N-CA-C 122.967 4.432 . . . . 2.0 122.967 -179.545 . . . . . . . . 3 2 . 1 . 010 nuclear nobuild core ' A' A ' 13' ' ' THR . . . . . . . . . . . . . 7.8 t -154.39 165.15 37.3 Favored 'General case' 0 N--CA 1.51 2.543 1 N-CA-C 121.903 4.038 . . . . 2.0 121.903 -179.116 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -132.62 170.15 12.12 Favored Pre-proline 0 CA--C 1.599 2.854 0 C-N-CA 126.119 1.767 . . . . 2.0 108.717 179.331 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 15' ' ' PRO . . . . . . . . . . . . . 61.0 Cg_exo -59.3 -179.11 0.16 Allowed 'Trans proline' 0 CA--C 1.574 2.488 1 N-CA-C 124.941 4.939 . . . . 2.0 124.941 -179.784 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -78.83 164.12 24.76 Favored 'General case' 0 N--CA 1.5 2.04 0 N-CA-C 106.174 -1.787 . . . . 2.0 106.174 179.278 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . 84.45 -48.58 4.08 Favored Glycine 1 N--CA 1.523 4.437 0 N-CA-C 105.714 -2.954 . . . . 2.0 105.714 -178.769 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 28.4 mmtm -81.69 63.9 6.16 Favored 'General case' 0 CA--C 1.596 2.731 0 N-CA-C 102.052 -3.314 . . . . 2.0 102.052 178.698 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 45.5 p-10 -84.09 -13.59 52.64 Favored 'General case' 0 N--CA 1.487 1.397 0 N-CA-C 121.034 3.716 . . . . 2.0 121.034 -179.451 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 76.8 mt -91.14 113.84 26.21 Favored 'General case' 0 CA--C 1.553 1.087 0 CA-C-N 119.083 0.856 . . . . 2.0 111.166 179.862 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 21' ' ' CYS . . . . . 0.455 ' SG ' HD21 ' A' ' 1' ' ' LEU . 1.8 m -80.32 94.12 6.06 Favored 'General case' 0 CA--C 1.574 1.9 0 N-CA-C 101.303 -3.592 . . . . 2.0 101.303 179.235 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 22' ' ' TYR . . . . . . . . . . . . 0.302 0.0 OUTLIER -72.26 148.13 45.77 Favored 'General case' 0 CA--C 1.551 0.993 0 N-CA-C 121.446 3.869 . . . . 2.0 121.446 -179.313 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 58.5 mttp -111.29 92.2 3.95 Favored 'General case' 0 CA--C 1.561 1.38 1 N-CA-C 99.233 -4.358 . . . . 2.0 99.233 179.249 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 24' ' ' MET . . . . . . . . . . . . . 27.9 ttt -72.24 67.99 0.72 Allowed 'General case' 0 CA--C 1.573 1.852 0 O-C-N 120.811 -1.181 . . . . 2.0 111.55 -179.873 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 25' ' ' PHE . . . . . . . . . . . . . 10.8 m-30 -57.64 131.19 49.48 Favored 'General case' 0 N--CA 1.486 1.362 0 N-CA-C 114.804 1.409 . . . . 2.0 114.804 -179.861 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 26' ' ' MET . . . . . . . . . . . . . 42.3 mtt -65.58 130.81 44.61 Favored 'General case' 0 N--CA 1.493 1.698 0 CA-C-O 118.536 -0.745 . . . . 2.0 110.74 179.778 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 27' ' ' MET . . . . . . . . . . . . . 8.6 tmm? -56.47 -35.24 67.72 Favored 'General case' 0 N--CA 1.51 2.543 0 CA-C-N 121.106 1.775 . . . . 2.0 112.131 179.561 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 49.2 m -76.32 -36.49 58.26 Favored 'General case' 0 CA--C 1.586 2.364 0 C-N-CA 124.276 1.031 . . . . 2.0 113.14 179.315 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 10.3 t0 -144.21 84.2 1.76 Allowed 'General case' 0 CA--C 1.577 1.992 0 O-C-N 120.692 -1.255 . . . . 2.0 107.766 179.794 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 1.9 mm? -48.46 -74.63 0.03 OUTLIER 'General case' 0 CA--C 1.574 1.887 0 N-CA-C 121.002 3.704 . . . . 2.0 121.002 -179.482 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 31' ' ' THR . . . . . . . . . . . . 0.283 12.2 t -18.41 -60.2 0.02 OUTLIER 'General case' 0 N--CA 1.508 2.44 0 N-CA-C 121.366 3.839 . . . . 2.0 121.366 -179.942 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 32' ' ' ILE . . . . . . . . . . . . . 1.8 mp -95.9 103.76 14.34 Favored Pre-proline 0 CA--C 1.59 2.491 0 N-CA-C 101.414 -3.551 . . . . 2.0 101.414 179.641 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 33' ' ' PRO . . . . . . . . . . . . . 55.6 Cg_endo -65.69 170.3 11.49 Favored 'Trans proline' 0 CA--C 1.56 1.791 1 N-CA-C 123.571 4.412 . . . . 2.0 123.571 -179.521 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 34' ' ' VAL . . . . . . . . . . . . . 54.9 t -73.04 -50.64 30.75 Favored 'Isoleucine or valine' 0 CA--C 1.594 2.642 0 N-CA-C 105.303 -2.11 . . . . 2.0 105.303 178.889 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 2.0 tptm -141.5 157.68 44.82 Favored 'General case' 0 CA--C 1.562 1.43 0 C-N-CA 126.618 1.967 . . . . 2.0 109.007 179.654 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 36' ' ' ARG . . . . . . . . . . . . 0.333 45.2 ttp180 -132.61 67.54 1.53 Allowed 'General case' 0 N--CA 1.498 1.937 0 N-CA-C 104.069 -2.567 . . . . 2.0 104.069 179.484 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . -94.23 -142.75 12.66 Favored Glycine 0 CA--C 1.545 1.924 1 N-CA-C 124.788 4.675 . . . . 2.0 124.788 -179.439 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 38' ' ' CYS . . . . . 0.429 ' HB2' ' SG ' ' A' ' 3' ' ' CYS 0.275 40.3 t -129.86 131.65 46.17 Favored 'General case' 0 CA--C 1.567 1.6 0 C-N-CA 125.23 1.412 . . . . 2.0 113.588 -179.575 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 39' ' ' ILE . . . . . . . . . . . . . 4.4 tp -153.75 172.95 0.68 Allowed 'Isoleucine or valine' 0 N--CA 1.504 2.23 0 N-CA-C 115.079 1.511 . . . . 2.0 115.079 -179.72 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 40' ' ' ASP . . . . . . . . . . . . . 10.1 p-10 -84.67 -54.98 4.35 Favored 'General case' 0 N--CA 1.513 2.677 0 O-C-N 119.315 -2.116 . . . . 2.0 113.683 179.694 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 73.5 t -128.34 148.39 32.83 Favored 'Isoleucine or valine' 0 CA--C 1.564 1.51 0 N-CA-C 103.16 -2.904 . . . . 2.0 103.16 179.522 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 42' ' ' CYS . . . . . . . . . . . . . 1.0 OUTLIER -61.42 105.22 0.56 Allowed Pre-proline 0 CA--C 1.603 2.988 1 N-CA-C 99.936 -4.098 . . . . 2.0 99.936 179.456 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 43' ' ' PRO . . . . . . . . . . . . 0.257 25.9 Cg_exo -49.6 175.93 0.03 OUTLIER 'Trans proline' 0 C--N 1.372 1.77 1 N-CA-C 125.23 5.05 . . . . 2.0 125.23 -178.555 . . . . . . . . 3 2 . 1 . 010 nuclear nobuild core ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 97.3 mttt -72.72 92.5 1.56 Allowed 'General case' 0 CA--C 1.569 1.684 0 N-CA-C 106.388 -1.708 . . . . 2.0 106.388 179.579 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 45' ' ' ASN . . . . . . . . . . . . . 2.6 p-10 -65.53 156.89 31.19 Favored 'General case' 0 CA--C 1.565 1.531 0 N-CA-C 116.429 2.011 . . . . 2.0 116.429 -179.607 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 11.3 t -132.44 -170.45 2.43 Favored 'General case' 0 N--CA 1.487 1.394 0 N-CA-C 113.614 0.968 . . . . 2.0 113.614 179.896 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 47' ' ' LEU . . . . . . . . . . . . 0.285 3.9 pp -58.41 -10.99 2.41 Favored 'General case' 0 N--CA 1.507 2.388 0 N-CA-C 117.125 2.268 . . . . 2.0 117.125 179.836 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 85.3 mt -104.57 -7.64 19.57 Favored 'General case' 0 CA--C 1.584 2.253 0 C-N-CA 126.281 1.833 . . . . 2.0 112.418 179.437 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 49' ' ' VAL . . . . . . . . . . . . . 8.1 p -156.17 164.33 1.27 Allowed 'Isoleucine or valine' 0 CA--C 1.579 2.085 0 N-CA-C 116.906 2.187 . . . . 2.0 116.906 -179.615 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 58.0 tttp -159.04 76.09 0.7 Allowed 'General case' 0 CA--C 1.577 2.015 0 N-CA-C 104.585 -2.376 . . . . 2.0 104.585 179.32 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 33.4 m-85 -51.76 126.04 16.73 Favored 'General case' 0 CA--C 1.571 1.755 1 N-CA-C 123.162 4.504 . . . . 2.0 123.162 -179.509 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 52' ' ' VAL . . . . . . . . . . . . 0.294 14.7 t -104.86 154.58 6.36 Favored 'Isoleucine or valine' 0 CA--C 1.581 2.143 0 N-CA-C 102.642 -3.095 . . . . 2.0 102.642 179.016 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 53' ' ' CYS . . . . . . . . . . . . . 1.3 p -153.0 159.94 42.96 Favored 'General case' 0 N--CA 1.496 1.857 0 O-C-N 117.851 -3.031 . . . . 2.0 118.277 -179.16 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 54' ' ' CYS . . . . . . . . . . . . . 27.6 p -145.23 120.66 10.32 Favored 'General case' 0 CA--C 1.574 1.879 0 C-N-CA 123.801 0.84 . . . . 2.0 110.358 179.784 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 16.0 m120 -55.18 12.26 0.0 OUTLIER 'General case' 0 N--CA 1.508 2.46 1 N-CA-C 124.719 5.081 . . . . 2.0 124.719 -179.618 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 56' ' ' THR . . . . . . . . . . . . 0.253 5.5 t -137.88 176.93 8.27 Favored 'General case' 0 N--CA 1.505 2.29 0 CA-C-N 123.078 2.672 . . . . 2.0 116.071 -179.91 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 57' ' ' ASP . . . . . . . . . . . . . 72.1 m-20 -63.68 121.11 13.16 Favored 'General case' 0 CA--C 1.567 1.633 0 N-CA-C 115.528 1.677 . . . . 2.0 115.528 -179.788 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 58' ' ' ARG . . . . . . . . . . . . 0.29 23.4 mtt180 59.65 14.76 4.21 Favored 'General case' 0 N--CA 1.503 2.203 0 N-CA-C 117.959 2.577 . . . . 2.0 117.959 -179.901 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 59' ' ' CYS . . . . . . . . . . . . . 29.3 p -68.0 -14.22 62.8 Favored 'General case' 0 N--CA 1.496 1.864 0 N-CA-C 118.349 2.722 . . . . 2.0 118.349 179.947 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 60' ' ' ASN . . . . . . . . . . . . . 32.5 p-10 . . . . . 0 CA--C 1.56 1.346 0 CA-C-O 125.216 2.436 . . . . 2.0 111.598 179.848 . . . . . . . . 0 0 . 1 . 011 nuclear nobuild core ' A' A ' 1' ' ' LEU . . . . . 0.63 HD13 ' SG ' ' A' ' 3' ' ' CYS . 0.4 OUTLIER . . . . . 0 CA--C 1.576 1.953 0 CA-C-O 122.51 1.148 . . . . 2.0 111.639 . . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 2.7 mppt? -145.0 97.74 3.06 Favored 'General case' 0 N--CA 1.486 1.371 0 N-CA-C 101.855 -3.387 . . . . 2.0 101.855 179.533 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 3' ' ' CYS . . . . . 0.63 ' SG ' HD13 ' A' ' 1' ' ' LEU . 72.6 m -105.48 -166.48 1.22 Allowed 'General case' 0 N--CA 1.49 1.562 0 N-CA-C 115.416 1.636 . . . . 2.0 115.416 -179.691 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 78.3 m-20 -126.68 121.42 32.05 Favored 'General case' 0 CA--C 1.559 1.3 0 CA-C-O 116.751 -1.595 . . . . 2.0 108.951 179.778 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 5' ' ' LYS . . . . . 0.414 ' HG2' ' H ' ' A' ' 11' ' ' SER . 0.0 OUTLIER -71.61 178.64 3.44 Favored 'General case' 0 CA--C 1.588 2.427 0 CA-C-N 123.579 2.9 . . . . 2.0 110.756 179.452 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 68.1 tp -58.41 -54.14 50.38 Favored 'General case' 0 N--CA 1.506 2.344 0 O-C-N 118.944 -2.347 . . . . 2.0 116.614 -179.768 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 7' ' ' ILE . . . . . . . . . . . . . 53.9 mt -52.21 141.71 30.31 Favored Pre-proline 0 CA--C 1.586 2.357 0 CA-C-O 117.175 -1.393 . . . . 2.0 114.515 -179.838 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 63.1 Cg_exo -39.03 -47.26 2.9 Favored 'Trans proline' 0 C--N 1.378 2.094 0 N-CA-C 120.271 3.143 . . . . 2.0 120.271 179.901 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 9' ' ' ILE . . . . . . . . . . . . . 11.3 tp -60.74 -39.55 82.08 Favored 'Isoleucine or valine' 0 N--CA 1.507 2.402 0 N-CA-C 113.932 1.086 . . . . 2.0 113.932 179.617 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . 48.55 111.34 0.0 OUTLIER 'General case' 0 CA--C 1.579 2.06 1 N-CA-C 123.97 4.804 . . . . 2.0 123.97 179.384 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 11' ' ' SER . . . . . 0.414 ' H ' ' HG2' ' A' ' 5' ' ' LYS . 98.2 p -58.05 153.45 14.57 Favored 'General case' 0 N--CA 1.501 2.082 0 C-N-CA 124.605 1.162 . . . . 2.0 114.117 179.689 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 12' ' ' LYS . . . . . . . . . . . . 0.279 81.4 tttt -90.93 -93.32 0.13 Allowed 'General case' 0 CA--C 1.581 2.165 0 N-CA-C 121.493 3.886 . . . . 2.0 121.493 -179.544 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 13' ' ' THR . . . . . . . . . . . . . 33.4 m -41.91 136.81 1.95 Allowed 'General case' 0 N--CA 1.498 1.974 0 N-CA-C 120.47 3.507 . . . . 2.0 120.47 -179.567 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 4.1 t -153.19 153.75 29.92 Favored Pre-proline 0 CA--C 1.601 2.934 0 C-N-CA 124.793 1.237 . . . . 2.0 111.226 -179.959 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 15' ' ' PRO . . . . . . . . . . . . . 65.7 Cg_exo -45.27 160.36 0.14 Allowed 'Trans proline' 0 CA--C 1.579 2.741 1 N-CA-C 126.083 5.378 . . . . 2.0 126.083 -179.819 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -82.27 168.22 17.82 Favored 'General case' 0 N--CA 1.5 2.064 0 C-N-CA 125.177 1.391 . . . . 2.0 112.944 179.731 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . 82.96 -49.65 4.26 Favored Glycine 1 N--CA 1.522 4.374 0 N-CA-C 108.162 -1.975 . . . . 2.0 108.162 -179.01 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 30.1 mmtm -72.41 94.8 1.68 Allowed 'General case' 0 CA--C 1.575 1.915 0 C-N-CA 129.32 3.048 . . . . 2.0 105.898 179.354 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 10.2 p30 -94.11 -25.03 17.33 Favored 'General case' 0 N--CA 1.498 1.932 0 N-CA-C 117.212 2.301 . . . . 2.0 117.212 179.913 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 70.2 mt -84.05 111.22 19.11 Favored 'General case' 0 CA--C 1.558 1.28 0 C-N-CA 125.596 1.558 . . . . 2.0 113.617 179.968 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 21' ' ' CYS . . . . . 0.428 ' SG ' HD22 ' A' ' 1' ' ' LEU . 2.0 m -81.25 101.31 9.64 Favored 'General case' 0 CA--C 1.578 2.026 1 N-CA-C 99.621 -4.214 . . . . 2.0 99.621 179.158 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 22' ' ' TYR . . . . . . . . . . . . . 5.8 p90 -83.66 164.26 19.78 Favored 'General case' 0 N--CA 1.48 1.074 0 N-CA-C 120.843 3.646 . . . . 2.0 120.843 -179.31 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 23' ' ' LYS . . . . . . . . . . . . 0.303 10.6 ptpp? -137.66 101.87 4.59 Favored 'General case' 0 CA--C 1.566 1.577 0 N-CA-C 104.389 -2.448 . . . . 2.0 104.389 179.306 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 24' ' ' MET . . . . . . . . . . . . . 4.7 ttt -65.41 92.8 0.13 Allowed 'General case' 0 CA--C 1.563 1.442 0 C-N-CA 125.149 1.38 . . . . 2.0 114.07 -179.803 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 25' ' ' PHE . . . . . . . . . . . . . 5.3 m-30 -81.61 104.14 11.82 Favored 'General case' 0 CA--C 1.568 1.636 0 N-CA-C 103.853 -2.647 . . . . 2.0 103.853 179.491 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 26' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -57.09 127.72 33.37 Favored 'General case' 0 N--CA 1.494 1.753 0 O-C-N 120.797 -1.189 . . . . 2.0 112.279 -179.809 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 27' ' ' MET . . . . . . . . . . . . . 0.1 OUTLIER -48.82 -32.74 9.24 Favored 'General case' 0 N--CA 1.509 2.496 0 N-CA-C 116.613 2.079 . . . . 2.0 116.613 -179.944 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 50.5 m -75.03 -30.61 61.13 Favored 'General case' 0 CA--C 1.592 2.594 0 O-C-N 121.512 -0.743 . . . . 2.0 112.238 179.162 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 56.5 t0 -151.04 92.2 1.79 Allowed 'General case' 0 CA--C 1.571 1.769 0 N-CA-C 105.083 -2.191 . . . . 2.0 105.083 179.687 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 3.2 mm? -65.56 -66.7 0.51 Allowed 'General case' 0 CA--C 1.571 1.769 0 N-CA-C 118.837 2.903 . . . . 2.0 118.837 -179.526 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 31' ' ' THR . . . . . . . . . . . . . 72.1 p -33.83 -48.44 0.29 Allowed 'General case' 0 N--CA 1.506 2.355 0 N-CA-C 120.457 3.503 . . . . 2.0 120.457 -179.704 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 32' ' ' ILE . . . . . . . . . . . . . 2.1 mp -93.96 107.27 26.88 Favored Pre-proline 0 CA--C 1.586 2.356 0 N-CA-C 101.606 -3.479 . . . . 2.0 101.606 179.554 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 33' ' ' PRO . . . . . . . . . . . . . 12.6 Cg_exo -68.79 149.08 72.55 Favored 'Trans proline' 0 CA--C 1.561 1.842 0 N-CA-C 118.383 2.417 . . . . 2.0 118.383 -179.602 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 34' ' ' VAL . . . . . . . . . . . . 0.283 24.5 t -86.75 -29.77 5.88 Favored 'Isoleucine or valine' 0 CA--C 1.583 2.249 0 C-N-CA 123.579 0.751 . . . . 2.0 111.543 179.421 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER -144.81 167.02 23.58 Favored 'General case' 0 CA--C 1.559 1.317 0 CA-C-O 123.602 1.668 . . . . 2.0 110.067 179.453 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 6.6 mtp180 -150.69 108.89 3.75 Favored 'General case' 0 CA--C 1.571 1.773 0 N-CA-C 104.814 -2.291 . . . . 2.0 104.814 -179.867 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . -140.97 -144.58 4.46 Favored Glycine 0 N--CA 1.498 2.824 0 N-CA-C 118.393 2.117 . . . . 2.0 118.393 -179.697 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 38' ' ' CYS . . . . . . . . . . . . . 20.8 p -130.93 131.99 44.81 Favored 'General case' 0 N--CA 1.494 1.738 0 N-CA-C 113.653 0.983 . . . . 2.0 113.653 179.99 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 39' ' ' ILE . . . . . 0.488 HG21 ' HD3' ' A' ' 43' ' ' PRO . 9.6 tp -152.85 175.83 0.58 Allowed 'Isoleucine or valine' 0 N--CA 1.498 1.969 0 C-N-CA 124.182 0.993 . . . . 2.0 112.751 -179.839 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 40' ' ' ASP . . . . . 0.428 ' H ' HG13 ' A' ' 39' ' ' ILE . 13.3 p-10 -108.02 -28.88 9.3 Favored 'General case' 0 N--CA 1.497 1.908 0 O-C-N 119.527 -1.983 . . . . 2.0 113.53 179.354 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 8.0 t -140.35 27.54 0.48 Allowed 'Isoleucine or valine' 0 N--CA 1.506 2.334 0 CA-C-N 120.134 1.334 . . . . 2.0 112.649 179.952 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 42' ' ' CYS . . . . . . . . . . . . 0.359 2.8 m 77.11 115.75 0.03 OUTLIER Pre-proline 0 CA--C 1.615 3.469 1 N-CA-C 97.03 -5.174 . . . . 2.0 97.03 -179.221 . . . . . . . . 3 2 . 1 . 011 nuclear nobuild core ' A' A ' 43' ' ' PRO . . . . . 0.488 ' HD3' HG21 ' A' ' 39' ' ' ILE 0.45 80.0 Cg_exo -30.06 -60.06 0.13 Allowed 'Trans proline' 0 C--N 1.371 1.745 1 N-CA-C 127.799 6.038 . . . . 2.0 127.799 -178.484 . . . . . . . . 4 3 . 1 . 011 nuclear nobuild core ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 9.1 mtmm 160.78 91.14 0.0 OUTLIER 'General case' 0 CA--C 1.561 1.373 1 N-CA-C 98.512 -4.625 . . . . 2.0 98.512 -179.879 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 45' ' ' ASN . . . . . . . . . . . . . 4.6 p-10 -66.02 113.76 4.68 Favored 'General case' 0 CA--C 1.572 1.798 0 N-CA-C 114.759 1.392 . . . . 2.0 114.759 -179.713 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 10.8 t -113.02 -169.96 1.58 Allowed 'General case' 0 N--CA 1.492 1.669 0 N-CA-C 114.09 1.145 . . . . 2.0 114.09 -179.947 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 47' ' ' LEU . . . . . . . . . . . . . 6.7 mp -54.77 -16.33 2.5 Favored 'General case' 0 N--CA 1.509 2.492 0 N-CA-C 116.984 2.216 . . . . 2.0 116.984 179.803 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 74.6 mt -103.98 -3.49 24.59 Favored 'General case' 0 CA--C 1.578 2.046 0 C-N-CA 125.577 1.551 . . . . 2.0 112.366 179.456 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 49' ' ' VAL . . . . . . . . . . . . . 7.2 p -166.91 150.78 1.56 Allowed 'Isoleucine or valine' 0 N--CA 1.5 2.071 0 N-CA-C 118.114 2.635 . . . . 2.0 118.114 -179.645 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 55.7 tttp -134.1 111.06 10.03 Favored 'General case' 0 CA--C 1.571 1.781 1 N-CA-C 98.259 -4.719 . . . . 2.0 98.259 179.391 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 86.8 m-85 -92.3 122.31 34.65 Favored 'General case' 0 N--CA 1.497 1.917 0 N-CA-C 118.573 2.805 . . . . 2.0 118.573 -179.353 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 52' ' ' VAL . . . . . . . . . . . . . 53.3 t -92.6 106.25 17.64 Favored 'Isoleucine or valine' 0 N--CA 1.503 2.208 0 N-CA-C 102.982 -2.97 . . . . 2.0 102.982 179.522 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 53' ' ' CYS . . . . . . . . . . . . 0.261 0.7 OUTLIER -108.16 139.32 43.01 Favored 'General case' 0 CA--C 1.575 1.923 0 N-CA-C 118.988 2.958 . . . . 2.0 118.988 -179.323 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 54' ' ' CYS . . . . . . . . . . . . . 30.0 p -127.71 118.83 24.54 Favored 'General case' 0 CA--C 1.575 1.922 0 C-N-CA 124.035 0.934 . . . . 2.0 110.834 179.821 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 4.8 p-10 -57.11 37.61 0.0 OUTLIER 'General case' 0 N--CA 1.508 2.463 1 N-CA-C 124.981 5.178 . . . . 2.0 124.981 -179.584 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 6.3 t -158.55 174.33 15.24 Favored 'General case' 0 N--CA 1.503 2.21 0 O-C-N 119.326 -2.109 . . . . 2.0 114.168 179.939 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 57' ' ' ASP . . . . . . . . . . . . . 69.4 m-20 -66.94 129.56 40.28 Favored 'General case' 0 CA--C 1.571 1.782 0 O-C-N 120.325 -1.485 . . . . 2.0 114.82 179.932 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 58' ' ' ARG . . . . . . . . . . . . 0.332 40.1 mtp85 52.19 24.71 2.91 Favored 'General case' 0 N--CA 1.499 2.008 0 N-CA-C 118.726 2.862 . . . . 2.0 118.726 179.917 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 59' ' ' CYS . . . . . . . . . . . . . 29.2 p -77.37 -19.89 55.57 Favored 'General case' 0 CA--C 1.579 2.06 0 O-C-N 120.668 -1.27 . . . . 2.0 114.352 179.608 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 60' ' ' ASN . . . . . . . . . . . . . 34.9 p-10 . . . . . 0 CA--C 1.563 1.473 0 CA-C-O 124.392 2.044 . . . . 2.0 113.525 179.881 . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' A' A ' 1' ' ' LEU . . . . . 0.466 ' C ' ' H ' ' A' ' 14' ' ' CYS . 3.4 tm? . . . . . 0 N--CA 1.495 1.782 0 CA-C-O 117.023 -1.465 . . . . 2.0 111.804 . . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 54.7 tptt -119.84 -55.31 2.1 Favored 'General case' 0 N--CA 1.514 2.757 0 CA-C-N 121.886 2.13 . . . . 2.0 109.181 179.656 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 3' ' ' CYS . . . . . . . . . . . . 0.312 1.9 m 76.6 -172.87 0.09 Allowed 'General case' 0 CA--C 1.563 1.471 0 N-CA-C 114.38 1.252 . . . . 2.0 114.38 -179.9 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 79.5 m-20 -91.05 152.48 20.63 Favored 'General case' 0 CA--C 1.55 0.955 0 N-CA-C 115.312 1.597 . . . . 2.0 115.312 -179.803 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 18.3 ptpt -90.84 -156.91 0.46 Allowed 'General case' 0 CA--C 1.579 2.087 0 N-CA-C 104.913 -2.254 . . . . 2.0 104.913 179.103 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 3.8 mm? -54.9 -34.0 62.6 Favored 'General case' 0 N--CA 1.512 2.637 0 O-C-N 117.679 -3.138 . . . . 2.0 115.154 179.665 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 7' ' ' ILE . . . . . . . . . . . . . 35.1 mt -75.74 141.43 72.21 Favored Pre-proline 0 CA--C 1.586 2.329 0 C-N-CA 125.312 1.445 . . . . 2.0 112.426 179.871 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 77.4 Cg_exo -55.94 -40.13 86.92 Favored 'Trans proline' 0 CA--C 1.57 2.321 0 C-N-CA 122.836 2.357 . . . . 2.0 117.964 179.596 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 9' ' ' ILE . . . . . . . . . . . . . 10.7 tp -97.75 93.04 3.13 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.726 0 C-N-CA 124.144 0.977 . . . . 2.0 111.083 179.969 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . 0.466 . . -133.71 -166.97 1.86 Allowed 'General case' 0 CA--C 1.583 2.223 0 N-CA-C 114.828 1.418 . . . . 2.0 114.828 179.991 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 11' ' ' SER . . . . . . . . . . . . 0.368 2.0 t -43.66 165.69 0.01 OUTLIER 'General case' 0 CA--C 1.586 2.34 1 N-CA-C 127.027 5.936 . . . . 2.0 127.027 -179.351 . . . . . . . . 3 2 . 1 . 001 nuclear nobuild full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 1.6 ttmp? -105.99 -74.96 0.64 Allowed 'General case' 0 CA--C 1.577 2.008 0 N-CA-C 121.475 3.88 . . . . 2.0 121.475 -179.545 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 13' ' ' THR . . . . . . . . . . . . . 14.9 t -135.22 124.32 24.37 Favored 'General case' 0 N--CA 1.506 2.33 0 N-CA-C 121.741 3.978 . . . . 2.0 121.741 -179.374 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 14' ' ' CYS . . . . . 0.554 ' SG ' ' HD2' ' A' ' 18' ' ' LYS . 0.5 OUTLIER -106.5 171.94 4.33 Favored Pre-proline 0 CA--C 1.599 2.863 0 C-N-CA 126.613 1.965 . . . . 2.0 108.938 179.493 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 15' ' ' PRO . . . . . . . . . . . . . 83.5 Cg_exo -49.04 174.63 0.03 OUTLIER 'Trans proline' 0 CA--C 1.57 2.288 1 N-CA-C 124.474 4.759 . . . . 2.0 124.474 -179.722 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . 32.82 -172.87 0.0 OUTLIER 'General case' 0 N--CA 1.5 2.065 1 N-CA-C 123.558 4.651 . . . . 2.0 123.558 179.734 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . -82.59 38.71 2.65 Favored Glycine 0 N--CA 1.502 3.092 0 O-C-N 120.296 -1.503 . . . . 2.0 113.861 179.459 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 18' ' ' LYS . . . . . 0.554 ' HD2' ' SG ' ' A' ' 14' ' ' CYS . 0.1 OUTLIER -82.91 74.63 9.85 Favored 'General case' 0 CA--C 1.566 1.573 0 C-N-CA 125.546 1.538 . . . . 2.0 109.059 179.902 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 7.8 p30 -57.18 -36.65 71.06 Favored 'General case' 0 N--CA 1.487 1.403 1 N-CA-C 122.821 4.378 . . . . 2.0 122.821 -179.626 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 88.2 mt -70.18 122.96 20.48 Favored 'General case' 0 CA--C 1.558 1.251 0 N-CA-C 117.209 2.3 . . . . 2.0 117.209 -179.801 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 21' ' ' CYS . . . . . 0.562 ' SG ' ' O ' ' A' ' 56' ' ' THR . 32.1 m -82.91 95.34 7.94 Favored 'General case' 0 CA--C 1.566 1.565 0 N-CA-C 102.516 -3.142 . . . . 2.0 102.516 179.314 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 22' ' ' TYR . . . . . . . . . . . . 0.442 0.0 OUTLIER -61.57 153.17 28.44 Favored 'General case' 0 CA--C 1.554 1.12 0 N-CA-C 118.018 2.599 . . . . 2.0 118.018 -179.478 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 39.2 ttmt -133.98 76.67 1.67 Allowed 'General case' 0 CA--C 1.563 1.442 0 N-CA-C 103.373 -2.825 . . . . 2.0 103.373 179.584 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 24' ' ' MET . . . . . . . . . . . . 0.262 5.9 ttt -63.17 78.67 0.02 OUTLIER 'General case' 0 CA--C 1.567 1.609 0 C-N-CA 126.037 1.735 . . . . 2.0 113.968 -179.838 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 25' ' ' PHE . . . . . . . . . . . . . 13.9 m-85 -72.35 147.37 46.35 Favored 'General case' 0 N--CA 1.485 1.318 0 N-CA-C 113.784 1.031 . . . . 2.0 113.784 179.976 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 26' ' ' MET . . . . . . . . . . . . . 73.4 mtp -72.04 127.16 31.68 Favored 'General case' 0 N--CA 1.493 1.696 0 O-C-N 121.307 -0.871 . . . . 2.0 108.85 179.51 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 27' ' ' MET . . . . . . . . . . . . . 27.9 ttt -55.76 -36.45 67.32 Favored 'General case' 0 N--CA 1.513 2.708 0 CA-C-N 121.621 2.01 . . . . 2.0 111.717 179.365 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 73.2 m -76.85 -29.6 55.93 Favored 'General case' 0 CA--C 1.585 2.308 0 N-CA-C 114.163 1.172 . . . . 2.0 114.163 179.324 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 8.9 t70 -150.76 81.12 1.34 Allowed 'General case' 0 CA--C 1.57 1.748 0 O-C-N 120.174 -1.579 . . . . 2.0 108.558 179.695 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 1.8 mm? -45.79 -75.98 0.03 OUTLIER 'General case' 0 CA--C 1.575 1.927 0 N-CA-C 120.688 3.588 . . . . 2.0 120.688 -179.507 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 31' ' ' THR . . . . . . . . . . . . 0.259 43.4 p -6.71 -66.87 0.0 OUTLIER 'General case' 0 N--CA 1.506 2.341 1 N-CA-C 122.511 4.263 . . . . 2.0 122.511 -179.735 . . . . . . . . 3 2 . 1 . 001 nuclear nobuild full ' A' A ' 32' ' ' ILE . . . . . . . . . . . . . 2.0 mp -99.04 106.89 40.96 Favored Pre-proline 0 CA--C 1.584 2.265 0 N-CA-C 102.173 -3.269 . . . . 2.0 102.173 179.726 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 33' ' ' PRO . . . . . . . . . . . . . 21.5 Cg_exo -59.39 166.02 8.34 Favored 'Trans proline' 0 CA--C 1.559 1.753 1 N-CA-C 123.744 4.478 . . . . 2.0 123.744 -179.658 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 34' ' ' VAL . . . . . . . . . . . . . 78.7 t -76.14 -51.67 19.47 Favored 'Isoleucine or valine' 0 CA--C 1.592 2.57 0 N-CA-C 103.125 -2.917 . . . . 2.0 103.125 178.637 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 59.9 mttm -143.43 167.52 21.99 Favored 'General case' 0 CA--C 1.564 1.494 0 CA-C-O 125.574 2.606 . . . . 2.0 108.652 179.451 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 9.1 mtp180 -142.88 119.56 11.13 Favored 'General case' 0 CA--C 1.582 2.191 1 N-CA-C 98.184 -4.747 . . . . 2.0 98.184 179.7 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . -157.8 -134.84 1.8 Allowed Glycine 0 N--CA 1.488 2.107 0 O-C-N 118.942 -2.349 . . . . 2.0 118.891 -179.44 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 38' ' ' CYS . . . . . . . . . . . . . 26.9 p -123.23 138.92 54.52 Favored 'General case' 0 N--CA 1.489 1.51 0 N-CA-C 117.421 2.378 . . . . 2.0 117.421 -179.821 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 39' ' ' ILE . . . . . 0.443 HG12 ' CG ' ' A' ' 43' ' ' PRO . 2.2 tp -164.65 159.01 1.29 Allowed 'Isoleucine or valine' 0 CA--C 1.576 1.959 0 N-CA-C 115.312 1.597 . . . . 2.0 115.312 -179.909 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 40' ' ' ASP . . . . . . . . . . . . . 9.3 p-10 -78.69 -48.14 15.58 Favored 'General case' 0 N--CA 1.506 2.363 0 O-C-N 119.751 -1.843 . . . . 2.0 114.313 179.595 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 91.2 t -135.83 144.02 34.7 Favored 'Isoleucine or valine' 0 CA--C 1.56 1.346 0 N-CA-C 102.972 -2.973 . . . . 2.0 102.972 179.703 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 42' ' ' CYS . . . . . . . . . . . . . 0.8 OUTLIER -58.37 105.49 0.55 Allowed Pre-proline 0 CA--C 1.603 3.01 0 N-CA-C 101.401 -3.555 . . . . 2.0 101.401 179.578 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 43' ' ' PRO . . . . . 0.443 ' CG ' HG12 ' A' ' 39' ' ' ILE . 24.7 Cg_exo -50.18 177.92 0.03 OUTLIER 'Trans proline' 0 C--N 1.372 1.811 1 N-CA-C 125.105 5.002 . . . . 2.0 125.105 -178.571 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 9.7 mtmp? -70.14 92.22 0.74 Allowed 'General case' 0 CA--C 1.566 1.589 0 N-CA-C 105.511 -2.033 . . . . 2.0 105.511 179.534 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 45' ' ' ASN . . . . . . . . . . . . . 2.5 p-10 -60.06 114.05 2.65 Favored 'General case' 0 CA--C 1.567 1.601 0 N-CA-C 116.73 2.122 . . . . 2.0 116.73 -179.402 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 7.8 t -80.09 -178.03 6.33 Favored 'General case' 0 CA--C 1.567 1.608 0 N-CA-C 114.667 1.358 . . . . 2.0 114.667 179.968 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 47' ' ' LEU . . . . . . . . . . . . . 97.4 mt -51.74 -28.34 14.8 Favored 'General case' 0 N--CA 1.505 2.309 0 N-CA-C 115.955 1.835 . . . . 2.0 115.955 179.777 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 79.1 mt -101.84 7.44 41.64 Favored 'General case' 0 CA--C 1.581 2.14 0 N-CA-C 114.518 1.303 . . . . 2.0 114.518 179.735 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 49' ' ' VAL . . . . . . . . . . . . . 13.9 p -148.14 159.67 7.4 Favored 'Isoleucine or valine' 0 N--CA 1.5 2.067 0 CA-C-N 122.195 2.27 . . . . 2.0 117.127 -179.518 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 13.3 tmtt? -155.27 86.65 1.09 Allowed 'General case' 0 CA--C 1.573 1.84 0 N-CA-C 101.625 -3.472 . . . . 2.0 101.625 179.562 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 36.7 m-85 -69.56 127.32 32.58 Favored 'General case' 0 CA--C 1.57 1.735 0 N-CA-C 121.442 3.867 . . . . 2.0 121.442 -179.297 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 52' ' ' VAL . . . . . . . . . . . . 0.323 8.6 t -99.51 162.51 2.98 Favored 'Isoleucine or valine' 0 CA--C 1.586 2.349 0 N-CA-C 102.574 -3.121 . . . . 2.0 102.574 178.881 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 53' ' ' CYS . . . . . . . . . . . . 0.318 1.2 p -166.2 153.47 9.83 Favored 'General case' 0 N--CA 1.495 1.801 0 O-C-N 117.388 -3.32 . . . . 2.0 117.993 -179.046 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 54' ' ' CYS . . . . . . . . . . . . 0.389 23.2 p -151.13 117.61 5.71 Favored 'General case' 0 CA--C 1.583 2.25 0 CA-C-O 122.946 1.355 . . . . 2.0 111.694 179.412 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 9.7 m120 -30.27 -0.8 0.0 OUTLIER 'General case' 0 CA--C 1.582 2.19 1 N-CA-C 129.681 6.919 . . . . 2.0 129.681 -179.596 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 56' ' ' THR . . . . . 0.562 ' O ' ' SG ' ' A' ' 21' ' ' CYS . 7.2 t -143.46 160.85 39.83 Favored 'General case' 0 N--CA 1.515 2.782 0 CA-C-N 125.564 3.802 . . . . 2.0 116.225 -179.747 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 57' ' ' ASP . . . . . . . . . . . . . 44.1 m-20 -46.27 104.07 0.05 OUTLIER 'General case' 0 N--CA 1.503 2.203 0 N-CA-C 118.416 2.747 . . . . 2.0 118.416 -179.783 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 58' ' ' ARG . . . . . . . . . . . . 0.315 27.7 mtm180 82.27 16.8 0.39 Allowed 'General case' 0 N--CA 1.507 2.405 0 C-N-CA 125.481 1.512 . . . . 2.0 115.057 -179.695 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 59' ' ' CYS . . . . . . . . . . . . . 34.0 t -63.84 -26.34 68.57 Favored 'General case' 0 CA--C 1.58 2.11 0 N-CA-C 115.148 1.536 . . . . 2.0 115.148 179.689 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 60' ' ' ASN . . . . . . . . . . . . . 51.2 p30 . . . . . 0 CA--C 1.568 1.652 0 CA-C-O 124.309 2.004 . . . . 2.0 114.975 179.837 . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' A' A ' 1' ' ' LEU . . . . . 0.436 HD23 ' SG ' ' A' ' 3' ' ' CYS . 14.2 tp . . . . . 0 CA--C 1.567 1.597 0 N-CA-C 113.883 1.068 . . . . 2.0 113.883 . . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 27.5 mtpt -89.87 130.33 36.11 Favored 'General case' 0 CA--C 1.571 1.776 0 N-CA-C 106.118 -1.808 . . . . 2.0 106.118 179.399 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 3' ' ' CYS . . . . . 0.436 ' SG ' HD23 ' A' ' 1' ' ' LEU . 90.8 m -131.75 -171.44 2.62 Favored 'General case' 0 N--CA 1.499 2.012 0 O-C-N 119.374 -2.079 . . . . 2.0 113.935 -179.84 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 77.9 m-20 -135.83 118.92 16.46 Favored 'General case' 0 CA--C 1.558 1.262 0 C-N-CA 123.562 0.745 . . . . 2.0 112.789 179.943 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -71.14 177.12 3.96 Favored 'General case' 0 CA--C 1.594 2.65 0 CA-C-N 120.34 1.427 . . . . 2.0 110.438 179.209 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 32.1 mt -48.72 -43.45 37.31 Favored 'General case' 0 N--CA 1.514 2.758 0 N-CA-C 119.394 3.109 . . . . 2.0 119.394 -179.84 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 7' ' ' ILE . . . . . . . . . . . . . 46.4 mm -35.62 139.11 0.39 Allowed Pre-proline 0 CA--C 1.583 2.214 0 N-CA-C 116.636 2.088 . . . . 2.0 116.636 -179.87 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 49.4 Cg_exo -37.39 -51.94 1.56 Allowed 'Trans proline' 0 CA--C 1.565 2.055 0 C-N-CA 123.673 2.916 . . . . 2.0 118.729 -179.961 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 9' ' ' ILE . . . . . . . . . . . . 0.31 17.4 tt -84.63 -71.69 0.41 Allowed 'Isoleucine or valine' 0 N--CA 1.496 1.852 0 N-CA-C 107.745 -1.206 . . . . 2.0 107.745 179.471 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . 58.76 137.55 0.01 OUTLIER 'General case' 0 CA--C 1.574 1.887 0 N-CA-C 119.447 3.128 . . . . 2.0 119.447 179.639 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 38.8 t -147.99 -143.61 0.14 Allowed 'General case' 0 CA--C 1.581 2.158 0 O-C-N 120.32 -1.487 . . . . 2.0 111.644 -179.943 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . 0.369 3.9 ttmt 92.14 174.98 0.02 OUTLIER 'General case' 0 N--CA 1.503 2.188 0 C-N-CA 126.061 1.745 . . . . 2.0 115.172 -179.915 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 13' ' ' THR . . . . . . . . . . . . . 84.9 m -152.66 149.59 28.58 Favored 'General case' 0 N--CA 1.495 1.807 0 N-CA-C 114.007 1.114 . . . . 2.0 114.007 -179.689 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 14' ' ' CYS . . . . . . . . . . . . 0.295 0.1 OUTLIER -134.16 176.97 2.48 Favored Pre-proline 0 CA--C 1.599 2.85 0 C-N-CA 124.545 1.138 . . . . 2.0 109.625 179.398 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 15' ' ' PRO . . . . . . . . . . . . . 88.0 Cg_exo -52.99 172.2 0.2 Allowed 'Trans proline' 0 CA--C 1.572 2.422 1 N-CA-C 126.232 5.435 . . . . 2.0 126.232 -179.64 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -78.56 169.97 17.4 Favored 'General case' 0 N--CA 1.498 1.938 0 N-CA-C 107.965 -1.124 . . . . 2.0 107.965 179.247 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . 83.79 -50.41 4.4 Favored Glycine 1 N--CA 1.519 4.201 0 O-C-N 118.295 -2.753 . . . . 2.0 106.942 -178.953 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 73.9 mmtt -78.76 71.62 5.23 Favored 'General case' 0 CA--C 1.581 2.168 0 N-CA-C 104.259 -2.497 . . . . 2.0 104.259 179.105 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 8.5 p30 -82.15 -21.48 36.56 Favored 'General case' 0 N--CA 1.49 1.571 1 N-CA-C 121.928 4.047 . . . . 2.0 121.928 -179.513 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 86.0 mt -88.16 119.54 28.65 Favored 'General case' 0 CA--C 1.553 1.087 0 N-CA-C 113.298 0.851 . . . . 2.0 113.298 -179.934 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 21' ' ' CYS . . . . . 0.407 ' SG ' HD21 ' A' ' 1' ' ' LEU . 4.5 m -83.96 100.82 11.28 Favored 'General case' 0 CA--C 1.58 2.131 1 N-CA-C 99.664 -4.198 . . . . 2.0 99.664 179.198 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 22' ' ' TYR . . . . . . . . . . . . . 4.7 p90 -75.45 159.58 31.19 Favored 'General case' 0 CA--C 1.556 1.181 0 N-CA-C 119.505 3.15 . . . . 2.0 119.505 -179.349 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 29.4 ttpt -139.03 98.65 3.58 Favored 'General case' 0 CA--C 1.565 1.556 0 N-CA-C 103.219 -2.882 . . . . 2.0 103.219 179.567 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 24' ' ' MET . . . . . 0.526 ' SD ' ' HB2' ' A' ' 35' ' ' LYS . 13.6 ttm -69.73 74.93 0.43 Allowed 'General case' 0 CA--C 1.57 1.737 0 N-CA-C 114.805 1.409 . . . . 2.0 114.805 -179.76 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 25' ' ' PHE . . . . . . . . . . . . . 4.5 m-30 -62.48 128.09 34.36 Favored 'General case' 0 N--CA 1.497 1.917 0 O-C-N 120.431 -1.418 . . . . 2.0 112.121 179.821 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 26' ' ' MET . . . . . . . . . . . . . 76.5 mtp -57.31 129.32 41.25 Favored 'General case' 0 N--CA 1.497 1.886 0 N-CA-C 114.305 1.224 . . . . 2.0 114.305 179.895 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 27' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -59.09 -39.42 82.12 Favored 'General case' 0 N--CA 1.512 2.644 0 CA-C-N 120.985 1.72 . . . . 2.0 110.742 179.381 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 48.9 m -68.75 -34.35 75.44 Favored 'General case' 0 CA--C 1.584 2.281 0 N-CA-C 113.647 0.981 . . . . 2.0 113.647 179.368 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 8.9 t70 -155.47 84.49 1.05 Allowed 'General case' 0 CA--C 1.572 1.794 0 O-C-N 120.631 -1.293 . . . . 2.0 109.343 179.671 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 30' ' ' LEU . . . . . 0.471 ' H ' HD22 ' A' ' 30' ' ' LEU . 2.3 mm? -44.43 -41.51 6.3 Favored 'General case' 0 CA--C 1.574 1.887 0 N-CA-C 120.76 3.615 . . . . 2.0 120.76 -179.776 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 31' ' ' THR . . . . . . . . . . . . . 43.3 p -41.06 -54.82 2.73 Favored 'General case' 0 N--CA 1.502 2.138 0 N-CA-C 119.587 3.18 . . . . 2.0 119.587 -179.784 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 32' ' ' ILE . . . . . . . . . . . . . 2.1 mp -96.61 114.63 64.81 Favored Pre-proline 0 CA--C 1.586 2.34 0 N-CA-C 106.7 -1.593 . . . . 2.0 106.7 179.914 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 33' ' ' PRO . . . . . . . . . . . . . 13.3 Cg_exo -70.29 151.0 65.84 Favored 'Trans proline' 0 CA--C 1.572 2.422 0 N-CA-C 119.261 2.754 . . . . 2.0 119.261 -179.871 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 34' ' ' VAL . . . . . . . . . . . . . 60.9 t -79.14 -38.75 20.63 Favored 'Isoleucine or valine' 0 N--CA 1.509 2.489 0 C-N-CA 124.397 1.079 . . . . 2.0 111.119 179.445 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 35' ' ' LYS . . . . . 0.526 ' HB2' ' SD ' ' A' ' 24' ' ' MET . 18.1 tptt -147.93 170.32 17.95 Favored 'General case' 0 CA--C 1.559 1.295 0 CA-C-O 123.986 1.85 . . . . 2.0 110.151 179.817 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 36' ' ' ARG . . . . . . . . . . . . 0.269 7.2 ttp180 -148.21 114.27 5.81 Favored 'General case' 0 CA--C 1.575 1.939 0 N-CA-C 101.423 -3.547 . . . . 2.0 101.423 -179.906 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . -145.65 -148.99 4.91 Favored Glycine 0 N--CA 1.496 2.694 0 N-CA-C 119.793 2.677 . . . . 2.0 119.793 -179.561 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 38' ' ' CYS . . . . . . . . . . . . . 13.6 p -126.42 137.27 53.4 Favored 'General case' 0 CA--C 1.571 1.752 0 C-N-CA 123.89 0.876 . . . . 2.0 112.064 179.933 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 39' ' ' ILE . . . . . 0.841 HG21 ' HD3' ' A' ' 43' ' ' PRO . 10.5 tp -165.03 165.77 0.55 Allowed 'Isoleucine or valine' 0 N--CA 1.509 2.494 0 O-C-N 120.595 -1.316 . . . . 2.0 113.997 -179.703 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 40' ' ' ASP . . . . . . . . . . . . . 7.9 p-10 -79.31 -46.95 16.7 Favored 'General case' 0 N--CA 1.505 2.29 0 O-C-N 119.283 -2.136 . . . . 2.0 114.471 179.493 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 80.5 t -130.75 152.03 36.87 Favored 'Isoleucine or valine' 0 CA--C 1.576 1.965 0 C-N-CA 127.134 2.174 . . . . 2.0 105.275 179.644 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 42' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -52.59 111.01 2.23 Favored Pre-proline 0 N--CA 1.526 3.332 0 N-CA-C 102.745 -3.057 . . . . 2.0 102.745 179.359 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 43' ' ' PRO . . . . . 0.841 ' HD3' HG21 ' A' ' 39' ' ' ILE 0.548 71.7 Cg_exo -11.94 -109.4 0.0 OUTLIER 'Trans proline' 0 C--N 1.378 2.079 2 C-N-CA 125.799 4.332 . . . . 2.0 123.02 -178.408 . . . . . . . . 4 3 . 1 . 002 nuclear nobuild full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 6.0 mtmp? -159.8 95.28 1.18 Allowed 'General case' 0 CA--C 1.556 1.183 1 N-CA-C 96.68 -5.304 . . . . 2.0 96.68 179.691 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 45' ' ' ASN . . . . . . . . . . . . . 2.8 p-10 -62.66 97.47 0.1 Allowed 'General case' 0 CA--C 1.575 1.912 0 N-CA-C 116.404 2.001 . . . . 2.0 116.404 -179.522 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 13.7 t -79.64 -179.18 6.74 Favored 'General case' 0 CA--C 1.567 1.615 0 N-CA-C 114.35 1.241 . . . . 2.0 114.35 179.981 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 47' ' ' LEU . . . . . . . . . . . . 0.385 1.3 pp -54.52 -15.66 1.88 Allowed 'General case' 0 N--CA 1.509 2.521 0 N-CA-C 117.938 2.57 . . . . 2.0 117.938 179.819 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 84.5 mt -104.29 3.49 32.64 Favored 'General case' 0 CA--C 1.59 2.501 0 C-N-CA 125.463 1.505 . . . . 2.0 111.471 179.133 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 49' ' ' VAL . . . . . . . . . . . . . 6.7 p -157.7 156.09 4.43 Favored 'Isoleucine or valine' 0 CA--C 1.579 2.082 0 N-CA-C 118.439 2.755 . . . . 2.0 118.439 -179.584 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -145.81 72.37 1.3 Allowed 'General case' 0 CA--C 1.584 2.258 0 N-CA-C 103.143 -2.91 . . . . 2.0 103.143 179.097 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 97.2 m-85 -44.88 133.72 6.09 Favored 'General case' 0 CA--C 1.574 1.896 0 N-CA-C 120.402 3.482 . . . . 2.0 120.402 -179.498 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 52' ' ' VAL . . . . . . . . . . . . . 40.6 t -115.9 103.02 14.55 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.897 0 N-CA-C 103.081 -2.933 . . . . 2.0 103.081 179.726 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 53' ' ' CYS . . . . . . . . . . . . 0.255 4.2 m -121.11 153.65 37.19 Favored 'General case' 0 CA--C 1.569 1.695 0 N-CA-C 117.881 2.548 . . . . 2.0 117.881 -179.6 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 54' ' ' CYS . . . . . . . . . . . . 0.351 8.6 p -141.73 127.69 19.46 Favored 'General case' 0 CA--C 1.577 2.019 0 CA-C-O 122.427 1.108 . . . . 2.0 111.065 179.703 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 4.7 p-10 -53.15 36.24 0.0 OUTLIER 'General case' 0 N--CA 1.5 2.062 1 N-CA-C 125.8 5.481 . . . . 2.0 125.8 -179.56 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 56' ' ' THR . . . . . . . . . . . . 0.253 7.2 t -153.8 170.88 19.9 Favored 'General case' 0 N--CA 1.499 2.022 0 O-C-N 119.443 -2.035 . . . . 2.0 114.424 179.968 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 57' ' ' ASP . . . . . . . . . . . . . 73.3 m-20 -60.98 117.96 6.13 Favored 'General case' 0 CA--C 1.563 1.444 0 N-CA-C 114.487 1.291 . . . . 2.0 114.487 -179.807 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 58' ' ' ARG . . . . . . . . . . . . . 78.0 mtt85 64.09 20.51 12.22 Favored 'General case' 0 N--CA 1.5 2.075 0 N-CA-C 116.222 1.934 . . . . 2.0 116.222 -179.834 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 59' ' ' CYS . . . . . . . . . . . . . 49.3 t -62.84 -28.82 70.28 Favored 'General case' 0 CA--C 1.575 1.94 0 N-CA-C 116.7 2.111 . . . . 2.0 116.7 179.912 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 60' ' ' ASN . . . . . . . . . . . . . 41.3 p-10 . . . . . 0 CA--C 1.572 1.793 0 CA-C-O 124.252 1.977 . . . . 2.0 115.46 179.846 . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' A' A ' 1' ' ' LEU . . . . . 0.548 HD13 ' SG ' ' A' ' 3' ' ' CYS . 0.5 OUTLIER . . . . . 0 CA--C 1.579 2.058 0 CA-C-O 123.065 1.412 . . . . 2.0 112.51 . . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 53.9 mttp -145.2 111.28 5.56 Favored 'General case' 0 CA--C 1.566 1.559 0 N-CA-C 100.801 -3.777 . . . . 2.0 100.801 179.427 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 3' ' ' CYS . . . . . 0.548 ' SG ' HD13 ' A' ' 1' ' ' LEU . 90.7 m -133.02 156.85 46.6 Favored 'General case' 0 N--CA 1.491 1.588 0 O-C-N 120.335 -1.478 . . . . 2.0 113.909 -179.722 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 29.6 m-20 -105.63 117.18 33.35 Favored 'General case' 0 N--CA 1.487 1.415 0 N-CA-C 114.259 1.207 . . . . 2.0 114.259 -179.768 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . 0.301 1.1 pttt -64.63 -179.9 0.55 Allowed 'General case' 0 CA--C 1.58 2.133 0 O-C-N 120.518 -1.364 . . . . 2.0 112.686 179.634 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -41.75 -43.82 3.03 Favored 'General case' 0 N--CA 1.502 2.171 1 N-CA-C 121.94 4.052 . . . . 2.0 121.94 -179.691 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 7' ' ' ILE . . . . . . . . . . . . . 35.8 mt -55.39 142.15 60.67 Favored Pre-proline 0 CA--C 1.588 2.416 0 CA-C-O 116.882 -1.532 . . . . 2.0 113.227 179.878 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 65.3 Cg_exo -35.54 -54.04 0.77 Allowed 'Trans proline' 0 CA--C 1.57 2.321 0 C-N-CA 123.914 3.076 . . . . 2.0 118.78 179.977 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 9' ' ' ILE . . . . . . . . . . . . . 1.6 pp -126.44 75.27 0.51 Allowed 'Isoleucine or valine' 0 CA--C 1.575 1.924 0 N-CA-C 107.253 -1.388 . . . . 2.0 107.253 179.658 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -80.23 -163.32 0.54 Allowed 'General case' 0 CA--C 1.579 2.087 0 N-CA-C 119.19 3.033 . . . . 2.0 119.19 -179.749 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 8.8 t -57.12 -178.94 0.03 OUTLIER 'General case' 0 CA--C 1.582 2.201 0 N-CA-C 118.091 2.626 . . . . 2.0 118.091 -179.845 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . 0.25 37.1 ttpt -120.97 -93.5 0.52 Allowed 'General case' 0 CA--C 1.578 2.021 0 N-CA-C 118.324 2.712 . . . . 2.0 118.324 -179.64 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 13' ' ' THR . . . . . . . . . . . . . 32.6 m -46.59 134.56 9.36 Favored 'General case' 0 N--CA 1.501 2.087 0 N-CA-C 120.259 3.429 . . . . 2.0 120.259 -179.454 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 3.9 t -149.47 154.57 38.51 Favored Pre-proline 0 CA--C 1.598 2.823 0 C-N-CA 124.616 1.166 . . . . 2.0 111.174 -179.932 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 15' ' ' PRO . . . . . . . . . . . . . 58.4 Cg_exo -43.25 157.63 0.1 Allowed 'Trans proline' 0 CA--C 1.575 2.535 1 N-CA-C 126.659 5.6 . . . . 2.0 126.659 -179.66 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -79.76 168.92 18.68 Favored 'General case' 0 N--CA 1.499 1.981 0 C-N-CA 124.87 1.268 . . . . 2.0 111.385 179.642 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . 83.75 -51.59 4.59 Favored Glycine 1 N--CA 1.519 4.197 0 O-C-N 119.381 -2.074 . . . . 2.0 108.215 -179.049 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 21.1 mmtm -71.87 101.44 2.64 Favored 'General case' 0 CA--C 1.572 1.803 0 C-N-CA 129.048 2.939 . . . . 2.0 106.764 179.386 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 19' ' ' ASN . . . . . . . . . . . . 0.34 0.2 OUTLIER -106.94 -8.11 16.76 Favored 'General case' 0 N--CA 1.499 2.012 0 N-CA-C 117.406 2.372 . . . . 2.0 117.406 179.862 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 89.0 mt -100.2 113.97 27.04 Favored 'General case' 0 CA--C 1.563 1.471 0 C-N-CA 126.141 1.776 . . . . 2.0 109.593 179.605 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 1.3 m -80.23 101.05 8.63 Favored 'General case' 0 CA--C 1.577 1.996 0 N-CA-C 101.457 -3.535 . . . . 2.0 101.457 179.226 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 22' ' ' TYR . . . . . . . . . . . . 0.37 13.2 p90 -75.91 160.29 30.06 Favored 'General case' 0 N--CA 1.484 1.23 0 N-CA-C 119.145 3.016 . . . . 2.0 119.145 -179.509 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 60.2 tttt -135.98 87.31 2.3 Favored 'General case' 0 CA--C 1.565 1.527 0 N-CA-C 103.125 -2.917 . . . . 2.0 103.125 179.846 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 24' ' ' MET . . . . . 0.575 ' HB3' ' H ' ' A' ' 35' ' ' LYS . 24.2 ttt -61.89 76.75 0.02 OUTLIER 'General case' 0 N--CA 1.492 1.659 0 N-CA-C 118.242 2.682 . . . . 2.0 118.242 -179.58 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 25' ' ' PHE . . . . . . . . . . . . . 12.5 m-30 -69.53 128.0 34.96 Favored 'General case' 0 CA--C 1.568 1.656 0 O-C-N 120.598 -1.313 . . . . 2.0 112.328 179.839 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 26' ' ' MET . . . . . . . . . . . . . 32.2 mtm -64.16 132.02 49.17 Favored 'General case' 0 N--CA 1.501 2.087 0 O-C-N 120.308 -1.495 . . . . 2.0 108.524 179.619 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 27' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -53.48 -31.12 44.45 Favored 'General case' 0 N--CA 1.511 2.58 0 CA-C-N 121.772 2.078 . . . . 2.0 114.045 179.775 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 50.3 m -83.73 -39.77 19.7 Favored 'General case' 0 CA--C 1.587 2.371 0 C-N-CA 124.634 1.174 . . . . 2.0 112.004 179.218 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 38.6 t70 -131.66 88.32 2.56 Favored 'General case' 0 CA--C 1.572 1.789 0 N-CA-C 107.08 -1.452 . . . . 2.0 107.08 179.773 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 2.2 mm? -60.57 -82.66 0.02 OUTLIER 'General case' 0 CA--C 1.578 2.022 0 N-CA-C 121.078 3.733 . . . . 2.0 121.078 -179.413 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 31' ' ' THR . . . . . . . . . . . . 0.344 13.9 t -19.13 -52.22 0.01 OUTLIER 'General case' 0 N--CA 1.51 2.543 1 N-CA-C 123.257 4.54 . . . . 2.0 123.257 -179.643 . . . . . . . . 3 2 . 1 . 003 nuclear nobuild full ' A' A ' 32' ' ' ILE . . . . . . . . . . . . . 1.7 mp -97.28 105.93 28.5 Favored Pre-proline 0 CA--C 1.59 2.518 1 N-CA-C 99.314 -4.328 . . . . 2.0 99.314 179.432 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 33' ' ' PRO . . . . . . . . . . . . . 5.5 Cg_endo -73.14 178.23 6.81 Favored 'Trans proline' 0 CA--C 1.568 2.19 0 N-CA-C 120.323 3.163 . . . . 2.0 120.323 -179.446 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 34' ' ' VAL . . . . . . . . . . . . . 56.0 t -85.79 -63.05 1.33 Allowed 'Isoleucine or valine' 0 CA--C 1.585 2.292 0 N-CA-C 106.865 -1.531 . . . . 2.0 106.865 179.309 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 35' ' ' LYS . . . . . 0.575 ' H ' ' HB3' ' A' ' 24' ' ' MET . 38.9 ttmt -139.34 113.62 8.92 Favored 'General case' 0 CA--C 1.558 1.281 0 C-N-CA 124.419 1.088 . . . . 2.0 113.609 -179.9 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 36' ' ' ARG . . . . . . . . . . . . 0.345 51.8 ttp180 -85.69 73.27 10.45 Favored 'General case' 0 CA--C 1.59 2.485 0 O-C-N 120.257 -1.527 . . . . 2.0 110.319 179.971 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . -98.44 -145.84 19.48 Favored Glycine 0 N--CA 1.501 2.976 1 N-CA-C 123.535 4.174 . . . . 2.0 123.535 -179.507 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 38' ' ' CYS . . . . . . . . . . . . . 14.6 p -126.64 132.99 51.1 Favored 'General case' 0 N--CA 1.498 1.955 0 N-CA-C 114.887 1.44 . . . . 2.0 114.887 179.921 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 39' ' ' ILE . . . . . 0.596 HG13 ' H ' ' A' ' 40' ' ' ASP . 6.2 tp -152.81 -174.8 0.18 Allowed 'Isoleucine or valine' 0 N--CA 1.502 2.174 0 C-N-CA 124.7 1.2 . . . . 2.0 111.598 -179.93 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 40' ' ' ASP . . . . . 0.596 ' H ' HG13 ' A' ' 39' ' ' ILE . 4.0 p30 -119.55 -25.94 5.87 Favored 'General case' 0 N--CA 1.5 2.046 0 O-C-N 119.339 -2.101 . . . . 2.0 113.075 179.212 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 54.9 t -137.14 16.53 0.84 Allowed 'Isoleucine or valine' 0 N--CA 1.504 2.235 0 CA-C-N 120.546 1.521 . . . . 2.0 113.001 179.853 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 42' ' ' CYS . . . . . . . . . . . . 0.314 3.1 m 81.59 111.91 0.03 OUTLIER Pre-proline 0 CA--C 1.61 3.271 1 N-CA-C 95.454 -5.758 . . . . 2.0 95.454 -178.972 . . . . . . . . 3 2 . 1 . 003 nuclear nobuild full ' A' A ' 43' ' ' PRO . . . . . 0.496 ' HD3' HG21 ' A' ' 39' ' ' ILE 0.498 41.5 Cg_exo -22.03 -75.27 0.02 OUTLIER 'Trans proline' 0 C--N 1.376 1.998 1 N-CA-C 125.061 4.985 . . . . 2.0 125.061 -178.635 . . . . . . . . 4 3 . 1 . 003 nuclear nobuild full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 3.4 mtpp -179.74 101.64 0.03 OUTLIER 'General case' 0 CA--C 1.564 1.489 1 N-CA-C 99.881 -4.118 . . . . 2.0 99.881 179.832 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 45' ' ' ASN . . . . . . . . . . . . . 2.5 p-10 -73.82 139.69 45.29 Favored 'General case' 0 N--CA 1.492 1.661 0 O-C-N 120.268 -1.52 . . . . 2.0 114.573 -179.811 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 12.3 t -148.34 -173.48 4.33 Favored 'General case' 0 N--CA 1.49 1.551 0 N-CA-C 112.896 0.702 . . . . 2.0 112.896 179.936 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 47' ' ' LEU . . . . . . . . . . . . . 2.6 pp -57.76 -15.34 7.78 Favored 'General case' 0 N--CA 1.508 2.439 0 N-CA-C 116.578 2.066 . . . . 2.0 116.578 179.572 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 10.0 tp -96.78 -27.0 14.93 Favored 'General case' 0 CA--C 1.579 2.064 0 C-N-CA 126.513 1.925 . . . . 2.0 112.049 179.374 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 49' ' ' VAL . . . . . . . . . . . . . 10.9 p -154.15 146.9 13.87 Favored 'Isoleucine or valine' 0 CA--C 1.579 2.059 0 N-CA-C 119.021 2.971 . . . . 2.0 119.021 -179.522 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 18.9 ttpt -132.18 120.64 22.52 Favored 'General case' 0 CA--C 1.572 1.819 0 N-CA-C 101.7 -3.444 . . . . 2.0 101.7 179.526 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -103.05 135.27 45.04 Favored 'General case' 0 N--CA 1.506 2.34 0 O-C-N 118.393 -2.692 . . . . 2.0 117.635 -179.293 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 52' ' ' VAL . . . . . . . . . . . . . 25.4 t -102.22 97.39 5.59 Favored 'Isoleucine or valine' 0 CA--C 1.575 1.91 0 N-CA-C 104.012 -2.588 . . . . 2.0 104.012 179.588 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 53' ' ' CYS . . . . . . . . . . . . . 0.8 OUTLIER -100.22 132.56 45.51 Favored 'General case' 0 CA--C 1.576 1.966 0 N-CA-C 119.975 3.324 . . . . 2.0 119.975 -179.331 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 54' ' ' CYS . . . . . . . . . . . . . 51.4 t -117.14 124.76 49.97 Favored 'General case' 0 N--CA 1.495 1.82 0 C-N-CA 124.401 1.081 . . . . 2.0 110.305 179.909 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 2.6 t30 -67.54 49.03 0.05 OUTLIER 'General case' 0 N--CA 1.503 2.204 1 N-CA-C 124.22 4.896 . . . . 2.0 124.22 -179.368 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 56' ' ' THR . . . . . . . . . . . . 0.332 5.9 t -163.17 171.12 16.77 Favored 'General case' 0 N--CA 1.503 2.208 0 O-C-N 119.673 -1.892 . . . . 2.0 113.346 179.663 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 57' ' ' ASP . . . . . . . . . . . . . 20.0 m-20 -70.32 107.47 3.78 Favored 'General case' 0 CA--C 1.57 1.722 0 N-CA-C 115.661 1.726 . . . . 2.0 115.661 -179.8 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 58' ' ' ARG . . . . . . . . . . . . 0.278 74.7 mtm180 78.2 13.14 1.61 Allowed 'General case' 0 N--CA 1.502 2.162 0 N-CA-C 116.52 2.044 . . . . 2.0 116.52 179.833 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 59' ' ' CYS . . . . . . . . . . . . . 44.3 t -69.33 -10.79 59.51 Favored 'General case' 0 CA--C 1.577 2.019 0 N-CA-C 117.253 2.316 . . . . 2.0 117.253 179.742 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 60' ' ' ASN . . . . . . . . . . . . . 45.4 p30 . . . . . 0 CA--C 1.561 1.403 0 CA-C-O 125.537 2.589 . . . . 2.0 113.737 179.953 . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' A' A ' 1' ' ' LEU . . . . . . . . . . . . 0.313 0.3 OUTLIER . . . . . 0 CA--C 1.57 1.734 0 N-CA-C 113.798 1.036 . . . . 2.0 113.798 . . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 4.1 mmmm -69.09 130.24 42.17 Favored 'General case' 0 N--CA 1.494 1.748 0 O-C-N 120.736 -1.227 . . . . 2.0 110.626 179.833 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 70.7 m -135.1 -169.95 2.48 Favored 'General case' 0 CA--C 1.572 1.792 0 O-C-N 120.493 -1.379 . . . . 2.0 114.364 -179.855 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER -129.8 132.9 46.66 Favored 'General case' 0 N--CA 1.49 1.567 0 C-N-CA 124.98 1.312 . . . . 2.0 110.23 179.909 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 5' ' ' LYS . . . . . 0.447 ' H ' ' HB1' ' A' ' 10' ' ' ALA . 11.9 ptmt -83.84 172.57 12.02 Favored 'General case' 0 CA--C 1.591 2.534 0 CA-C-N 120.183 1.356 . . . . 2.0 107.671 179.088 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 52.1 mt -42.49 -43.69 3.78 Favored 'General case' 0 N--CA 1.514 2.726 0 N-CA-C 119.336 3.087 . . . . 2.0 119.336 -179.758 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 7' ' ' ILE . . . . . . . . . . . . . 43.8 mm -48.02 131.44 12.09 Favored Pre-proline 0 CA--C 1.583 2.213 0 CA-C-O 115.975 -1.964 . . . . 2.0 112.088 179.968 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . 0.323 13.9 Cg_exo -16.01 -68.75 0.01 OUTLIER 'Trans proline' 0 CA--C 1.563 1.965 0 C-N-CA 124.758 3.639 . . . . 2.0 121.547 -179.751 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 9' ' ' ILE . . . . . . . . . . . . 0.298 15.1 tt -88.18 -72.01 0.46 Allowed 'Isoleucine or valine' 0 CA--C 1.573 1.862 0 CA-C-O 118.824 -0.608 . . . . 2.0 109.517 179.72 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 10' ' ' ALA . . . . . 0.447 ' HB1' ' H ' ' A' ' 5' ' ' LYS . . . 52.77 152.02 0.0 OUTLIER 'General case' 0 CA--C 1.576 1.949 1 N-CA-C 121.972 4.064 . . . . 2.0 121.972 179.711 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 20.2 t -148.46 135.27 19.92 Favored 'General case' 0 N--CA 1.492 1.64 0 O-C-N 120.469 -1.394 . . . . 2.0 114.133 -179.97 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 78.1 tttt -135.75 135.16 39.74 Favored 'General case' 0 N--CA 1.493 1.709 0 C-N-CA 125.201 1.4 . . . . 2.0 107.759 179.782 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 13' ' ' THR . . . . . . . . . . . . . 14.3 t -117.12 104.4 11.19 Favored 'General case' 0 N--CA 1.504 2.235 0 CA-C-N 120.845 1.657 . . . . 2.0 111.108 179.962 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 14' ' ' CYS . . . . . . . . . . . . 0.294 0.0 OUTLIER -123.64 168.24 13.02 Favored Pre-proline 0 CA--C 1.588 2.435 0 O-C-N 121.077 -1.014 . . . . 2.0 113.376 179.925 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 15' ' ' PRO . . . . . . . . . . . . . 53.5 Cg_exo -62.78 166.99 12.65 Favored 'Trans proline' 0 N--CA 1.505 2.152 1 N-CA-C 124.989 4.957 . . . . 2.0 124.989 -179.631 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -69.45 173.69 5.65 Favored 'General case' 0 N--CA 1.498 1.958 0 C-N-CA 123.661 0.784 . . . . 2.0 109.14 179.382 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . 84.55 -52.58 4.72 Favored Glycine 0 N--CA 1.516 3.978 0 O-C-N 118.36 -2.712 . . . . 2.0 106.669 -178.963 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 39.4 mmtt -78.74 61.01 2.92 Favored 'General case' 0 CA--C 1.598 2.79 0 N-CA-C 105.224 -2.139 . . . . 2.0 105.224 179.08 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 7.4 p30 -60.96 -41.92 97.27 Favored 'General case' 0 N--CA 1.481 1.123 0 N-CA-C 119.627 3.195 . . . . 2.0 119.627 -179.582 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 97.4 mt -71.93 112.24 7.86 Favored 'General case' 0 CA--C 1.554 1.113 0 N-CA-C 115.44 1.644 . . . . 2.0 115.44 -179.87 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 1.4 m -82.62 97.85 8.71 Favored 'General case' 0 CA--C 1.577 1.994 0 N-CA-C 100.323 -3.954 . . . . 2.0 100.323 179.255 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 22' ' ' TYR . . . . . . . . . . . . 0.381 1.2 p90 -64.87 161.12 18.97 Favored 'General case' 0 CA--C 1.562 1.43 0 N-CA-C 120.65 3.574 . . . . 2.0 120.65 -179.347 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 7.3 tppt? -138.3 98.32 3.58 Favored 'General case' 0 CA--C 1.568 1.665 0 N-CA-C 102.546 -3.131 . . . . 2.0 102.546 179.86 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 24' ' ' MET . . . . . 0.439 ' SD ' ' HB2' ' A' ' 35' ' ' LYS . 10.0 ttt -72.59 85.86 1.18 Allowed 'General case' 0 CA--C 1.565 1.525 0 O-C-N 120.498 -1.377 . . . . 2.0 112.17 -179.892 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 25' ' ' PHE . . . . . . . . . . . . . 2.4 m-30 -76.91 117.68 18.75 Favored 'General case' 0 CA--C 1.569 1.69 0 N-CA-C 106.675 -1.602 . . . . 2.0 106.675 179.632 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 26' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -56.52 129.05 39.17 Favored 'General case' 0 N--CA 1.497 1.912 0 O-C-N 121.047 -1.033 . . . . 2.0 113.668 -179.781 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 27' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -42.83 -44.01 4.28 Favored 'General case' 0 N--CA 1.506 2.331 0 N-CA-C 117.326 2.343 . . . . 2.0 117.326 -179.787 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 53.1 m -76.13 -42.29 47.35 Favored 'General case' 0 CA--C 1.581 2.161 0 N-CA-C 113.287 0.847 . . . . 2.0 113.287 179.566 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 64.4 t0 -133.34 96.28 3.69 Favored 'General case' 0 CA--C 1.568 1.663 0 N-CA-C 105.705 -1.961 . . . . 2.0 105.705 179.712 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 2.8 mm? -64.95 -63.41 1.12 Allowed 'General case' 0 CA--C 1.568 1.669 0 N-CA-C 118.602 2.815 . . . . 2.0 118.602 -179.601 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 31' ' ' THR . . . . . . . . . . . . . 81.3 p -33.41 -46.68 0.19 Allowed 'General case' 0 N--CA 1.508 2.44 0 N-CA-C 120.426 3.491 . . . . 2.0 120.426 -179.673 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 32' ' ' ILE . . . . . . . . . . . . . 2.2 mp -87.39 111.35 40.8 Favored Pre-proline 0 CA--C 1.589 2.444 0 N-CA-C 103.756 -2.683 . . . . 2.0 103.756 179.649 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 33' ' ' PRO . . . . . . . . . . . . . 6.1 Cg_exo -71.42 144.68 46.06 Favored 'Trans proline' 0 CA--C 1.565 2.06 0 N-CA-C 118.214 2.351 . . . . 2.0 118.214 -179.764 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 34' ' ' VAL . . . . . . . . . . . . 0.314 14.3 m -98.0 -14.65 7.69 Favored 'Isoleucine or valine' 0 N--CA 1.508 2.459 0 N-CA-C 113.762 1.023 . . . . 2.0 113.762 179.456 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 35' ' ' LYS . . . . . 0.439 ' HB2' ' SD ' ' A' ' 24' ' ' MET 0.276 3.1 tmtt? -161.93 155.45 21.14 Favored 'General case' 0 CA--C 1.568 1.658 0 C-N-CA 126.332 1.853 . . . . 2.0 108.623 179.472 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 36' ' ' ARG . . . . . . . . . . . . 0.305 13.1 ttp180 -140.64 105.52 4.95 Favored 'General case' 0 CA--C 1.581 2.154 0 N-CA-C 103.024 -2.954 . . . . 2.0 103.024 -180.0 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . -134.14 -139.96 4.22 Favored Glycine 0 N--CA 1.502 3.066 0 N-CA-C 121.622 3.409 . . . . 2.0 121.622 -179.502 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 38' ' ' CYS . . . . . . . . . . . . . 0.8 OUTLIER -135.24 142.4 45.96 Favored 'General case' 0 N--CA 1.498 1.967 0 N-CA-C 113.645 0.98 . . . . 2.0 113.645 -179.971 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 39' ' ' ILE . . . . . 0.502 HG21 ' HD3' ' A' ' 43' ' ' PRO . 8.2 tp -166.57 171.36 0.21 Allowed 'Isoleucine or valine' 0 N--CA 1.507 2.4 0 O-C-N 120.777 -1.202 . . . . 2.0 114.085 -179.623 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 40' ' ' ASP . . . . . . . . . . . . . 20.6 m-20 -87.46 -52.67 5.23 Favored 'General case' 0 CA--C 1.577 1.992 0 O-C-N 120.131 -1.606 . . . . 2.0 112.163 179.364 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 95.7 t -132.8 39.58 0.7 Allowed 'Isoleucine or valine' 0 N--CA 1.51 2.537 0 N-CA-C 114.131 1.16 . . . . 2.0 114.131 -179.624 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 42' ' ' CYS . . . . . . . . . . . . 0.257 2.5 m 73.28 114.89 0.03 OUTLIER Pre-proline 0 N--CA 1.515 2.818 0 N-CA-C 103.278 -2.86 . . . . 2.0 103.278 -179.579 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 43' ' ' PRO . . . . . 0.502 ' HD3' HG21 ' A' ' 39' ' ' ILE . 12.7 Cg_exo -58.7 170.58 2.5 Favored 'Trans proline' 0 C--N 1.373 1.844 0 CA-C-N 127.039 3.549 . . . . 2.0 118.796 -179.318 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 56.4 mtmt -64.45 99.11 0.28 Allowed 'General case' 0 CA--C 1.574 1.887 0 CA-C-O 123.558 1.647 . . . . 2.0 108.023 179.719 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 45' ' ' ASN . . . . . . . . . . . . 0.276 4.0 p-10 -71.89 -157.87 0.04 OUTLIER 'General case' 0 CA--C 1.569 1.702 0 N-CA-C 118.215 2.672 . . . . 2.0 118.215 -179.555 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 46' ' ' SER . . . . . . . . . . . . 0.315 6.3 t 78.11 -43.46 0.38 Allowed 'General case' 0 N--CA 1.489 1.48 0 N-CA-C 117.519 2.414 . . . . 2.0 117.519 179.945 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 47' ' ' LEU . . . . . . . . . . . . . 2.6 pp -47.6 -49.83 25.84 Favored 'General case' 0 N--CA 1.507 2.417 0 CA-C-N 120.348 1.431 . . . . 2.0 113.264 179.643 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 90.3 mt -156.34 25.68 0.35 Allowed 'General case' 0 CA--C 1.586 2.335 0 C-N-CA 126.947 2.099 . . . . 2.0 109.031 179.434 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 49' ' ' VAL . . . . . . . . . . . . . 3.7 p -168.07 171.24 0.18 Allowed 'Isoleucine or valine' 0 CA--C 1.587 2.38 0 N-CA-C 119.425 3.12 . . . . 2.0 119.425 -178.902 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 23.1 ttpt -151.62 75.1 1.15 Allowed 'General case' 0 CA--C 1.583 2.245 0 N-CA-C 101.501 -3.518 . . . . 2.0 101.501 178.954 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 99.0 m-85 -51.37 131.85 28.9 Favored 'General case' 0 CA--C 1.565 1.531 1 N-CA-C 123.17 4.507 . . . . 2.0 123.17 -179.241 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 52' ' ' VAL . . . . . . . . . . . . . 7.0 t -100.46 139.92 20.72 Favored 'Isoleucine or valine' 0 CA--C 1.577 2.018 1 N-CA-C 99.297 -4.334 . . . . 2.0 99.297 179.023 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 53' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -145.45 143.68 30.17 Favored 'General case' 0 CA--C 1.568 1.643 0 O-C-N 118.509 -2.619 . . . . 2.0 115.683 -179.148 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 54' ' ' CYS . . . . . . . . . . . . . 25.7 p -126.78 120.46 29.39 Favored 'General case' 0 CA--C 1.572 1.821 0 C-N-CA 123.448 0.699 . . . . 2.0 110.314 179.905 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 9.0 m120 -51.27 6.81 0.0 OUTLIER 'General case' 0 N--CA 1.506 2.367 1 N-CA-C 125.471 5.36 . . . . 2.0 125.471 -179.506 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 56' ' ' THR . . . . . . . . . . . . 0.252 5.5 t -137.6 175.98 9.12 Favored 'General case' 0 N--CA 1.504 2.233 0 CA-C-N 123.31 2.777 . . . . 2.0 117.315 -179.758 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 57' ' ' ASP . . . . . . . . . . . . . 38.1 m-20 -61.4 116.2 4.47 Favored 'General case' 0 N--CA 1.487 1.415 0 N-CA-C 115.366 1.617 . . . . 2.0 115.366 -179.931 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 58' ' ' ARG . . . . . . . . . . . . 0.315 38.2 mtp180 62.37 21.26 12.43 Favored 'General case' 0 CA--C 1.578 2.046 0 N-CA-C 117.999 2.592 . . . . 2.0 117.999 -179.969 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 59' ' ' CYS . . . . . . . . . . . . . 29.1 p -72.96 -24.7 60.82 Favored 'General case' 0 CA--C 1.573 1.862 0 N-CA-C 116.816 2.154 . . . . 2.0 116.816 179.829 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 60' ' ' ASN . . . . . . . . . . . . . 41.2 p-10 . . . . . 0 CA--C 1.56 1.334 0 CA-C-O 124.161 1.934 . . . . 2.0 112.229 179.849 . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' A' A ' 1' ' ' LEU . . . . . 0.438 HD23 ' SG ' ' A' ' 3' ' ' CYS . 6.0 tp . . . . . 0 CA--C 1.57 1.721 0 N-CA-C 113.497 0.925 . . . . 2.0 113.497 . . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -85.66 137.36 32.89 Favored 'General case' 0 CA--C 1.571 1.779 0 N-CA-C 107.886 -1.153 . . . . 2.0 107.886 179.711 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 3' ' ' CYS . . . . . 0.438 ' SG ' HD23 ' A' ' 1' ' ' LEU . 88.2 m -139.59 167.38 22.23 Favored 'General case' 0 N--CA 1.494 1.772 0 O-C-N 119.653 -1.904 . . . . 2.0 114.216 -179.89 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 69.4 m-80 -111.36 138.28 48.04 Favored 'General case' 0 CA--C 1.563 1.48 0 N-CA-C 116.969 2.211 . . . . 2.0 116.969 -179.858 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 5' ' ' LYS . . . . . 0.402 ' H ' ' HB1' ' A' ' 10' ' ' ALA 0.26 14.8 ptpt -87.56 172.17 9.95 Favored 'General case' 0 CA--C 1.587 2.396 0 CA-C-N 120.223 1.374 . . . . 2.0 107.481 178.912 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 1.5 mm? -39.98 -49.34 2.48 Favored 'General case' 0 N--CA 1.506 2.369 0 N-CA-C 120.897 3.665 . . . . 2.0 120.897 -179.835 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 7' ' ' ILE . . . . . . . . . . . . . 21.5 mt -73.7 147.11 86.5 Favored Pre-proline 0 CA--C 1.585 2.325 0 N-CA-C 114.2 1.185 . . . . 2.0 114.2 -179.79 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 70.6 Cg_exo -44.79 -45.54 13.53 Favored 'Trans proline' 0 CA--C 1.567 2.164 0 N-CA-C 119.864 2.986 . . . . 2.0 119.864 179.827 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 9' ' ' ILE . . . . . . . . . . . . 0.297 0.2 OUTLIER -59.37 -46.96 92.15 Favored 'Isoleucine or valine' 0 N--CA 1.514 2.726 0 CA-C-N 120.571 1.532 . . . . 2.0 112.356 179.611 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 10' ' ' ALA . . . . . 0.402 ' HB1' ' H ' ' A' ' 5' ' ' LYS . . . 55.97 159.2 0.01 OUTLIER 'General case' 0 CA--C 1.578 2.032 1 N-CA-C 123.918 4.784 . . . . 2.0 123.918 179.345 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 8.2 t -66.3 -174.31 0.26 Allowed 'General case' 0 CA--C 1.58 2.103 0 N-CA-C 117.763 2.505 . . . . 2.0 117.763 -179.902 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . 0.309 50.4 tptt -98.23 -90.56 0.28 Allowed 'General case' 0 CA--C 1.572 1.801 1 N-CA-C 123.304 4.557 . . . . 2.0 123.304 -179.485 . . . . . . . . 3 2 . 1 . 005 nuclear nobuild full ' A' A ' 13' ' ' THR . . . . . . . . . . . . . 8.4 t -156.92 170.81 21.64 Favored 'General case' 0 N--CA 1.506 2.351 0 N-CA-C 120.108 3.373 . . . . 2.0 120.108 -179.143 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 14' ' ' CYS . . . . . . . . . . . . 0.419 0.5 OUTLIER -146.4 168.44 11.59 Favored Pre-proline 0 CA--C 1.6 2.902 0 C-N-CA 126.104 1.761 . . . . 2.0 108.713 179.215 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 15' ' ' PRO . . . . . . . . . . . . . 92.2 Cg_exo -45.07 171.37 0.02 OUTLIER 'Trans proline' 0 CA--C 1.571 2.347 1 N-CA-C 128.673 6.374 . . . . 2.0 128.673 -179.488 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -78.72 165.36 23.69 Favored 'General case' 0 N--CA 1.499 1.986 0 N-CA-C 104.506 -2.405 . . . . 2.0 104.506 178.944 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . 85.34 -47.94 3.93 Favored Glycine 1 N--CA 1.524 4.512 0 O-C-N 117.082 -3.511 . . . . 2.0 105.37 -178.642 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 39.9 mmtm -83.3 63.78 7.42 Favored 'General case' 0 CA--C 1.604 3.031 1 N-CA-C 99.939 -4.097 . . . . 2.0 99.939 178.493 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 37.3 p-10 -80.85 -20.49 42.23 Favored 'General case' 0 N--CA 1.483 1.18 0 N-CA-C 121.527 3.899 . . . . 2.0 121.527 -179.261 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 70.7 mt -88.59 112.95 23.64 Favored 'General case' 0 CA--C 1.555 1.136 0 CA-C-N 119.284 0.947 . . . . 2.0 110.586 179.771 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 21' ' ' CYS . . . . . 0.425 ' SG ' HD21 ' A' ' 1' ' ' LEU . 1.7 m -79.91 95.4 6.08 Favored 'General case' 0 CA--C 1.576 1.947 0 N-CA-C 100.389 -3.93 . . . . 2.0 100.389 179.257 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 22' ' ' TYR . . . . . . . . . . . . 0.266 0.0 OUTLIER -76.14 154.72 35.24 Favored 'General case' 0 CA--C 1.552 1.054 0 N-CA-C 121.008 3.707 . . . . 2.0 121.008 -179.35 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 31.8 mtmt -117.73 92.2 3.77 Favored 'General case' 0 CA--C 1.559 1.317 1 N-CA-C 99.626 -4.212 . . . . 2.0 99.626 179.311 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 24' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -71.13 72.97 0.63 Allowed 'General case' 0 CA--C 1.578 2.027 0 C-N-CA 124.374 1.07 . . . . 2.0 108.719 179.912 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 25' ' ' PHE . . . . . . . . . . . . . 9.6 m-30 -62.1 133.23 54.99 Favored 'General case' 0 N--CA 1.486 1.367 0 O-C-N 120.709 -1.245 . . . . 2.0 113.152 -179.856 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 26' ' ' MET . . . . . . . . . . . . . 34.4 mtp -64.48 131.2 46.44 Favored 'General case' 0 N--CA 1.489 1.503 0 N-CA-C 113.131 0.789 . . . . 2.0 113.131 -179.995 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 27' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -54.22 -38.83 66.15 Favored 'General case' 0 N--CA 1.514 2.731 0 CA-C-N 120.779 1.627 . . . . 2.0 112.164 179.461 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 50.4 m -79.73 -32.52 41.15 Favored 'General case' 0 CA--C 1.586 2.337 0 N-CA-C 114.062 1.134 . . . . 2.0 114.062 179.418 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 52.7 t0 -146.86 84.31 1.6 Allowed 'General case' 0 CA--C 1.573 1.85 0 O-C-N 120.599 -1.313 . . . . 2.0 109.723 179.871 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 1.6 mm? -51.18 -67.52 0.24 Allowed 'General case' 0 CA--C 1.576 1.972 0 N-CA-C 120.763 3.616 . . . . 2.0 120.763 -179.496 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 31' ' ' THR . . . . . . . . . . . . 0.337 15.3 t -19.22 -61.97 0.02 OUTLIER 'General case' 0 N--CA 1.51 2.538 1 N-CA-C 121.825 4.009 . . . . 2.0 121.825 -179.793 . . . . . . . . 3 2 . 1 . 005 nuclear nobuild full ' A' A ' 32' ' ' ILE . . . . . . . . . . . . . 1.8 mp -100.71 103.68 26.02 Favored Pre-proline 0 CA--C 1.589 2.468 1 N-CA-C 99.661 -4.2 . . . . 2.0 99.661 179.577 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 33' ' ' PRO . . . . . . . . . . . . . 14.5 Cg_endo -62.8 171.1 6.28 Favored 'Trans proline' 0 CA--C 1.561 1.862 1 N-CA-C 123.372 4.335 . . . . 2.0 123.372 -179.512 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 34' ' ' VAL . . . . . . . . . . . . . 97.8 t -73.66 -55.57 12.05 Favored 'Isoleucine or valine' 0 CA--C 1.59 2.49 0 N-CA-C 104.467 -2.42 . . . . 2.0 104.467 178.963 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 36.7 tttm -136.35 162.17 33.75 Favored 'General case' 0 CA--C 1.564 1.496 0 CA-C-O 124.449 2.071 . . . . 2.0 108.963 179.601 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 36' ' ' ARG . . . . . . . . . . . . 0.346 40.2 ttp180 -138.26 108.61 6.49 Favored 'General case' 0 CA--C 1.574 1.866 1 N-CA-C 98.495 -4.631 . . . . 2.0 98.495 179.533 . . . . . . . . 3 2 . 1 . 005 nuclear nobuild full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . -145.04 -147.77 4.7 Favored Glycine 0 N--CA 1.489 2.21 0 O-C-N 119.053 -2.279 . . . . 2.0 118.387 -179.56 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 38' ' ' CYS . . . . . . . . . . . . . 19.1 p -115.47 137.51 51.98 Favored 'General case' 0 CA--C 1.562 1.421 0 C-N-CA 123.723 0.809 . . . . 2.0 111.587 179.959 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 39' ' ' ILE . . . . . . . . . . . . . 3.4 tp -160.23 166.12 0.73 Allowed 'Isoleucine or valine' 0 N--CA 1.495 1.809 0 O-C-N 120.879 -1.138 . . . . 2.0 113.838 -179.906 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 40' ' ' ASP . . . . . . . . . . . . . 9.6 p30 -80.87 -102.05 0.03 OUTLIER 'General case' 0 N--CA 1.507 2.406 0 N-CA-C 103.736 -2.69 . . . . 2.0 103.736 179.435 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 87.7 t -85.98 162.12 2.87 Favored 'Isoleucine or valine' 0 CA--C 1.58 2.126 0 N-CA-C 104.595 -2.372 . . . . 2.0 104.595 178.982 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 42' ' ' CYS . . . . . . . . . . . . . 1.7 m -63.78 107.24 1.19 Allowed Pre-proline 0 CA--C 1.605 3.068 1 N-CA-C 100.007 -4.071 . . . . 2.0 100.007 179.554 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 43' ' ' PRO . . . . . . . . . . . . . 26.4 Cg_exo -50.37 -178.02 0.01 OUTLIER 'Trans proline' 0 C--N 1.372 1.791 1 N-CA-C 125.088 4.996 . . . . 2.0 125.088 -178.709 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 96.7 mttt -73.08 103.15 3.74 Favored 'General case' 0 CA--C 1.568 1.639 0 N-CA-C 104.187 -2.523 . . . . 2.0 104.187 179.386 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 45' ' ' ASN . . . . . . . . . . . . 0.25 2.0 p-10 -67.6 117.45 9.56 Favored 'General case' 0 CA--C 1.563 1.466 0 N-CA-C 117.174 2.287 . . . . 2.0 117.174 -179.358 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 14.9 t -82.73 179.27 7.83 Favored 'General case' 0 CA--C 1.565 1.54 0 N-CA-C 113.776 1.028 . . . . 2.0 113.776 179.962 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 47' ' ' LEU . . . . . . . . . . . . . 88.8 mt -51.55 -25.01 5.97 Favored 'General case' 0 N--CA 1.507 2.391 0 N-CA-C 116.424 2.009 . . . . 2.0 116.424 179.768 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 78.7 mt -102.51 7.33 40.2 Favored 'General case' 0 CA--C 1.579 2.093 0 C-N-CA 125.131 1.372 . . . . 2.0 114.636 179.591 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 49' ' ' VAL . . . . . . . . . . . . . 9.0 p -153.93 159.24 3.37 Favored 'Isoleucine or valine' 0 N--CA 1.502 2.13 0 N-CA-C 117.505 2.409 . . . . 2.0 117.505 -179.644 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER -153.78 78.47 1.13 Allowed 'General case' 0 CA--C 1.576 1.967 0 N-CA-C 102.752 -3.055 . . . . 2.0 102.752 179.343 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER -58.69 128.81 39.05 Favored 'General case' 0 CA--C 1.569 1.697 1 N-CA-C 122.7 4.333 . . . . 2.0 122.7 -179.341 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 52' ' ' VAL . . . . . . . . . . . . 0.284 14.1 t -103.13 151.88 6.11 Favored 'Isoleucine or valine' 0 CA--C 1.578 2.047 0 N-CA-C 102.107 -3.294 . . . . 2.0 102.107 179.047 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 53' ' ' CYS . . . . . . . . . . . . 0.261 0.8 OUTLIER -147.5 160.82 42.17 Favored 'General case' 0 CA--C 1.568 1.65 0 N-CA-C 119.178 3.029 . . . . 2.0 119.178 -179.026 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 54' ' ' CYS . . . . . . . . . . . . . 29.0 p -143.34 120.69 11.61 Favored 'General case' 0 CA--C 1.574 1.895 0 C-N-CA 123.928 0.891 . . . . 2.0 110.342 179.78 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 14.8 m120 -55.45 12.01 0.0 OUTLIER 'General case' 0 N--CA 1.508 2.467 1 N-CA-C 124.518 5.007 . . . . 2.0 124.518 -179.674 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 56' ' ' THR . . . . . . . . . . . . 0.274 4.9 t -138.26 177.82 7.59 Favored 'General case' 0 N--CA 1.502 2.134 0 CA-C-N 123.077 2.671 . . . . 2.0 116.794 -179.839 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 57' ' ' ASP . . . . . . . . . . . . . 69.9 m-20 -65.11 120.76 13.27 Favored 'General case' 0 CA--C 1.565 1.541 0 N-CA-C 115.779 1.77 . . . . 2.0 115.779 -179.755 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 58' ' ' ARG . . . . . . . . . . . . . 10.7 mmm180 56.45 31.19 18.39 Favored 'General case' 0 CA--C 1.586 2.348 0 N-CA-C 115.193 1.553 . . . . 2.0 115.193 -179.919 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 59' ' ' CYS . . . . . . . . . . . . . 29.7 p -83.77 -21.13 32.3 Favored 'General case' 0 N--CA 1.495 1.813 0 N-CA-C 116.432 2.012 . . . . 2.0 116.432 179.848 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 60' ' ' ASN . . . . . . . . . . . . . 25.3 p-10 . . . . . 0 CA--C 1.56 1.34 0 CA-C-O 124.967 2.318 . . . . 2.0 113.079 179.886 . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' A' A ' 1' ' ' LEU . . . . . 0.603 HD13 ' SG ' ' A' ' 3' ' ' CYS . 0.7 OUTLIER . . . . . 0 CA--C 1.576 1.944 0 CA-C-O 123.257 1.503 . . . . 2.0 113.785 . . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 1.6 mptp? -151.87 108.41 3.47 Favored 'General case' 0 CA--C 1.565 1.523 0 N-CA-C 101.15 -3.648 . . . . 2.0 101.15 179.631 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 3' ' ' CYS . . . . . 0.603 ' SG ' HD13 ' A' ' 1' ' ' LEU . 90.7 m -114.01 -168.38 1.35 Allowed 'General case' 0 N--CA 1.499 1.979 0 CA-C-N 122.131 2.241 . . . . 2.0 115.941 -179.926 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 80.4 m-20 -139.4 113.35 8.68 Favored 'General case' 0 CA--C 1.56 1.329 0 C-N-CA 123.843 0.857 . . . . 2.0 110.547 179.911 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 5' ' ' LYS . . . . . 0.429 ' H ' ' HB1' ' A' ' 10' ' ' ALA . 0.3 OUTLIER -66.74 -179.03 0.8 Allowed 'General case' 0 CA--C 1.583 2.243 0 CA-C-N 121.202 1.819 . . . . 2.0 111.44 179.416 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -45.03 -41.87 7.9 Favored 'General case' 0 N--CA 1.509 2.493 0 N-CA-C 120.86 3.652 . . . . 2.0 120.86 -179.704 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 7' ' ' ILE . . . . . . . . . . . . . 38.5 mt -57.03 144.13 69.74 Favored Pre-proline 0 CA--C 1.586 2.348 0 C-N-CA 124.602 1.161 . . . . 2.0 113.53 179.861 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 90.1 Cg_exo -46.48 -42.6 22.99 Favored 'Trans proline' 0 CA--C 1.572 2.382 0 N-CA-C 118.901 2.616 . . . . 2.0 118.901 179.828 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 9' ' ' ILE . . . . . . . . . . . . 0.264 9.5 pt -88.37 -67.49 0.73 Allowed 'Isoleucine or valine' 0 N--CA 1.499 2.018 0 C-N-CA 123.799 0.84 . . . . 2.0 112.125 179.669 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 10' ' ' ALA . . . . . 0.429 ' HB1' ' H ' ' A' ' 5' ' ' LYS 0.259 . . 63.61 166.45 0.14 Allowed 'General case' 0 CA--C 1.581 2.166 0 N-CA-C 120.149 3.388 . . . . 2.0 120.149 179.818 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 15.8 t -87.01 149.86 24.46 Favored 'General case' 0 N--CA 1.495 1.819 0 O-C-N 121.099 -1.0 . . . . 2.0 113.437 179.984 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 12' ' ' LYS . . . . . 0.416 ' HG3' ' H ' ' A' ' 13' ' ' THR 0.388 9.0 ptpp? -84.21 -98.03 0.06 Allowed 'General case' 0 CA--C 1.584 2.287 1 N-CA-C 123.523 4.638 . . . . 2.0 123.523 -179.431 . . . . . . . . 4 3 . 1 . 006 nuclear nobuild full ' A' A ' 13' ' ' THR . . . . . 0.416 ' H ' ' HG3' ' A' ' 12' ' ' LYS . 35.7 m -22.58 129.56 0.02 OUTLIER 'General case' 0 N--CA 1.505 2.285 1 N-CA-C 123.494 4.627 . . . . 2.0 123.494 -179.558 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 52.9 t -156.34 146.05 15.47 Favored Pre-proline 0 CA--C 1.594 2.665 0 C-N-CA 125.525 1.53 . . . . 2.0 110.095 179.72 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 15' ' ' PRO . . . . . . . . . . . . . 44.2 Cg_exo -47.76 169.91 0.06 OUTLIER 'Trans proline' 0 CA--C 1.576 2.606 1 N-CA-C 126.042 5.362 . . . . 2.0 126.042 -179.836 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -78.02 165.77 23.64 Favored 'General case' 0 N--CA 1.496 1.865 0 C-N-CA 124.8 1.24 . . . . 2.0 110.236 179.532 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . 82.86 -48.37 4.0 Favored Glycine 1 N--CA 1.517 4.039 0 O-C-N 119.049 -2.282 . . . . 2.0 109.256 -179.106 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 35.7 mmtm -77.34 91.99 3.88 Favored 'General case' 0 CA--C 1.573 1.858 0 N-CA-C 101.953 -3.351 . . . . 2.0 101.953 179.262 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 9.9 p30 -98.38 -27.23 14.19 Favored 'General case' 0 N--CA 1.491 1.612 0 N-CA-C 117.369 2.359 . . . . 2.0 117.369 -179.85 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 76.6 mt -83.7 114.12 21.35 Favored 'General case' 0 CA--C 1.557 1.233 0 N-CA-C 116.148 1.907 . . . . 2.0 116.148 -179.849 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 21' ' ' CYS . . . . . 0.441 ' SG ' HD22 ' A' ' 1' ' ' LEU . 5.2 m -84.45 91.44 7.83 Favored 'General case' 0 CA--C 1.578 2.031 1 N-CA-C 99.989 -4.078 . . . . 2.0 99.989 179.152 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 22' ' ' TYR . . . . . . . . . . . . . 8.1 p90 -75.47 158.89 31.98 Favored 'General case' 0 CA--C 1.552 1.036 0 N-CA-C 120.461 3.504 . . . . 2.0 120.461 -179.311 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 19.0 ptpt -133.21 101.55 5.24 Favored 'General case' 0 CA--C 1.562 1.406 0 N-CA-C 104.952 -2.24 . . . . 2.0 104.952 179.491 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 24' ' ' MET . . . . . . . . . . . . . 0.1 OUTLIER -68.81 86.92 0.34 Allowed 'General case' 0 N--CA 1.485 1.285 0 C-N-CA 125.438 1.495 . . . . 2.0 112.542 179.949 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 25' ' ' PHE . . . . . . . . . . . . . 8.2 m-30 -78.28 108.33 11.54 Favored 'General case' 0 CA--C 1.563 1.444 0 N-CA-C 104.601 -2.37 . . . . 2.0 104.601 179.568 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 26' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -58.27 128.5 37.43 Favored 'General case' 0 CA--C 1.57 1.712 0 CA-C-O 117.869 -1.062 . . . . 2.0 110.806 179.999 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 27' ' ' MET . . . . . . . . . . . . . 31.0 mtp -41.59 -36.73 0.98 Allowed 'General case' 0 N--CA 1.51 2.54 0 N-CA-C 117.949 2.574 . . . . 2.0 117.949 -179.891 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 67.3 m -89.23 -32.57 17.36 Favored 'General case' 0 CA--C 1.588 2.424 0 C-N-CA 124.189 0.996 . . . . 2.0 112.151 179.293 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 15.9 m-20 -130.44 87.61 2.53 Favored 'General case' 0 CA--C 1.576 1.945 0 O-C-N 119.424 -2.047 . . . . 2.0 105.592 179.748 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 1.5 mm? -74.26 -75.22 0.16 Allowed 'General case' 0 CA--C 1.578 2.022 0 N-CA-C 119.652 3.205 . . . . 2.0 119.652 -179.528 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 31' ' ' THR . . . . . . . . . . . . 0.257 80.7 p -17.92 -68.27 0.02 OUTLIER 'General case' 0 N--CA 1.508 2.47 0 N-CA-C 121.065 3.728 . . . . 2.0 121.065 -179.588 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 32' ' ' ILE . . . . . . . . . . . . . 1.9 mp -90.79 108.02 24.68 Favored Pre-proline 0 CA--C 1.585 2.315 1 N-CA-C 99.714 -4.18 . . . . 2.0 99.714 179.503 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 33' ' ' PRO . . . . . . . . . . . . . 43.1 Cg_endo -61.7 162.85 20.19 Favored 'Trans proline' 0 CA--C 1.56 1.787 0 N-CA-C 119.012 2.659 . . . . 2.0 119.012 -179.659 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 34' ' ' VAL . . . . . . . . . . . . . 14.2 t -88.19 -47.74 15.35 Favored 'Isoleucine or valine' 0 N--CA 1.503 2.2 0 N-CA-C 107.011 -1.477 . . . . 2.0 107.011 179.148 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 4.6 tptp -124.78 155.27 39.63 Favored 'General case' 0 CA--C 1.564 1.505 0 CA-C-O 124.159 1.933 . . . . 2.0 108.559 179.605 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 2.9 mtp180 -141.74 110.85 6.29 Favored 'General case' 0 CA--C 1.566 1.576 0 N-CA-C 100.495 -3.891 . . . . 2.0 100.495 179.782 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . -141.94 -152.74 5.77 Favored Glycine 0 N--CA 1.487 2.035 0 N-CA-C 118.8 2.28 . . . . 2.0 118.8 -179.7 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 38' ' ' CYS . . . . . 0.42 ' HB3' ' SG ' ' A' ' 3' ' ' CYS . 25.7 p -127.66 126.69 42.43 Favored 'General case' 0 CA--C 1.562 1.441 0 C-N-CA 123.581 0.752 . . . . 2.0 112.401 179.902 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 39' ' ' ILE . . . . . 0.424 HG21 ' HD3' ' A' ' 43' ' ' PRO . 8.2 tp -147.81 179.22 0.8 Allowed 'Isoleucine or valine' 0 N--CA 1.497 1.878 0 C-N-CA 124.007 0.923 . . . . 2.0 112.858 -179.702 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 40' ' ' ASP . . . . . 0.412 ' H ' HG13 ' A' ' 39' ' ' ILE . 18.0 p-10 -102.91 -43.86 5.41 Favored 'General case' 0 CA--C 1.569 1.702 0 O-C-N 120.267 -1.521 . . . . 2.0 113.539 179.707 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 4.3 t -137.2 35.94 0.56 Allowed 'Isoleucine or valine' 0 N--CA 1.509 2.496 0 CA-C-N 120.086 1.312 . . . . 2.0 112.459 179.975 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 42' ' ' CYS . . . . . . . . . . . . 0.349 2.7 m 75.31 122.03 0.03 OUTLIER Pre-proline 0 CA--C 1.614 3.415 1 N-CA-C 99.919 -4.104 . . . . 2.0 99.919 -179.26 . . . . . . . . 3 2 . 1 . 006 nuclear nobuild full ' A' A ' 43' ' ' PRO . . . . . 0.424 ' HD3' HG21 ' A' ' 39' ' ' ILE . 27.4 Cg_exo -55.01 -4.08 0.34 Allowed 'Trans proline' 0 N--CA 1.503 2.077 1 N-CA-C 129.512 6.697 . . . . 2.0 129.512 -178.851 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . 0.331 69.3 mttt 110.1 104.66 0.0 OUTLIER 'General case' 0 N--CA 1.494 1.738 0 N-CA-C 100.685 -3.82 . . . . 2.0 100.685 -179.446 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 45' ' ' ASN . . . . . . . . . . . . . 4.0 p-10 -72.77 101.34 3.08 Favored 'General case' 0 CA--C 1.566 1.592 0 N-CA-C 116.449 2.018 . . . . 2.0 116.449 -179.393 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 14.1 t -81.64 178.43 8.34 Favored 'General case' 0 CA--C 1.567 1.625 0 N-CA-C 113.245 0.832 . . . . 2.0 113.245 179.888 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 47' ' ' LEU . . . . . . . . . . . . 0.392 3.4 pp -57.3 -12.78 2.64 Favored 'General case' 0 N--CA 1.508 2.466 0 N-CA-C 117.072 2.249 . . . . 2.0 117.072 179.729 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 77.3 mt -106.61 4.22 27.75 Favored 'General case' 0 CA--C 1.584 2.253 0 C-N-CA 125.549 1.54 . . . . 2.0 111.867 179.209 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 49' ' ' VAL . . . . . . . . . . . . . 14.4 p -157.44 149.33 9.78 Favored 'Isoleucine or valine' 0 N--CA 1.501 2.11 0 CA-C-N 123.378 2.808 . . . . 2.0 116.988 -179.604 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 17.3 ttpt -141.51 73.18 1.41 Allowed 'General case' 0 CA--C 1.58 2.112 0 N-CA-C 104.173 -2.529 . . . . 2.0 104.173 179.539 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER -59.85 130.15 45.35 Favored 'General case' 0 N--CA 1.494 1.755 0 N-CA-C 120.819 3.637 . . . . 2.0 120.819 -179.367 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 52' ' ' VAL . . . . . . . . . . . . . 18.7 t -99.69 121.17 50.04 Favored 'Isoleucine or valine' 0 CA--C 1.574 1.891 1 N-CA-C 100.091 -4.04 . . . . 2.0 100.091 179.244 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 53' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -121.42 135.57 55.05 Favored 'General case' 0 CA--C 1.574 1.896 0 N-CA-C 117.715 2.487 . . . . 2.0 117.715 -179.198 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 54' ' ' CYS . . . . . . . . . . . . . 31.2 p -118.17 120.14 36.81 Favored 'General case' 0 N--CA 1.495 1.788 0 C-N-CA 124.112 0.965 . . . . 2.0 111.96 179.835 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 25.0 p-10 -63.06 40.5 0.01 OUTLIER 'General case' 0 N--CA 1.506 2.36 1 N-CA-C 123.028 4.455 . . . . 2.0 123.028 -179.509 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 5.9 t -155.16 172.57 17.92 Favored 'General case' 0 N--CA 1.497 1.911 0 O-C-N 119.656 -1.902 . . . . 2.0 113.999 179.946 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 57' ' ' ASP . . . . . . . . . . . . . 85.5 m-20 -67.46 122.44 17.97 Favored 'General case' 0 CA--C 1.568 1.648 0 N-CA-C 116.538 2.051 . . . . 2.0 116.538 -179.851 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 58' ' ' ARG . . . . . . . . . . . . 0.254 37.5 mtm105 56.35 28.81 14.03 Favored 'General case' 0 CA--C 1.574 1.901 0 N-CA-C 117.935 2.568 . . . . 2.0 117.935 179.802 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 59' ' ' CYS . . . . . . . . . . . . . 30.2 p -86.14 14.63 6.07 Favored 'General case' 0 CA--C 1.579 2.074 0 N-CA-C 117.191 2.293 . . . . 2.0 117.191 179.893 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 60' ' ' ASN . . . . . . . . . . . . . 35.7 p-10 . . . . . 0 CA--C 1.561 1.369 0 CA-C-O 124.012 1.863 . . . . 2.0 112.541 -179.948 . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' A' A ' 1' ' ' LEU . . . . . 0.514 HD21 ' SG ' ' A' ' 3' ' ' CYS . 6.7 tt . . . . . 0 N--CA 1.502 2.175 0 CA-C-O 116.779 -1.581 . . . . 2.0 110.926 . . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 26.3 tttp -111.62 -47.31 3.17 Favored 'General case' 0 N--CA 1.521 3.08 0 CA-C-N 122.72 2.509 . . . . 2.0 113.798 -179.831 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 3' ' ' CYS . . . . . 0.514 ' SG ' HD21 ' A' ' 1' ' ' LEU 0.454 1.9 m 83.09 -136.65 0.01 OUTLIER 'General case' 0 CA--C 1.564 1.518 0 N-CA-C 119.483 3.142 . . . . 2.0 119.483 179.786 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 35.7 m-20 -131.67 131.54 43.21 Favored 'General case' 0 N--CA 1.484 1.242 0 N-CA-C 116.363 1.986 . . . . 2.0 116.363 -179.448 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 19.8 ptmt -76.11 -164.35 0.37 Allowed 'General case' 0 N--CA 1.501 2.077 0 CA-C-N 119.746 1.157 . . . . 2.0 108.398 179.193 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 4.5 mm? -52.65 -30.54 32.25 Favored 'General case' 0 N--CA 1.514 2.753 0 O-C-N 117.617 -3.177 . . . . 2.0 114.586 179.666 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 7' ' ' ILE . . . . . . . . . . . . . 51.2 mm -66.72 132.76 94.05 Favored Pre-proline 0 CA--C 1.587 2.365 0 C-N-CA 125.356 1.462 . . . . 2.0 109.784 179.562 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . 0.314 20.5 Cg_exo -18.61 -71.76 0.02 OUTLIER 'Trans proline' 0 CA--C 1.568 2.225 1 N-CA-C 123.136 4.244 . . . . 2.0 123.136 -179.859 . . . . . . . . 3 2 . 1 . 007 nuclear nobuild full ' A' A ' 9' ' ' ILE . . . . . . . . . . . . . 17.2 tt -135.37 73.12 0.36 Allowed 'Isoleucine or valine' 0 N--CA 1.503 2.191 0 CA-C-O 122.183 0.992 . . . . 2.0 109.15 179.966 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . 0.359 . . -71.46 -101.11 0.01 OUTLIER 'General case' 0 CA--C 1.583 2.223 1 N-CA-C 125.576 5.399 . . . . 2.0 125.576 -179.433 . . . . . . . . 3 2 . 1 . 007 nuclear nobuild full ' A' A ' 11' ' ' SER . . . . . . . . . . . . 0.253 4.9 t -63.21 -169.76 0.03 OUTLIER 'General case' 0 CA--C 1.581 2.154 1 N-CA-C 123.356 4.576 . . . . 2.0 123.356 -179.255 . . . . . . . . 3 2 . 1 . 007 nuclear nobuild full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 6.7 tptp -132.19 -79.55 0.5 Allowed 'General case' 0 CA--C 1.582 2.191 0 N-CA-C 118.921 2.934 . . . . 2.0 118.921 -179.788 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 13' ' ' THR . . . . . . . . . . . . . 8.1 t -134.15 118.5 17.75 Favored 'General case' 0 N--CA 1.511 2.583 0 N-CA-C 120.286 3.439 . . . . 2.0 120.286 -179.615 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 14' ' ' CYS . . . . . 0.581 ' SG ' ' HD2' ' A' ' 18' ' ' LYS . 0.5 OUTLIER -101.56 179.86 0.93 Allowed Pre-proline 0 CA--C 1.596 2.74 0 C-N-CA 125.663 1.585 . . . . 2.0 110.555 179.604 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 15' ' ' PRO . . . . . . . . . . . . . 87.8 Cg_exo -51.26 177.05 0.04 OUTLIER 'Trans proline' 0 CA--C 1.572 2.406 1 N-CA-C 123.606 4.426 . . . . 2.0 123.606 -179.876 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 16' ' ' ALA . . . . . . . . . . . . 0.253 . . 19.06 -164.96 0.0 OUTLIER 'General case' 0 N--CA 1.5 2.075 1 N-CA-C 124.009 4.818 . . . . 2.0 124.009 179.768 . . . . . . . . 3 2 . 1 . 007 nuclear nobuild full ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . -81.95 37.03 2.51 Favored Glycine 0 N--CA 1.502 3.059 0 O-C-N 119.886 -1.758 . . . . 2.0 113.636 179.503 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 18' ' ' LYS . . . . . 0.581 ' HD2' ' SG ' ' A' ' 14' ' ' CYS . 0.1 OUTLIER -83.51 82.26 8.37 Favored 'General case' 0 CA--C 1.563 1.469 0 C-N-CA 125.613 1.565 . . . . 2.0 106.886 179.937 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 8.5 p30 -69.34 -34.15 74.19 Favored 'General case' 0 CA--C 1.558 1.278 1 N-CA-C 122.715 4.339 . . . . 2.0 122.715 -179.542 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 49.4 mt -68.91 118.36 11.75 Favored 'General case' 0 CA--C 1.56 1.344 0 N-CA-C 115.951 1.834 . . . . 2.0 115.951 -179.844 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 21' ' ' CYS . . . . . 0.535 ' SG ' ' O ' ' A' ' 56' ' ' THR . 34.4 m -81.88 96.39 7.63 Favored 'General case' 0 CA--C 1.572 1.808 0 N-CA-C 103.143 -2.91 . . . . 2.0 103.143 179.304 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 22' ' ' TYR . . . . . . . . . . . . 0.4 0.0 OUTLIER -68.45 158.21 34.2 Favored 'General case' 0 CA--C 1.56 1.34 0 N-CA-C 119.716 3.228 . . . . 2.0 119.716 -179.515 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 29.4 mtmt -131.36 89.36 2.71 Favored 'General case' 0 CA--C 1.557 1.246 1 N-CA-C 99.664 -4.198 . . . . 2.0 99.664 179.466 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 24' ' ' MET . . . . . 0.45 ' HB3' ' H ' ' A' ' 35' ' ' LYS . 20.4 ttt -71.24 68.31 0.5 Allowed 'General case' 0 CA--C 1.571 1.755 0 O-C-N 121.171 -0.956 . . . . 2.0 111.688 -179.842 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 25' ' ' PHE . . . . . . . . . . . . . 11.3 m-30 -59.0 127.18 30.93 Favored 'General case' 0 N--CA 1.486 1.339 0 O-C-N 120.798 -1.189 . . . . 2.0 113.292 -179.932 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 26' ' ' MET . . . . . . . . . . . . . 84.5 mtp -59.95 128.77 38.51 Favored 'General case' 0 N--CA 1.493 1.689 0 CA-C-O 118.048 -0.977 . . . . 2.0 111.577 179.877 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 27' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -54.44 -35.99 63.56 Favored 'General case' 0 N--CA 1.511 2.604 0 CA-C-N 121.474 1.943 . . . . 2.0 112.529 179.62 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 75.6 m -83.96 -14.05 51.84 Favored 'General case' 0 CA--C 1.591 2.54 0 N-CA-C 114.525 1.305 . . . . 2.0 114.525 179.268 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -161.49 77.92 0.55 Allowed 'General case' 0 N--CA 1.499 2.023 0 O-C-N 119.408 -2.058 . . . . 2.0 108.302 179.855 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 2.4 mm? -46.32 -79.99 0.01 OUTLIER 'General case' 0 CA--C 1.576 1.944 1 N-CA-C 123.532 4.642 . . . . 2.0 123.532 -179.399 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 31' ' ' THR . . . . . . . . . . . . 0.337 14.6 t -19.75 -52.44 0.01 OUTLIER 'General case' 0 N--CA 1.508 2.453 1 N-CA-C 122.941 4.423 . . . . 2.0 122.941 -179.689 . . . . . . . . 3 2 . 1 . 007 nuclear nobuild full ' A' A ' 32' ' ' ILE . . . . . . . . . . . . . 1.8 mp -97.86 106.94 37.36 Favored Pre-proline 0 CA--C 1.591 2.523 0 N-CA-C 101.617 -3.475 . . . . 2.0 101.617 179.545 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 33' ' ' PRO . . . . . . . . . . . . . 3.1 Cg_endo -65.3 167.47 16.47 Favored 'Trans proline' 0 CA--C 1.559 1.772 1 N-CA-C 122.63 4.05 . . . . 2.0 122.63 -179.659 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 34' ' ' VAL . . . . . . . . . . . . . 96.5 t -75.38 -53.37 16.26 Favored 'Isoleucine or valine' 0 CA--C 1.591 2.531 0 N-CA-C 104.546 -2.39 . . . . 2.0 104.546 178.965 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 35' ' ' LYS . . . . . 0.45 ' H ' ' HB3' ' A' ' 24' ' ' MET . 97.6 mttt -149.13 117.82 6.61 Favored 'General case' 0 CA--C 1.552 1.055 0 C-N-CA 125.494 1.518 . . . . 2.0 110.795 179.63 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 36' ' ' ARG . . . . . . . . . . . . 0.358 28.1 ttp180 -88.63 109.59 20.23 Favored 'General case' 0 CA--C 1.594 2.653 0 N-CA-C 101.715 -3.439 . . . . 2.0 101.715 179.689 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . -141.04 -135.81 3.22 Favored Glycine 0 N--CA 1.497 2.764 0 N-CA-C 121.264 3.266 . . . . 2.0 121.264 -179.28 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 38' ' ' CYS . . . . . . . . . . . . . 29.7 p -125.73 141.8 51.83 Favored 'General case' 0 N--CA 1.491 1.598 0 N-CA-C 116.116 1.895 . . . . 2.0 116.116 -179.826 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 39' ' ' ILE . . . . . 0.435 HG12 ' CG ' ' A' ' 43' ' ' PRO . 2.4 tp -164.73 166.69 0.51 Allowed 'Isoleucine or valine' 0 CA--C 1.574 1.881 0 N-CA-C 114.465 1.283 . . . . 2.0 114.465 -179.906 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 40' ' ' ASP . . . . . . . . . . . . . 8.0 p-10 -82.74 -51.51 7.62 Favored 'General case' 0 N--CA 1.505 2.289 0 O-C-N 119.868 -1.77 . . . . 2.0 113.402 179.536 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 87.7 t -133.72 143.28 39.16 Favored 'Isoleucine or valine' 0 CA--C 1.563 1.474 0 N-CA-C 102.271 -3.233 . . . . 2.0 102.271 179.677 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 42' ' ' CYS . . . . . . . . . . . . . 1.0 OUTLIER -57.69 105.41 0.53 Allowed Pre-proline 0 CA--C 1.602 2.967 0 N-CA-C 101.872 -3.381 . . . . 2.0 101.872 179.638 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 43' ' ' PRO . . . . . 0.435 ' CG ' HG12 ' A' ' 39' ' ' ILE . 39.8 Cg_exo -48.41 174.17 0.03 OUTLIER 'Trans proline' 0 C--N 1.371 1.755 1 N-CA-C 126.201 5.423 . . . . 2.0 126.201 -178.638 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 57.2 mttp -72.81 89.22 1.36 Allowed 'General case' 0 CA--C 1.568 1.648 0 CA-C-N 112.889 -1.96 . . . . 2.0 105.927 179.597 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 45' ' ' ASN . . . . . . . . . . . . . 4.1 p-10 -63.62 154.54 32.49 Favored 'General case' 0 CA--C 1.567 1.601 0 N-CA-C 117.301 2.334 . . . . 2.0 117.301 -179.614 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 22.5 t -123.33 -173.18 2.67 Favored 'General case' 0 N--CA 1.485 1.286 0 N-CA-C 113.802 1.038 . . . . 2.0 113.802 179.993 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 47' ' ' LEU . . . . . . . . . . . . 0.35 1.0 OUTLIER -56.7 -15.54 4.75 Favored 'General case' 0 N--CA 1.508 2.463 0 N-CA-C 116.338 1.977 . . . . 2.0 116.338 179.63 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 88.8 mt -101.95 -2.43 29.77 Favored 'General case' 0 CA--C 1.588 2.436 0 C-N-CA 125.986 1.714 . . . . 2.0 111.809 179.138 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 49' ' ' VAL . . . . . . . . . . . . . 11.2 p -154.23 165.37 1.37 Allowed 'Isoleucine or valine' 0 CA--C 1.583 2.236 0 N-CA-C 117.254 2.316 . . . . 2.0 117.254 -179.522 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 61.7 tttp -159.14 93.55 1.15 Allowed 'General case' 0 CA--C 1.573 1.829 1 N-CA-C 99.759 -4.163 . . . . 2.0 99.759 179.394 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 83.8 m-85 -72.41 124.01 24.25 Favored 'General case' 0 CA--C 1.568 1.673 0 N-CA-C 121.363 3.838 . . . . 2.0 121.363 -179.309 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 52' ' ' VAL . . . . . . . . . . . . 0.283 78.9 t -100.01 156.7 4.04 Favored 'Isoleucine or valine' 0 CA--C 1.585 2.307 0 N-CA-C 102.816 -3.031 . . . . 2.0 102.816 179.101 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 53' ' ' CYS . . . . . . . . . . . . 0.324 1.4 p -164.86 160.63 19.63 Favored 'General case' 0 N--CA 1.5 2.04 0 O-C-N 117.33 -3.356 . . . . 2.0 119.329 -179.034 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 54' ' ' CYS . . . . . . . . . . . . 0.395 25.4 p -152.35 119.7 5.95 Favored 'General case' 0 CA--C 1.584 2.258 0 CA-C-O 122.85 1.31 . . . . 2.0 111.866 179.471 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 10.6 m120 -34.01 -9.55 0.0 OUTLIER 'General case' 0 N--CA 1.504 2.234 1 N-CA-C 129.839 6.977 . . . . 2.0 129.839 -179.54 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 56' ' ' THR . . . . . 0.535 ' O ' ' SG ' ' A' ' 21' ' ' CYS . 7.9 t -130.79 161.43 31.77 Favored 'General case' 0 N--CA 1.513 2.687 0 CA-C-N 124.861 3.482 . . . . 2.0 115.727 -179.81 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 57' ' ' ASP . . . . . . . . . . . . . 5.5 m-20 -48.22 120.89 3.86 Favored 'General case' 0 N--CA 1.497 1.902 0 N-CA-C 114.796 1.406 . . . . 2.0 114.796 -179.835 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 58' ' ' ARG . . . . . . . . . . . . 0.281 63.4 mtt180 70.92 9.92 6.87 Favored 'General case' 0 N--CA 1.502 2.141 0 N-CA-C 115.699 1.741 . . . . 2.0 115.699 -179.76 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 59' ' ' CYS . . . . . . . . . . . . . 35.7 t -61.57 -32.22 72.3 Favored 'General case' 0 CA--C 1.574 1.867 0 N-CA-C 115.632 1.716 . . . . 2.0 115.632 179.775 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 60' ' ' ASN . . . . . . . . . . . . . 47.9 p30 . . . . . 0 CA--C 1.567 1.602 0 CA-C-O 124.652 2.168 . . . . 2.0 112.848 179.813 . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' A' A ' 1' ' ' LEU . . . . . 0.524 HD13 ' SG ' ' A' ' 3' ' ' CYS . 0.5 OUTLIER . . . . . 0 CA--C 1.582 2.203 0 CA-C-O 122.467 1.127 . . . . 2.0 112.823 . . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 6.3 tmtt? -145.76 108.3 4.46 Favored 'General case' 0 N--CA 1.494 1.766 0 N-CA-C 101.076 -3.675 . . . . 2.0 101.076 179.855 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 3' ' ' CYS . . . . . 0.524 ' SG ' HD13 ' A' ' 1' ' ' LEU . 71.7 m -123.13 174.75 7.04 Favored 'General case' 0 N--CA 1.495 1.781 0 N-CA-C 119.126 3.01 . . . . 2.0 119.126 -179.474 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 18.0 m-20 -102.84 137.62 40.81 Favored 'General case' 0 CA--C 1.56 1.362 0 C-N-CA 124.193 0.997 . . . . 2.0 110.852 179.778 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 22.0 ptmt -84.84 -160.93 0.52 Allowed 'General case' 0 CA--C 1.593 2.631 0 CA-C-N 120.376 1.444 . . . . 2.0 108.113 179.224 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -46.0 -42.75 13.58 Favored 'General case' 0 N--CA 1.509 2.483 0 N-CA-C 119.136 3.013 . . . . 2.0 119.136 -179.996 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 7' ' ' ILE . . . . . . . . . . . . . 42.6 mm -65.88 138.77 96.54 Favored Pre-proline 0 CA--C 1.585 2.295 0 N-CA-C 115.542 1.682 . . . . 2.0 115.542 -179.74 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 80.0 Cg_exo -48.16 -40.55 34.55 Favored 'Trans proline' 0 CA--C 1.569 2.256 0 N-CA-C 121.063 3.447 . . . . 2.0 121.063 179.844 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 9' ' ' ILE . . . . . . . . . . . . . 34.4 mm -106.39 30.25 0.96 Allowed 'Isoleucine or valine' 0 CA--C 1.589 2.473 0 N-CA-C 114.169 1.174 . . . . 2.0 114.169 -179.817 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -74.52 160.63 30.66 Favored 'General case' 0 CA--C 1.574 1.9 0 O-C-N 118.108 -2.87 . . . . 2.0 117.205 -179.91 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 96.4 p -153.41 119.99 5.59 Favored 'General case' 0 N--CA 1.501 2.115 0 O-C-N 120.448 -1.407 . . . . 2.0 112.27 -179.919 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -148.49 138.69 22.5 Favored 'General case' 0 N--CA 1.497 1.888 0 O-C-N 120.801 -1.187 . . . . 2.0 113.41 -179.804 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 13' ' ' THR . . . . . . . . . . . . . 50.9 m -74.2 130.26 39.4 Favored 'General case' 0 N--CA 1.505 2.32 0 O-C-N 120.574 -1.329 . . . . 2.0 110.897 179.829 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 14' ' ' CYS . . . . . 0.465 ' SG ' ' HD2' ' A' ' 15' ' ' PRO 0.256 12.7 t -135.27 162.51 57.02 Favored Pre-proline 0 CA--C 1.594 2.641 0 N-CA-C 113.99 1.108 . . . . 2.0 113.99 -179.625 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 15' ' ' PRO . . . . . 0.465 ' HD2' ' SG ' ' A' ' 14' ' ' CYS . 68.4 Cg_exo -50.49 161.81 1.12 Allowed 'Trans proline' 0 CA--C 1.575 2.551 1 N-CA-C 125.538 5.169 . . . . 2.0 125.538 -179.822 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -84.36 171.83 12.31 Favored 'General case' 0 N--CA 1.498 1.954 0 C-N-CA 124.94 1.296 . . . . 2.0 111.757 179.581 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . 81.76 -46.93 3.56 Favored Glycine 1 N--CA 1.523 4.461 0 O-C-N 119.245 -2.159 . . . . 2.0 108.618 -178.938 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 72.8 mmtt -78.64 85.44 4.68 Favored 'General case' 0 CA--C 1.575 1.934 0 C-N-CA 129.017 2.927 . . . . 2.0 104.446 179.336 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 8.1 p30 -82.96 -23.97 33.19 Favored 'General case' 0 N--CA 1.496 1.832 0 N-CA-C 119.642 3.201 . . . . 2.0 119.642 -179.775 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 61.9 mt -88.66 121.71 31.32 Favored 'General case' 0 CA--C 1.551 0.998 0 C-N-CA 123.96 0.904 . . . . 2.0 113.11 -179.966 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 1.3 m -82.26 97.42 8.27 Favored 'General case' 0 CA--C 1.577 1.999 1 N-CA-C 99.001 -4.444 . . . . 2.0 99.001 179.064 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 22' ' ' TYR . . . . . . . . . . . . 0.263 0.0 OUTLIER -82.69 153.55 25.29 Favored 'General case' 0 N--CA 1.482 1.163 0 N-CA-C 118.795 2.887 . . . . 2.0 118.795 -179.429 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 13.4 ptmt -126.32 96.65 4.77 Favored 'General case' 0 CA--C 1.561 1.381 0 N-CA-C 103.938 -2.616 . . . . 2.0 103.938 179.629 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 24' ' ' MET . . . . . . . . . . . . 0.28 42.0 ttm -65.1 70.98 0.04 OUTLIER 'General case' 0 CA--C 1.57 1.742 0 C-N-CA 126.301 1.84 . . . . 2.0 113.911 -179.856 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 25' ' ' PHE . . . . . . . . . . . . . 4.0 m-30 -58.09 133.65 55.75 Favored 'General case' 0 N--CA 1.493 1.715 0 O-C-N 120.55 -1.344 . . . . 2.0 114.014 179.939 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 26' ' ' MET . . . . . . . . . . . . . 58.1 mtp -66.62 131.61 46.37 Favored 'General case' 0 N--CA 1.492 1.632 0 CA-C-O 118.609 -0.71 . . . . 2.0 111.948 179.941 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 27' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -54.06 -41.21 67.88 Favored 'General case' 0 N--CA 1.513 2.716 0 CA-C-N 120.702 1.592 . . . . 2.0 112.542 179.562 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 50.5 m -77.89 -35.26 50.99 Favored 'General case' 0 CA--C 1.585 2.299 0 N-CA-C 113.892 1.071 . . . . 2.0 113.892 179.475 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 11.8 t70 -141.19 82.17 1.82 Allowed 'General case' 0 CA--C 1.574 1.88 0 O-C-N 120.635 -1.29 . . . . 2.0 109.383 179.871 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 2.3 mm? -47.73 -71.42 0.07 Allowed 'General case' 0 CA--C 1.579 2.078 0 N-CA-C 119.876 3.287 . . . . 2.0 119.876 -179.671 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 31' ' ' THR . . . . . . . . . . . . . 56.2 p -15.18 -64.32 0.01 OUTLIER 'General case' 0 N--CA 1.511 2.587 0 N-CA-C 121.787 3.995 . . . . 2.0 121.787 -179.814 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 32' ' ' ILE . . . . . . . . . . . . . 1.8 mp -94.78 110.98 52.52 Favored Pre-proline 0 CA--C 1.587 2.392 0 N-CA-C 101.948 -3.353 . . . . 2.0 101.948 179.609 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 33' ' ' PRO . . . . . . . . . . . . . 5.2 Cg_exo -67.03 164.33 30.43 Favored 'Trans proline' 0 CA--C 1.557 1.665 0 N-CA-C 122.201 3.885 . . . . 2.0 122.201 -179.557 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 34' ' ' VAL . . . . . . . . . . . . . 58.7 t -70.74 -45.6 72.99 Favored 'Isoleucine or valine' 0 CA--C 1.595 2.679 0 N-CA-C 106.462 -1.681 . . . . 2.0 106.462 178.883 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 5.3 tptm -152.42 167.78 27.61 Favored 'General case' 0 CA--C 1.567 1.623 0 C-N-CA 126.626 1.97 . . . . 2.0 109.797 179.773 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 12.5 mtt180 -144.3 110.26 5.38 Favored 'General case' 0 CA--C 1.574 1.868 0 N-CA-C 104.196 -2.52 . . . . 2.0 104.196 179.495 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . -141.83 -135.53 3.13 Favored Glycine 0 N--CA 1.494 2.5 0 O-C-N 120.699 -1.25 . . . . 2.0 115.116 -179.872 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 38' ' ' CYS . . . . . . . . . . . . . 16.1 p -129.33 136.23 49.75 Favored 'General case' 0 N--CA 1.491 1.614 0 CA-C-N 118.174 0.987 . . . . 2.0 112.45 179.713 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 39' ' ' ILE . . . . . . . . . . . . . 3.3 tp -150.38 162.08 3.82 Favored 'Isoleucine or valine' 0 CA--C 1.577 2.003 0 N-CA-C 113.78 1.03 . . . . 2.0 113.78 -179.866 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 40' ' ' ASP . . . . . . . . . . . . . 8.1 p-10 -79.64 -49.84 11.53 Favored 'General case' 0 N--CA 1.513 2.713 0 O-C-N 119.139 -2.226 . . . . 2.0 114.504 179.753 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 70.3 t -134.47 143.72 37.1 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.415 0 N-CA-C 102.537 -3.135 . . . . 2.0 102.537 179.645 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 42' ' ' CYS . . . . . . . . . . . . 0.258 1.9 m -57.55 104.95 0.46 Allowed Pre-proline 0 CA--C 1.599 2.836 0 N-CA-C 102.032 -3.321 . . . . 2.0 102.032 179.67 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 43' ' ' PRO . . . . . . . . . . . . . 25.2 Cg_exo -50.75 179.87 0.02 OUTLIER 'Trans proline' 0 C--N 1.371 1.757 1 N-CA-C 125.466 5.141 . . . . 2.0 125.466 -178.693 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 29.9 mtpp -69.79 96.31 0.97 Allowed 'General case' 0 CA--C 1.565 1.522 0 N-CA-C 105.506 -2.035 . . . . 2.0 105.506 179.535 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 45' ' ' ASN . . . . . . . . . . . . 0.252 2.1 p-10 -62.62 112.91 2.69 Favored 'General case' 0 CA--C 1.567 1.604 0 N-CA-C 116.763 2.134 . . . . 2.0 116.763 -179.456 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 12.4 t -80.17 -179.8 7.25 Favored 'General case' 0 CA--C 1.567 1.604 0 N-CA-C 114.511 1.301 . . . . 2.0 114.511 179.943 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 47' ' ' LEU . . . . . . . . . . . . . 93.3 mt -49.77 -28.55 6.38 Favored 'General case' 0 N--CA 1.507 2.39 0 N-CA-C 116.708 2.114 . . . . 2.0 116.708 179.822 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 78.6 mt -102.54 12.73 36.01 Favored 'General case' 0 CA--C 1.579 2.082 0 C-N-CA 124.849 1.259 . . . . 2.0 114.06 179.655 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 49' ' ' VAL . . . . . . . . . . . . . 9.4 p -155.85 158.62 3.29 Favored 'Isoleucine or valine' 0 N--CA 1.502 2.168 0 N-CA-C 118.114 2.635 . . . . 2.0 118.114 -179.699 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 59.9 tttp -153.57 75.51 1.05 Allowed 'General case' 0 CA--C 1.581 2.135 0 N-CA-C 103.011 -2.959 . . . . 2.0 103.011 179.296 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 18.2 m-85 -50.38 120.79 4.88 Favored 'General case' 0 CA--C 1.572 1.806 0 N-CA-C 121.58 3.918 . . . . 2.0 121.58 -179.53 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 52' ' ' VAL . . . . . . . . . . . . 0.256 25.2 t -101.76 140.79 19.46 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.958 0 N-CA-C 101.968 -3.345 . . . . 2.0 101.968 179.294 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 53' ' ' CYS . . . . . . . . . . . . 0.425 6.8 p -155.71 158.95 39.08 Favored 'General case' 0 N--CA 1.493 1.702 0 N-CA-C 118.821 2.897 . . . . 2.0 118.821 -178.866 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 54' ' ' CYS . . . . . . . . . . . . 0.408 21.6 p -148.57 127.57 12.75 Favored 'General case' 0 CA--C 1.579 2.087 0 CA-C-O 122.606 1.193 . . . . 2.0 110.971 179.505 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 12.3 m120 -42.65 16.31 0.0 OUTLIER 'General case' 0 N--CA 1.504 2.262 1 N-CA-C 127.338 6.051 . . . . 2.0 127.338 -179.481 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 6.9 t -148.14 177.27 9.53 Favored 'General case' 0 N--CA 1.501 2.104 0 CA-C-N 123.179 2.718 . . . . 2.0 115.012 -179.935 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 57' ' ' ASP . . . . . . . . . . . . . 43.4 m-20 -62.86 124.03 19.99 Favored 'General case' 0 CA--C 1.56 1.362 0 C-N-CA 124.126 0.971 . . . . 2.0 112.792 -180.0 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 58' ' ' ARG . . . . . . . . . . . . . 71.3 mtp180 64.66 18.73 11.55 Favored 'General case' 0 N--CA 1.499 1.981 0 N-CA-C 117.01 2.226 . . . . 2.0 117.01 -179.962 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 59' ' ' CYS . . . . . . . . . . . . . 36.8 t -71.18 -19.56 62.39 Favored 'General case' 0 CA--C 1.579 2.078 0 N-CA-C 117.081 2.252 . . . . 2.0 117.081 179.902 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 60' ' ' ASN . . . . . . . . . . . . . 10.2 p30 . . . . . 0 CA--C 1.567 1.615 0 CA-C-O 125.21 2.433 . . . . 2.0 112.823 179.803 . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' A' A ' 1' ' ' LEU . . . . . . . . . . . . 0.301 0.3 OUTLIER . . . . . 0 CA--C 1.571 1.788 0 N-CA-C 114.117 1.154 . . . . 2.0 114.117 . . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 28.2 mttp -70.66 128.74 37.11 Favored 'General case' 0 N--CA 1.494 1.748 0 O-C-N 120.735 -1.228 . . . . 2.0 110.451 179.764 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 71.8 m -137.84 -176.52 4.45 Favored 'General case' 0 CA--C 1.566 1.562 0 CA-C-O 122.619 1.2 . . . . 2.0 113.323 -179.816 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 91.8 m-20 -122.86 97.42 5.44 Favored 'General case' 0 CA--C 1.554 1.102 0 C-N-CA 123.583 0.753 . . . . 2.0 111.739 179.957 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . 0.315 22.4 ptmt -56.15 164.14 1.37 Allowed 'General case' 0 CA--C 1.589 2.476 0 CA-C-N 120.396 1.453 . . . . 2.0 112.475 179.465 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 6' ' ' LEU . . . . . . . . . . . . 0.358 2.4 tm? -30.66 -49.52 0.12 Allowed 'General case' 0 N--CA 1.511 2.625 1 N-CA-C 122.648 4.314 . . . . 2.0 122.648 -179.139 . . . . . . . . 3 2 . 1 . 009 nuclear nobuild full ' A' A ' 7' ' ' ILE . . . . . . . . . . . . . 49.0 mm -55.08 149.16 25.89 Favored Pre-proline 0 CA--C 1.594 2.649 0 N-CA-C 114.425 1.268 . . . . 2.0 114.425 179.889 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 97.3 Cg_exo -47.21 -54.16 5.42 Favored 'Trans proline' 0 CA--C 1.575 2.549 0 C-N-CA 123.059 2.506 . . . . 2.0 118.282 179.881 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 9' ' ' ILE . . . . . . . . . . . . 0.256 10.8 tp -74.65 -48.31 35.05 Favored 'Isoleucine or valine' 0 N--CA 1.507 2.42 0 N-CA-C 114.459 1.281 . . . . 2.0 114.459 179.684 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . 24.52 120.1 0.0 OUTLIER 'General case' 0 CA--C 1.58 2.114 1 N-CA-C 124.202 4.89 . . . . 2.0 124.202 179.739 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 94.1 p -112.18 100.59 8.95 Favored 'General case' 0 CA--C 1.568 1.668 0 N-CA-C 117.116 2.265 . . . . 2.0 117.116 -179.754 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 16.6 tppt? -117.35 127.3 53.92 Favored 'General case' 0 N--CA 1.495 1.805 0 N-CA-C 108.05 -1.092 . . . . 2.0 108.05 179.715 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 13' ' ' THR . . . . . . . . . . . . . 9.8 t -135.99 78.47 1.72 Allowed 'General case' 0 N--CA 1.503 2.185 0 O-C-N 120.782 -1.199 . . . . 2.0 111.398 -179.973 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 14' ' ' CYS . . . . . . . . . . . . 0.272 0.1 OUTLIER -103.88 170.87 5.64 Favored Pre-proline 0 CA--C 1.587 2.398 0 N-CA-C 115.364 1.616 . . . . 2.0 115.364 -179.939 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 15' ' ' PRO . . . . . . . . . . . . . 86.2 Cg_exo -55.72 164.82 4.08 Favored 'Trans proline' 0 N--CA 1.501 1.954 1 N-CA-C 126.197 5.422 . . . . 2.0 126.197 -179.617 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -70.19 175.91 4.24 Favored 'General case' 0 N--CA 1.498 1.946 0 C-N-CA 123.935 0.894 . . . . 2.0 109.437 179.398 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . 83.65 -53.2 4.83 Favored Glycine 1 N--CA 1.518 4.141 0 O-C-N 118.341 -2.724 . . . . 2.0 106.558 -179.101 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 18.3 mmtm -80.3 65.83 5.59 Favored 'General case' 0 CA--C 1.602 2.977 0 N-CA-C 103.113 -2.921 . . . . 2.0 103.113 178.926 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 9.8 p30 -64.67 -38.84 92.38 Favored 'General case' 0 N--CA 1.482 1.156 0 N-CA-C 120.69 3.589 . . . . 2.0 120.69 -179.475 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 89.4 mt -72.36 117.02 13.5 Favored 'General case' 0 CA--C 1.55 0.959 0 N-CA-C 115.704 1.742 . . . . 2.0 115.704 -179.764 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 1.5 m -84.79 91.9 8.1 Favored 'General case' 0 CA--C 1.576 1.978 1 N-CA-C 98.902 -4.481 . . . . 2.0 98.902 179.084 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 22' ' ' TYR . . . . . . . . . . . . 0.321 4.4 p90 -65.56 153.69 40.81 Favored 'General case' 0 N--CA 1.481 1.08 0 N-CA-C 119.674 3.212 . . . . 2.0 119.674 -179.368 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 29.5 ttpt -132.21 96.14 3.82 Favored 'General case' 0 CA--C 1.562 1.422 0 N-CA-C 104.171 -2.529 . . . . 2.0 104.171 179.857 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 24' ' ' MET . . . . . 0.489 ' SD ' ' HB3' ' A' ' 35' ' ' LYS . 15.0 ttt -68.12 86.05 0.25 Allowed 'General case' 0 CA--C 1.567 1.609 0 N-CA-C 114.356 1.243 . . . . 2.0 114.356 -179.722 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 25' ' ' PHE . . . . . . . . . . . . . 3.0 m-30 -81.76 108.51 15.35 Favored 'General case' 0 CA--C 1.569 1.696 0 N-CA-C 105.153 -2.166 . . . . 2.0 105.153 179.649 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 26' ' ' MET . . . . . . . . . . . . . 22.3 ttt -58.11 137.99 56.47 Favored 'General case' 0 N--CA 1.496 1.841 0 O-C-N 120.885 -1.134 . . . . 2.0 113.864 -179.864 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 27' ' ' MET . . . . . . . . . . . . . 2.2 mmt -48.21 -39.69 21.94 Favored 'General case' 0 N--CA 1.508 2.456 0 N-CA-C 115.359 1.614 . . . . 2.0 115.359 179.929 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 59.4 m -80.76 -38.91 27.79 Favored 'General case' 0 CA--C 1.584 2.275 0 C-N-CA 123.611 0.765 . . . . 2.0 112.932 179.538 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 59.0 t0 -132.63 99.44 4.64 Favored 'General case' 0 CA--C 1.572 1.825 0 N-CA-C 106.573 -1.64 . . . . 2.0 106.573 179.733 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 2.4 mm? -76.55 -77.35 0.14 Allowed 'General case' 0 CA--C 1.578 2.046 0 N-CA-C 117.59 2.441 . . . . 2.0 117.59 -179.658 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 31' ' ' THR . . . . . . . . . . . . . 56.5 p -14.24 -69.81 0.01 OUTLIER 'General case' 0 N--CA 1.511 2.58 0 N-CA-C 121.15 3.759 . . . . 2.0 121.15 -179.804 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 32' ' ' ILE . . . . . . . . . . . . . 2.0 mp -89.44 112.47 51.73 Favored Pre-proline 0 CA--C 1.589 2.451 1 N-CA-C 99.562 -4.236 . . . . 2.0 99.562 179.552 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 33' ' ' PRO . . . . . . . . . . . . . 6.0 Cg_exo -66.87 158.19 57.73 Favored 'Trans proline' 0 CA--C 1.554 1.512 0 N-CA-C 119.706 2.925 . . . . 2.0 119.706 -179.41 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 34' ' ' VAL . . . . . . . . . . . . 0.255 13.2 m -85.16 -37.18 12.0 Favored 'Isoleucine or valine' 0 CA--C 1.585 2.315 0 CA-C-O 121.627 0.727 . . . . 2.0 109.82 179.078 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 35' ' ' LYS . . . . . 0.489 ' HB3' ' SD ' ' A' ' 24' ' ' MET . 34.8 ttmt -145.66 163.87 33.53 Favored 'General case' 0 CA--C 1.569 1.706 0 CA-C-O 123.72 1.724 . . . . 2.0 109.293 179.59 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 14.4 mtp180 -145.39 132.22 20.11 Favored 'General case' 0 CA--C 1.576 1.964 0 N-CA-C 102.815 -3.031 . . . . 2.0 102.815 179.585 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . -153.21 -146.35 4.35 Favored Glycine 0 N--CA 1.488 2.162 0 O-C-N 119.797 -1.815 . . . . 2.0 117.61 -179.775 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 38' ' ' CYS . . . . . . . . . . . . . 10.5 p -129.33 132.5 47.12 Favored 'General case' 0 CA--C 1.571 1.765 0 C-N-CA 123.668 0.787 . . . . 2.0 111.481 179.944 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 39' ' ' ILE . . . . . 0.515 HG21 ' HD3' ' A' ' 43' ' ' PRO . 9.9 tp -158.98 172.66 0.39 Allowed 'Isoleucine or valine' 0 N--CA 1.503 2.198 0 O-C-N 120.692 -1.255 . . . . 2.0 113.08 -179.773 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 40' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -95.3 -46.39 6.75 Favored 'General case' 0 N--CA 1.498 1.945 0 O-C-N 119.858 -1.776 . . . . 2.0 114.173 179.724 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 69.0 t -130.87 25.82 1.63 Allowed 'Isoleucine or valine' 0 N--CA 1.512 2.631 0 N-CA-C 114.934 1.457 . . . . 2.0 114.934 -179.584 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 42' ' ' CYS . . . . . . . . . . . . 0.283 2.8 m 81.21 114.07 0.03 OUTLIER Pre-proline 0 N--CA 1.526 3.339 1 N-CA-C 96.337 -5.431 . . . . 2.0 96.337 -179.15 . . . . . . . . 3 2 . 1 . 009 nuclear nobuild full ' A' A ' 43' ' ' PRO . . . . . 0.515 ' HD3' HG21 ' A' ' 39' ' ' ILE 0.472 31.5 Cg_exo -34.46 -96.52 0.0 OUTLIER 'Trans proline' 0 CA--C 1.565 2.027 1 N-CA-C 123.617 4.43 . . . . 2.0 123.617 -178.832 . . . . . . . . 4 3 . 1 . 009 nuclear nobuild full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 44.7 mttm -159.28 95.86 1.27 Allowed 'General case' 0 CA--C 1.562 1.426 1 N-CA-C 98.706 -4.553 . . . . 2.0 98.706 179.696 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 45' ' ' ASN . . . . . . . . . . . . . 5.2 p-10 -72.91 -168.3 0.46 Allowed 'General case' 0 CA--C 1.572 1.812 0 N-CA-C 117.793 2.516 . . . . 2.0 117.793 -179.594 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 46' ' ' SER . . . . . . . . . . . . 0.349 5.5 t 80.79 -41.6 0.18 Allowed 'General case' 0 N--CA 1.491 1.605 0 N-CA-C 118.236 2.68 . . . . 2.0 118.236 179.907 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 47' ' ' LEU . . . . . . . . . . . . 0.252 2.7 pp -49.36 -51.1 36.83 Favored 'General case' 0 N--CA 1.508 2.473 0 CA-C-N 120.724 1.602 . . . . 2.0 113.07 179.696 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 92.3 mt -155.37 27.44 0.4 Allowed 'General case' 0 CA--C 1.589 2.444 0 C-N-CA 126.688 1.995 . . . . 2.0 108.269 179.428 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 49' ' ' VAL . . . . . 0.4 HG21 ' HG3' ' A' ' 24' ' ' MET . 14.5 p -169.33 168.24 0.27 Allowed 'Isoleucine or valine' 0 CA--C 1.582 2.201 0 N-CA-C 118.932 2.938 . . . . 2.0 118.932 -179.139 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 28.4 ttpt -146.92 74.26 1.34 Allowed 'General case' 0 CA--C 1.581 2.141 0 N-CA-C 102.251 -3.24 . . . . 2.0 102.251 178.977 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 54.3 m-85 -53.04 126.45 20.64 Favored 'General case' 0 CA--C 1.572 1.816 0 N-CA-C 120.187 3.403 . . . . 2.0 120.187 -179.41 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 52' ' ' VAL . . . . . . . . . . . . . 55.9 t -100.43 110.86 28.43 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.853 0 N-CA-C 101.176 -3.639 . . . . 2.0 101.176 179.371 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 53' ' ' CYS . . . . . . . . . . . . 0.312 1.4 p -123.68 136.61 54.57 Favored 'General case' 0 CA--C 1.569 1.709 0 N-CA-C 118.406 2.743 . . . . 2.0 118.406 -179.211 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 54' ' ' CYS . . . . . . . . . . . . 0.307 19.6 p -128.41 124.92 37.48 Favored 'General case' 0 CA--C 1.578 2.026 0 CA-C-O 122.722 1.248 . . . . 2.0 110.533 179.75 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 12.4 p-10 -52.9 32.36 0.0 OUTLIER 'General case' 0 N--CA 1.498 1.964 1 N-CA-C 127.675 6.176 . . . . 2.0 127.675 -179.544 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 56' ' ' THR . . . . . . . . . . . . 0.256 9.4 t -150.24 170.01 20.0 Favored 'General case' 0 N--CA 1.501 2.114 0 O-C-N 119.342 -2.098 . . . . 2.0 114.238 179.95 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 57' ' ' ASP . . . . . . . . . . . . . 39.5 m-20 -62.0 118.96 7.97 Favored 'General case' 0 N--CA 1.488 1.427 0 N-CA-C 113.894 1.072 . . . . 2.0 113.894 -179.925 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 58' ' ' ARG . . . . . . . . . . . . 0.277 21.5 mtt85 65.84 18.69 11.19 Favored 'General case' 0 N--CA 1.498 1.941 0 N-CA-C 117.403 2.372 . . . . 2.0 117.403 -179.881 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 59' ' ' CYS . . . . . . . . . . . . . 48.4 t -63.78 -32.47 73.98 Favored 'General case' 0 CA--C 1.577 1.999 0 N-CA-C 116.567 2.062 . . . . 2.0 116.567 179.899 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 60' ' ' ASN . . . . . . . . . . . . . 19.6 p30 . . . . . 0 CA--C 1.566 1.566 0 CA-C-O 124.993 2.33 . . . . 2.0 114.58 179.859 . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' A' A ' 1' ' ' LEU . . . . . 0.455 HD21 ' SG ' ' A' ' 21' ' ' CYS . 6.2 tp . . . . . 0 CA--C 1.572 1.824 0 N-CA-C 114.727 1.381 . . . . 2.0 114.727 . . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 15.8 mtmm -86.77 140.96 29.21 Favored 'General case' 0 CA--C 1.576 1.946 0 O-C-N 120.993 -1.067 . . . . 2.0 108.314 179.549 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 3' ' ' CYS . . . . . 0.429 ' SG ' ' HB2' ' A' ' 38' ' ' CYS . 85.7 m -137.39 174.41 10.63 Favored 'General case' 0 N--CA 1.499 1.988 0 O-C-N 119.339 -2.101 . . . . 2.0 115.251 -179.906 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 60.8 m-20 -123.65 103.41 8.4 Favored 'General case' 0 CA--C 1.574 1.868 0 N-CA-C 119.119 3.007 . . . . 2.0 119.119 -179.839 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 19.2 ptmt -59.23 170.62 0.9 Allowed 'General case' 0 CA--C 1.6 2.875 0 O-C-N 119.67 -1.893 . . . . 2.0 111.934 179.264 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 4.2 mm? -31.37 -49.99 0.16 Allowed 'General case' 0 N--CA 1.511 2.58 1 N-CA-C 122.234 4.161 . . . . 2.0 122.234 -179.758 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 7' ' ' ILE . . . . . . . . . . . . . 20.9 mt -69.57 148.11 96.81 Favored Pre-proline 0 CA--C 1.584 2.258 0 N-CA-C 115.256 1.576 . . . . 2.0 115.256 -179.816 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 82.6 Cg_exo -51.47 -48.3 21.97 Favored 'Trans proline' 0 CA--C 1.574 2.475 0 C-N-CA 123.154 2.57 . . . . 2.0 117.167 179.681 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 9' ' ' ILE . . . . . . . . . . . . 0.283 11.3 tp -61.85 -46.49 96.41 Favored 'Isoleucine or valine' 0 N--CA 1.511 2.593 0 CA-C-N 119.712 1.142 . . . . 2.0 112.444 179.521 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . 54.51 175.77 0.03 OUTLIER 'General case' 0 CA--C 1.579 2.091 1 N-CA-C 126.484 5.735 . . . . 2.0 126.484 179.336 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 8.7 t -68.68 -169.99 0.19 Allowed 'General case' 0 CA--C 1.58 2.099 0 N-CA-C 118.548 2.796 . . . . 2.0 118.548 -179.833 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . 0.297 2.5 tppp? -106.01 -90.66 0.41 Allowed 'General case' 0 CA--C 1.572 1.819 1 N-CA-C 122.967 4.432 . . . . 2.0 122.967 -179.545 . . . . . . . . 3 2 . 1 . 010 nuclear nobuild full ' A' A ' 13' ' ' THR . . . . . . . . . . . . . 7.8 t -154.39 165.15 37.3 Favored 'General case' 0 N--CA 1.51 2.543 1 N-CA-C 121.903 4.038 . . . . 2.0 121.903 -179.116 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -132.62 170.15 12.12 Favored Pre-proline 0 CA--C 1.599 2.854 0 C-N-CA 126.119 1.767 . . . . 2.0 108.717 179.331 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 15' ' ' PRO . . . . . . . . . . . . . 61.0 Cg_exo -59.3 -179.11 0.16 Allowed 'Trans proline' 0 CA--C 1.574 2.488 1 N-CA-C 124.941 4.939 . . . . 2.0 124.941 -179.784 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -78.83 164.12 24.76 Favored 'General case' 0 N--CA 1.5 2.04 0 N-CA-C 106.174 -1.787 . . . . 2.0 106.174 179.278 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . 84.45 -48.58 4.08 Favored Glycine 1 N--CA 1.523 4.437 0 N-CA-C 105.714 -2.954 . . . . 2.0 105.714 -178.769 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 28.4 mmtm -81.69 63.9 6.16 Favored 'General case' 0 CA--C 1.596 2.731 0 N-CA-C 102.052 -3.314 . . . . 2.0 102.052 178.698 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 45.5 p-10 -84.09 -13.59 52.64 Favored 'General case' 0 N--CA 1.487 1.397 0 N-CA-C 121.034 3.716 . . . . 2.0 121.034 -179.451 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 76.8 mt -91.14 113.84 26.21 Favored 'General case' 0 CA--C 1.553 1.087 0 CA-C-N 119.083 0.856 . . . . 2.0 111.166 179.862 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 21' ' ' CYS . . . . . 0.455 ' SG ' HD21 ' A' ' 1' ' ' LEU . 1.8 m -80.32 94.12 6.06 Favored 'General case' 0 CA--C 1.574 1.9 0 N-CA-C 101.303 -3.592 . . . . 2.0 101.303 179.235 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 22' ' ' TYR . . . . . . . . . . . . 0.302 0.0 OUTLIER -72.26 148.13 45.77 Favored 'General case' 0 CA--C 1.551 0.993 0 N-CA-C 121.446 3.869 . . . . 2.0 121.446 -179.313 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 58.5 mttp -111.29 92.2 3.95 Favored 'General case' 0 CA--C 1.561 1.38 1 N-CA-C 99.233 -4.358 . . . . 2.0 99.233 179.249 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 24' ' ' MET . . . . . . . . . . . . . 27.9 ttt -72.24 67.99 0.72 Allowed 'General case' 0 CA--C 1.573 1.852 0 O-C-N 120.811 -1.181 . . . . 2.0 111.55 -179.873 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 25' ' ' PHE . . . . . . . . . . . . . 10.8 m-30 -57.64 131.19 49.48 Favored 'General case' 0 N--CA 1.486 1.362 0 N-CA-C 114.804 1.409 . . . . 2.0 114.804 -179.861 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 26' ' ' MET . . . . . . . . . . . . . 42.3 mtt -65.58 130.81 44.61 Favored 'General case' 0 N--CA 1.493 1.698 0 CA-C-O 118.536 -0.745 . . . . 2.0 110.74 179.778 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 27' ' ' MET . . . . . . . . . . . . . 8.6 tmm? -56.47 -35.24 67.72 Favored 'General case' 0 N--CA 1.51 2.543 0 CA-C-N 121.106 1.775 . . . . 2.0 112.131 179.561 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 49.2 m -76.32 -36.49 58.26 Favored 'General case' 0 CA--C 1.586 2.364 0 C-N-CA 124.276 1.031 . . . . 2.0 113.14 179.315 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 10.3 t0 -144.21 84.2 1.76 Allowed 'General case' 0 CA--C 1.577 1.992 0 O-C-N 120.692 -1.255 . . . . 2.0 107.766 179.794 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 1.9 mm? -48.46 -74.63 0.03 OUTLIER 'General case' 0 CA--C 1.574 1.887 0 N-CA-C 121.002 3.704 . . . . 2.0 121.002 -179.482 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 31' ' ' THR . . . . . . . . . . . . 0.283 12.2 t -18.41 -60.2 0.02 OUTLIER 'General case' 0 N--CA 1.508 2.44 0 N-CA-C 121.366 3.839 . . . . 2.0 121.366 -179.942 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 32' ' ' ILE . . . . . . . . . . . . . 1.8 mp -95.9 103.76 14.34 Favored Pre-proline 0 CA--C 1.59 2.491 0 N-CA-C 101.414 -3.551 . . . . 2.0 101.414 179.641 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 33' ' ' PRO . . . . . . . . . . . . . 55.6 Cg_endo -65.69 170.3 11.49 Favored 'Trans proline' 0 CA--C 1.56 1.791 1 N-CA-C 123.571 4.412 . . . . 2.0 123.571 -179.521 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 34' ' ' VAL . . . . . . . . . . . . . 54.9 t -73.04 -50.64 30.75 Favored 'Isoleucine or valine' 0 CA--C 1.594 2.642 0 N-CA-C 105.303 -2.11 . . . . 2.0 105.303 178.889 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 2.0 tptm -141.5 157.68 44.82 Favored 'General case' 0 CA--C 1.562 1.43 0 C-N-CA 126.618 1.967 . . . . 2.0 109.007 179.654 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 36' ' ' ARG . . . . . . . . . . . . 0.333 45.2 ttp180 -132.61 67.54 1.53 Allowed 'General case' 0 N--CA 1.498 1.937 0 N-CA-C 104.069 -2.567 . . . . 2.0 104.069 179.484 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . -94.23 -142.75 12.66 Favored Glycine 0 CA--C 1.545 1.924 1 N-CA-C 124.788 4.675 . . . . 2.0 124.788 -179.439 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 38' ' ' CYS . . . . . 0.429 ' HB2' ' SG ' ' A' ' 3' ' ' CYS 0.275 40.3 t -129.86 131.65 46.17 Favored 'General case' 0 CA--C 1.567 1.6 0 C-N-CA 125.23 1.412 . . . . 2.0 113.588 -179.575 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 39' ' ' ILE . . . . . . . . . . . . . 4.4 tp -153.75 172.95 0.68 Allowed 'Isoleucine or valine' 0 N--CA 1.504 2.23 0 N-CA-C 115.079 1.511 . . . . 2.0 115.079 -179.72 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 40' ' ' ASP . . . . . . . . . . . . . 10.1 p-10 -84.67 -54.98 4.35 Favored 'General case' 0 N--CA 1.513 2.677 0 O-C-N 119.315 -2.116 . . . . 2.0 113.683 179.694 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 73.5 t -128.34 148.39 32.83 Favored 'Isoleucine or valine' 0 CA--C 1.564 1.51 0 N-CA-C 103.16 -2.904 . . . . 2.0 103.16 179.522 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 42' ' ' CYS . . . . . . . . . . . . . 1.0 OUTLIER -61.42 105.22 0.56 Allowed Pre-proline 0 CA--C 1.603 2.988 1 N-CA-C 99.936 -4.098 . . . . 2.0 99.936 179.456 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 43' ' ' PRO . . . . . . . . . . . . 0.257 25.9 Cg_exo -49.6 175.93 0.03 OUTLIER 'Trans proline' 0 C--N 1.372 1.77 1 N-CA-C 125.23 5.05 . . . . 2.0 125.23 -178.555 . . . . . . . . 3 2 . 1 . 010 nuclear nobuild full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 97.3 mttt -72.72 92.5 1.56 Allowed 'General case' 0 CA--C 1.569 1.684 0 N-CA-C 106.388 -1.708 . . . . 2.0 106.388 179.579 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 45' ' ' ASN . . . . . . . . . . . . . 2.6 p-10 -65.53 156.89 31.19 Favored 'General case' 0 CA--C 1.565 1.531 0 N-CA-C 116.429 2.011 . . . . 2.0 116.429 -179.607 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 11.3 t -132.44 -170.45 2.43 Favored 'General case' 0 N--CA 1.487 1.394 0 N-CA-C 113.614 0.968 . . . . 2.0 113.614 179.896 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 47' ' ' LEU . . . . . . . . . . . . 0.285 3.9 pp -58.41 -10.99 2.41 Favored 'General case' 0 N--CA 1.507 2.388 0 N-CA-C 117.125 2.268 . . . . 2.0 117.125 179.836 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 85.3 mt -104.57 -7.64 19.57 Favored 'General case' 0 CA--C 1.584 2.253 0 C-N-CA 126.281 1.833 . . . . 2.0 112.418 179.437 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 49' ' ' VAL . . . . . . . . . . . . . 8.1 p -156.17 164.33 1.27 Allowed 'Isoleucine or valine' 0 CA--C 1.579 2.085 0 N-CA-C 116.906 2.187 . . . . 2.0 116.906 -179.615 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 58.0 tttp -159.04 76.09 0.7 Allowed 'General case' 0 CA--C 1.577 2.015 0 N-CA-C 104.585 -2.376 . . . . 2.0 104.585 179.32 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 33.4 m-85 -51.76 126.04 16.73 Favored 'General case' 0 CA--C 1.571 1.755 1 N-CA-C 123.162 4.504 . . . . 2.0 123.162 -179.509 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 52' ' ' VAL . . . . . . . . . . . . 0.294 14.7 t -104.86 154.58 6.36 Favored 'Isoleucine or valine' 0 CA--C 1.581 2.143 0 N-CA-C 102.642 -3.095 . . . . 2.0 102.642 179.016 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 53' ' ' CYS . . . . . . . . . . . . . 1.3 p -153.0 159.94 42.96 Favored 'General case' 0 N--CA 1.496 1.857 0 O-C-N 117.851 -3.031 . . . . 2.0 118.277 -179.16 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 54' ' ' CYS . . . . . . . . . . . . . 27.6 p -145.23 120.66 10.32 Favored 'General case' 0 CA--C 1.574 1.879 0 C-N-CA 123.801 0.84 . . . . 2.0 110.358 179.784 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 16.0 m120 -55.18 12.26 0.0 OUTLIER 'General case' 0 N--CA 1.508 2.46 1 N-CA-C 124.719 5.081 . . . . 2.0 124.719 -179.618 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 56' ' ' THR . . . . . . . . . . . . 0.253 5.5 t -137.88 176.93 8.27 Favored 'General case' 0 N--CA 1.505 2.29 0 CA-C-N 123.078 2.672 . . . . 2.0 116.071 -179.91 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 57' ' ' ASP . . . . . . . . . . . . . 72.1 m-20 -63.68 121.11 13.16 Favored 'General case' 0 CA--C 1.567 1.633 0 N-CA-C 115.528 1.677 . . . . 2.0 115.528 -179.788 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 58' ' ' ARG . . . . . . . . . . . . 0.29 23.4 mtt180 59.65 14.76 4.21 Favored 'General case' 0 N--CA 1.503 2.203 0 N-CA-C 117.959 2.577 . . . . 2.0 117.959 -179.901 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 59' ' ' CYS . . . . . . . . . . . . . 29.3 p -68.0 -14.22 62.8 Favored 'General case' 0 N--CA 1.496 1.864 0 N-CA-C 118.349 2.722 . . . . 2.0 118.349 179.947 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 60' ' ' ASN . . . . . . . . . . . . . 32.5 p-10 . . . . . 0 CA--C 1.56 1.346 0 CA-C-O 125.216 2.436 . . . . 2.0 111.598 179.848 . . . . . . . . 0 0 . 1 . 011 nuclear nobuild full ' A' A ' 1' ' ' LEU . . . . . 0.63 HD13 ' SG ' ' A' ' 3' ' ' CYS . 0.4 OUTLIER . . . . . 0 CA--C 1.576 1.953 0 CA-C-O 122.51 1.148 . . . . 2.0 111.639 . . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 2.7 mppt? -145.0 97.74 3.06 Favored 'General case' 0 N--CA 1.486 1.371 0 N-CA-C 101.855 -3.387 . . . . 2.0 101.855 179.533 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 3' ' ' CYS . . . . . 0.63 ' SG ' HD13 ' A' ' 1' ' ' LEU . 72.6 m -105.48 -166.48 1.22 Allowed 'General case' 0 N--CA 1.49 1.562 0 N-CA-C 115.416 1.636 . . . . 2.0 115.416 -179.691 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 78.3 m-20 -126.68 121.42 32.05 Favored 'General case' 0 CA--C 1.559 1.3 0 CA-C-O 116.751 -1.595 . . . . 2.0 108.951 179.778 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 5' ' ' LYS . . . . . 0.414 ' HG2' ' H ' ' A' ' 11' ' ' SER . 0.0 OUTLIER -71.61 178.64 3.44 Favored 'General case' 0 CA--C 1.588 2.427 0 CA-C-N 123.579 2.9 . . . . 2.0 110.756 179.452 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 68.1 tp -58.41 -54.14 50.38 Favored 'General case' 0 N--CA 1.506 2.344 0 O-C-N 118.944 -2.347 . . . . 2.0 116.614 -179.768 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 7' ' ' ILE . . . . . . . . . . . . . 53.9 mt -52.21 141.71 30.31 Favored Pre-proline 0 CA--C 1.586 2.357 0 CA-C-O 117.175 -1.393 . . . . 2.0 114.515 -179.838 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 63.1 Cg_exo -39.03 -47.26 2.9 Favored 'Trans proline' 0 C--N 1.378 2.094 0 N-CA-C 120.271 3.143 . . . . 2.0 120.271 179.901 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 9' ' ' ILE . . . . . . . . . . . . . 11.3 tp -60.74 -39.55 82.08 Favored 'Isoleucine or valine' 0 N--CA 1.507 2.402 0 N-CA-C 113.932 1.086 . . . . 2.0 113.932 179.617 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . 48.55 111.34 0.0 OUTLIER 'General case' 0 CA--C 1.579 2.06 1 N-CA-C 123.97 4.804 . . . . 2.0 123.97 179.384 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 11' ' ' SER . . . . . 0.414 ' H ' ' HG2' ' A' ' 5' ' ' LYS . 98.2 p -58.05 153.45 14.57 Favored 'General case' 0 N--CA 1.501 2.082 0 C-N-CA 124.605 1.162 . . . . 2.0 114.117 179.689 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . 0.279 81.4 tttt -90.93 -93.32 0.13 Allowed 'General case' 0 CA--C 1.581 2.165 0 N-CA-C 121.493 3.886 . . . . 2.0 121.493 -179.544 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 13' ' ' THR . . . . . . . . . . . . . 33.4 m -41.91 136.81 1.95 Allowed 'General case' 0 N--CA 1.498 1.974 0 N-CA-C 120.47 3.507 . . . . 2.0 120.47 -179.567 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 4.1 t -153.19 153.75 29.92 Favored Pre-proline 0 CA--C 1.601 2.934 0 C-N-CA 124.793 1.237 . . . . 2.0 111.226 -179.959 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 15' ' ' PRO . . . . . . . . . . . . . 65.7 Cg_exo -45.27 160.36 0.14 Allowed 'Trans proline' 0 CA--C 1.579 2.741 1 N-CA-C 126.083 5.378 . . . . 2.0 126.083 -179.819 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -82.27 168.22 17.82 Favored 'General case' 0 N--CA 1.5 2.064 0 C-N-CA 125.177 1.391 . . . . 2.0 112.944 179.731 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . 82.96 -49.65 4.26 Favored Glycine 1 N--CA 1.522 4.374 0 N-CA-C 108.162 -1.975 . . . . 2.0 108.162 -179.01 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 30.1 mmtm -72.41 94.8 1.68 Allowed 'General case' 0 CA--C 1.575 1.915 0 C-N-CA 129.32 3.048 . . . . 2.0 105.898 179.354 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 10.2 p30 -94.11 -25.03 17.33 Favored 'General case' 0 N--CA 1.498 1.932 0 N-CA-C 117.212 2.301 . . . . 2.0 117.212 179.913 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 70.2 mt -84.05 111.22 19.11 Favored 'General case' 0 CA--C 1.558 1.28 0 C-N-CA 125.596 1.558 . . . . 2.0 113.617 179.968 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 21' ' ' CYS . . . . . 0.428 ' SG ' HD22 ' A' ' 1' ' ' LEU . 2.0 m -81.25 101.31 9.64 Favored 'General case' 0 CA--C 1.578 2.026 1 N-CA-C 99.621 -4.214 . . . . 2.0 99.621 179.158 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 22' ' ' TYR . . . . . . . . . . . . . 5.8 p90 -83.66 164.26 19.78 Favored 'General case' 0 N--CA 1.48 1.074 0 N-CA-C 120.843 3.646 . . . . 2.0 120.843 -179.31 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . 0.303 10.6 ptpp? -137.66 101.87 4.59 Favored 'General case' 0 CA--C 1.566 1.577 0 N-CA-C 104.389 -2.448 . . . . 2.0 104.389 179.306 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 24' ' ' MET . . . . . . . . . . . . . 4.7 ttt -65.41 92.8 0.13 Allowed 'General case' 0 CA--C 1.563 1.442 0 C-N-CA 125.149 1.38 . . . . 2.0 114.07 -179.803 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 25' ' ' PHE . . . . . . . . . . . . . 5.3 m-30 -81.61 104.14 11.82 Favored 'General case' 0 CA--C 1.568 1.636 0 N-CA-C 103.853 -2.647 . . . . 2.0 103.853 179.491 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 26' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -57.09 127.72 33.37 Favored 'General case' 0 N--CA 1.494 1.753 0 O-C-N 120.797 -1.189 . . . . 2.0 112.279 -179.809 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 27' ' ' MET . . . . . . . . . . . . . 0.1 OUTLIER -48.82 -32.74 9.24 Favored 'General case' 0 N--CA 1.509 2.496 0 N-CA-C 116.613 2.079 . . . . 2.0 116.613 -179.944 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 50.5 m -75.03 -30.61 61.13 Favored 'General case' 0 CA--C 1.592 2.594 0 O-C-N 121.512 -0.743 . . . . 2.0 112.238 179.162 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 56.5 t0 -151.04 92.2 1.79 Allowed 'General case' 0 CA--C 1.571 1.769 0 N-CA-C 105.083 -2.191 . . . . 2.0 105.083 179.687 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 3.2 mm? -65.56 -66.7 0.51 Allowed 'General case' 0 CA--C 1.571 1.769 0 N-CA-C 118.837 2.903 . . . . 2.0 118.837 -179.526 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 31' ' ' THR . . . . . . . . . . . . . 72.1 p -33.83 -48.44 0.29 Allowed 'General case' 0 N--CA 1.506 2.355 0 N-CA-C 120.457 3.503 . . . . 2.0 120.457 -179.704 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 32' ' ' ILE . . . . . . . . . . . . . 2.1 mp -93.96 107.27 26.88 Favored Pre-proline 0 CA--C 1.586 2.356 0 N-CA-C 101.606 -3.479 . . . . 2.0 101.606 179.554 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 33' ' ' PRO . . . . . . . . . . . . . 12.6 Cg_exo -68.79 149.08 72.55 Favored 'Trans proline' 0 CA--C 1.561 1.842 0 N-CA-C 118.383 2.417 . . . . 2.0 118.383 -179.602 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 34' ' ' VAL . . . . . . . . . . . . 0.283 24.5 t -86.75 -29.77 5.88 Favored 'Isoleucine or valine' 0 CA--C 1.583 2.249 0 C-N-CA 123.579 0.751 . . . . 2.0 111.543 179.421 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER -144.81 167.02 23.58 Favored 'General case' 0 CA--C 1.559 1.317 0 CA-C-O 123.602 1.668 . . . . 2.0 110.067 179.453 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 6.6 mtp180 -150.69 108.89 3.75 Favored 'General case' 0 CA--C 1.571 1.773 0 N-CA-C 104.814 -2.291 . . . . 2.0 104.814 -179.867 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . -140.97 -144.58 4.46 Favored Glycine 0 N--CA 1.498 2.824 0 N-CA-C 118.393 2.117 . . . . 2.0 118.393 -179.697 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 38' ' ' CYS . . . . . . . . . . . . . 20.8 p -130.93 131.99 44.81 Favored 'General case' 0 N--CA 1.494 1.738 0 N-CA-C 113.653 0.983 . . . . 2.0 113.653 179.99 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 39' ' ' ILE . . . . . 0.488 HG21 ' HD3' ' A' ' 43' ' ' PRO . 9.6 tp -152.85 175.83 0.58 Allowed 'Isoleucine or valine' 0 N--CA 1.498 1.969 0 C-N-CA 124.182 0.993 . . . . 2.0 112.751 -179.839 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 40' ' ' ASP . . . . . 0.428 ' H ' HG13 ' A' ' 39' ' ' ILE . 13.3 p-10 -108.02 -28.88 9.3 Favored 'General case' 0 N--CA 1.497 1.908 0 O-C-N 119.527 -1.983 . . . . 2.0 113.53 179.354 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 8.0 t -140.35 27.54 0.48 Allowed 'Isoleucine or valine' 0 N--CA 1.506 2.334 0 CA-C-N 120.134 1.334 . . . . 2.0 112.649 179.952 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 42' ' ' CYS . . . . . . . . . . . . 0.359 2.8 m 77.11 115.75 0.03 OUTLIER Pre-proline 0 CA--C 1.615 3.469 1 N-CA-C 97.03 -5.174 . . . . 2.0 97.03 -179.221 . . . . . . . . 3 2 . 1 . 011 nuclear nobuild full ' A' A ' 43' ' ' PRO . . . . . 0.488 ' HD3' HG21 ' A' ' 39' ' ' ILE 0.45 80.0 Cg_exo -30.06 -60.06 0.13 Allowed 'Trans proline' 0 C--N 1.371 1.745 1 N-CA-C 127.799 6.038 . . . . 2.0 127.799 -178.484 . . . . . . . . 4 3 . 1 . 011 nuclear nobuild full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 9.1 mtmm 160.78 91.14 0.0 OUTLIER 'General case' 0 CA--C 1.561 1.373 1 N-CA-C 98.512 -4.625 . . . . 2.0 98.512 -179.879 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 45' ' ' ASN . . . . . . . . . . . . . 4.6 p-10 -66.02 113.76 4.68 Favored 'General case' 0 CA--C 1.572 1.798 0 N-CA-C 114.759 1.392 . . . . 2.0 114.759 -179.713 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 10.8 t -113.02 -169.96 1.58 Allowed 'General case' 0 N--CA 1.492 1.669 0 N-CA-C 114.09 1.145 . . . . 2.0 114.09 -179.947 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 47' ' ' LEU . . . . . . . . . . . . . 6.7 mp -54.77 -16.33 2.5 Favored 'General case' 0 N--CA 1.509 2.492 0 N-CA-C 116.984 2.216 . . . . 2.0 116.984 179.803 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 74.6 mt -103.98 -3.49 24.59 Favored 'General case' 0 CA--C 1.578 2.046 0 C-N-CA 125.577 1.551 . . . . 2.0 112.366 179.456 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 49' ' ' VAL . . . . . . . . . . . . . 7.2 p -166.91 150.78 1.56 Allowed 'Isoleucine or valine' 0 N--CA 1.5 2.071 0 N-CA-C 118.114 2.635 . . . . 2.0 118.114 -179.645 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 55.7 tttp -134.1 111.06 10.03 Favored 'General case' 0 CA--C 1.571 1.781 1 N-CA-C 98.259 -4.719 . . . . 2.0 98.259 179.391 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 86.8 m-85 -92.3 122.31 34.65 Favored 'General case' 0 N--CA 1.497 1.917 0 N-CA-C 118.573 2.805 . . . . 2.0 118.573 -179.353 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 52' ' ' VAL . . . . . . . . . . . . . 53.3 t -92.6 106.25 17.64 Favored 'Isoleucine or valine' 0 N--CA 1.503 2.208 0 N-CA-C 102.982 -2.97 . . . . 2.0 102.982 179.522 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 53' ' ' CYS . . . . . . . . . . . . 0.261 0.7 OUTLIER -108.16 139.32 43.01 Favored 'General case' 0 CA--C 1.575 1.923 0 N-CA-C 118.988 2.958 . . . . 2.0 118.988 -179.323 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 54' ' ' CYS . . . . . . . . . . . . . 30.0 p -127.71 118.83 24.54 Favored 'General case' 0 CA--C 1.575 1.922 0 C-N-CA 124.035 0.934 . . . . 2.0 110.834 179.821 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 4.8 p-10 -57.11 37.61 0.0 OUTLIER 'General case' 0 N--CA 1.508 2.463 1 N-CA-C 124.981 5.178 . . . . 2.0 124.981 -179.584 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 6.3 t -158.55 174.33 15.24 Favored 'General case' 0 N--CA 1.503 2.21 0 O-C-N 119.326 -2.109 . . . . 2.0 114.168 179.939 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 57' ' ' ASP . . . . . . . . . . . . . 69.4 m-20 -66.94 129.56 40.28 Favored 'General case' 0 CA--C 1.571 1.782 0 O-C-N 120.325 -1.485 . . . . 2.0 114.82 179.932 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 58' ' ' ARG . . . . . . . . . . . . 0.332 40.1 mtp85 52.19 24.71 2.91 Favored 'General case' 0 N--CA 1.499 2.008 0 N-CA-C 118.726 2.862 . . . . 2.0 118.726 179.917 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 59' ' ' CYS . . . . . . . . . . . . . 29.2 p -77.37 -19.89 55.57 Favored 'General case' 0 CA--C 1.579 2.06 0 O-C-N 120.668 -1.27 . . . . 2.0 114.352 179.608 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 60' ' ' ASN . . . . . . . . . . . . . 34.9 p-10 . . . . . 0 CA--C 1.563 1.473 0 CA-C-O 124.392 2.044 . . . . 2.0 113.525 179.881 . . . . . . . . 0 0 . 1 stop_ save_