data_1cdn_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 1cdn _Structure_validation_residue.Date_analyzed 2016-10-06 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 ' 3' ' ' PRO . . . . . . . . . . . . . 95.4 Cg_exo . . . . . 0 N--CA 1.458 -0.614 0 N-CA-C 112.657 0.214 . . . . 0.0 112.657 . . . . . . . . . 0 0 . 1 . 001 nuclear orig core ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 2.9 mp0 -60.38 -48.74 80.47 Favored 'General case' 0 N--CA 1.455 -0.216 0 C-N-CA 124.005 0.922 . . . . 0.0 112.04 176.114 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 32.8 mt-10 -62.18 -44.41 96.66 Favored 'General case' 0 N--CA 1.453 -0.282 0 N-CA-C 109.19 -0.67 . . . . 0.0 109.19 177.802 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 40.9 mt -60.48 -38.01 82.88 Favored 'General case' 0 N--CA 1.449 -0.504 0 C-N-CA 123.455 0.702 . . . . 0.0 111.869 177.648 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 20.8 tptm -60.62 -49.72 76.39 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 118.442 0.564 . . . . 0.0 110.221 170.635 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . -50.84 -50.1 39.1 Favored Glycine 0 CA--C 1.531 1.061 0 N-CA-C 110.63 -0.988 . . . . 0.0 110.63 177.176 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 9' ' ' ILE . . . . . . . . . . . . . 19.5 mm -58.98 -54.76 29.63 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.235 0 C-N-CA 125.826 1.65 . . . . 0.0 109.958 176.904 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 10' ' ' PHE . . . . . . . . . . . . . 32.3 t80 -47.66 -52.78 16.97 Favored 'General case' 0 N--CA 1.451 -0.419 0 O-C-N 121.605 -0.685 . . . . 0.0 109.703 177.762 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 52.9 mt-10 -60.02 -51.19 70.71 Favored 'General case' 0 N--CA 1.453 -0.318 0 C-N-CA 123.668 0.787 . . . . 0.0 110.359 -179.578 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 58.4 tttt -44.27 -59.91 2.16 Favored 'General case' 0 C--N 1.339 0.115 0 C-N-CA 124.126 0.97 . . . . 0.0 110.214 175.913 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 63.0 m-85 -75.42 -38.73 59.63 Favored 'General case' 0 N--CA 1.452 -0.345 0 C-N-CA 120.449 -0.5 . . . . 0.0 110.88 -169.124 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -57.24 -58.85 6.44 Favored 'General case' 0 C--O 1.237 0.411 0 CA-C-O 122.013 0.911 . . . . 0.0 110.015 174.939 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.454 -0.267 0 C-N-CA 124.282 1.033 . . . . 0.0 111.441 178.972 . . . . . . . . 0 0 . 1 . 001 nuclear orig core ' A' A ' 20' ' ' PRO . . . . . . . . . . . . . 72.2 Cg_endo . . . . . 0 N--CA 1.455 -0.793 0 N-CA-C 112.781 0.262 . . . . 0.0 112.781 . . . . . . . . . 0 0 . 1 . 001 nuclear orig core ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 92.9 m-20 -97.69 -15.15 20.51 Favored 'General case' 0 N--CA 1.454 -0.242 0 C-N-CA 124.464 1.106 . . . . 0.0 113.325 -166.772 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 7.1 tp60 -138.67 127.23 23.27 Favored 'General case' 0 CA--C 1.537 0.443 0 C-N-CA 123.725 0.81 . . . . 0.0 109.992 -168.307 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 74.8 mt -95.07 129.32 42.21 Favored 'General case' 0 CA--C 1.531 0.241 0 C-N-CA 124.301 1.041 . . . . 0.0 110.782 178.666 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 1.5 p -79.16 176.02 10.06 Favored 'General case' 0 C--O 1.238 0.472 0 N-CA-C 108.301 -1.0 . . . . 0.0 108.301 167.103 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 58.1 mttp -54.24 -38.77 66.14 Favored 'General case' 0 N--CA 1.451 -0.39 0 CA-C-O 119.352 -0.356 . . . . 0.0 110.902 175.162 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 31.3 mm-40 -71.42 -47.4 56.21 Favored 'General case' 0 CA--C 1.518 -0.26 0 CA-C-N 118.436 0.562 . . . . 0.0 110.557 -171.243 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 2.2 mp0 -53.97 -48.96 69.81 Favored 'General case' 0 N--CA 1.451 -0.418 0 CA-C-N 115.87 -0.605 . . . . 0.0 109.549 172.368 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 13.1 mt -56.97 -43.52 81.71 Favored 'General case' 0 C--O 1.218 -0.554 0 C-N-CA 120.023 -0.671 . . . . 0.0 112.304 174.59 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 37.6 ttpt -61.67 -47.86 83.44 Favored 'General case' 0 C--N 1.32 -0.702 0 CA-C-N 118.5 0.591 . . . . 0.0 110.121 -176.641 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 11.8 tp -65.56 -43.8 88.76 Favored 'General case' 0 CA--C 1.533 0.326 0 CA-C-O 120.609 0.242 . . . . 0.0 110.877 179.823 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 7.1 tt -50.73 -58.71 5.25 Favored 'General case' 0 CA--C 1.522 -0.119 0 C-N-CA 124.146 0.979 . . . . 0.0 109.549 173.521 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 31.0 mt -58.93 -52.73 64.52 Favored 'General case' 0 C--O 1.219 -0.501 0 N-CA-C 108.782 -0.821 . . . . 0.0 108.782 -177.882 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 22.9 tt0 -49.5 -45.62 47.28 Favored 'General case' 0 C--N 1.332 -0.194 0 O-C-N 121.37 -0.831 . . . . 0.0 111.775 179.25 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 7.9 m -74.09 -54.74 7.18 Favored 'General case' 0 CA--C 1.533 0.325 0 CA-C-O 120.61 0.243 . . . . 0.0 111.612 -177.81 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 29.5 mm-40 -91.98 -33.4 14.86 Favored 'General case' 0 N--CA 1.452 -0.339 0 C-N-CA 124.008 0.923 . . . . 0.0 113.138 -166.36 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 79.6 m-85 . . . . . 0 CA--C 1.536 0.439 0 C-N-CA 124.98 1.312 . . . . 0.0 111.525 -171.912 . . . . . . . . 0 0 . 1 . 001 nuclear orig core ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 48.3 tp . . . . . 0 CA--C 1.519 -0.242 0 N-CA-C 112.842 0.682 . . . . 0.0 112.842 . . . . . . . . . 0 0 . 1 . 001 nuclear orig core ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 7.4 m-20 -64.07 -43.38 95.64 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-N 115.843 -0.617 . . . . 0.0 111.1 -174.898 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 29.7 mm-40 -71.14 -42.24 69.42 Favored 'General case' 0 N--CA 1.45 -0.45 0 N-CA-C 109.263 -0.643 . . . . 0.0 109.263 177.219 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 56.5 tp -53.96 -47.64 71.13 Favored 'General case' 0 N--CA 1.452 -0.367 0 N-CA-C 109.539 -0.541 . . . . 0.0 109.539 177.448 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 50' ' ' PHE . . . . . . . . . . . . . 82.9 t80 -51.69 -53.73 35.93 Favored 'General case' 0 N--CA 1.454 -0.266 0 C-N-CA 123.657 0.783 . . . . 0.0 110.614 177.987 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 72.2 mm-40 -56.06 -49.12 74.64 Favored 'General case' 0 CA--C 1.532 0.283 0 CA-C-O 120.605 0.24 . . . . 0.0 110.968 177.429 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 50.2 mm-40 -57.73 -40.99 80.92 Favored 'General case' 0 CA--C 1.531 0.219 0 C-N-CA 122.779 0.432 . . . . 0.0 112.138 179.801 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 62.2 mt -71.44 -41.15 69.83 Favored 'General case' 0 N--CA 1.45 -0.464 0 C-N-CA 122.857 0.463 . . . . 0.0 111.011 179.16 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 19.6 t70 . . . . . 0 CA--C 1.541 0.621 0 C-N-CA 125.966 1.707 . . . . 0.0 112.136 -178.386 . . . . . . . . 0 0 . 1 . 001 nuclear orig core ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 56.5 mt-10 . . . . . 0 N--CA 1.452 -0.345 0 N-CA-C 109.42 -0.585 . . . . 0.0 109.42 . . . . . . . . . 0 0 . 1 . 001 nuclear orig core ' A' A ' 61' ' ' VAL . . . . . . . . . . . . . 3.7 t -103.91 120.94 54.81 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.422 0 C-N-CA 123.332 0.653 . . . . 0.0 111.354 -167.183 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 95.1 p -77.45 163.7 26.11 Favored 'General case' 0 N--CA 1.463 0.195 0 C-N-CA 123.196 0.598 . . . . 0.0 110.492 174.931 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 63' ' ' PHE . . . . . . . . . . . . . 68.9 t80 -59.38 -32.99 70.65 Favored 'General case' 0 CA--C 1.528 0.133 0 O-C-N 122.032 -0.418 . . . . 0.0 111.879 176.091 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 39.2 mm-40 -66.97 -59.1 3.78 Favored 'General case' 0 N--CA 1.446 -0.639 0 N-CA-C 109.363 -0.606 . . . . 0.0 109.363 -179.437 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 8.3 pt-20 -66.91 -29.58 69.49 Favored 'General case' 0 CA--C 1.54 0.578 0 O-C-N 121.5 -0.75 . . . . 0.0 111.313 -177.656 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 13.3 t80 -50.63 -28.53 9.01 Favored 'General case' 0 CA--C 1.536 0.417 0 C-N-CA 123.825 0.85 . . . . 0.0 111.891 168.779 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 67' ' ' GLN . . . . . . . . . . . . . 80.5 mm-40 -55.32 -23.32 23.08 Favored 'General case' 0 CA--C 1.535 0.401 0 CA-C-N 119.696 1.135 . . . . 0.0 112.962 174.668 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 88.4 t -55.25 -32.38 28.42 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.526 0 CA-C-N 119.472 1.033 . . . . 0.0 110.765 171.701 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 37.2 tp -71.33 -47.72 54.81 Favored 'General case' 0 N--CA 1.454 -0.257 0 N-CA-C 107.159 -1.423 . . . . 0.0 107.159 179.47 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 70' ' ' VAL . . . . . . . . . . . . . 18.5 t . . . . . 0 CA--C 1.534 0.348 0 C-N-CA 122.88 0.472 . . . . 0.0 110.142 -179.983 . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 86.9 Cg_exo . . . . . 0 N--CA 1.457 -0.664 0 CA-C-O 120.429 0.095 . . . . 0.0 112.338 . . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 40.3 tt0 -61.11 -49.37 77.56 Favored 'General case' 0 CA--C 1.529 0.17 0 C-N-CA 123.389 0.676 . . . . 0.0 111.103 177.534 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 29.7 mt-10 -60.75 -45.63 93.54 Favored 'General case' 0 N--CA 1.454 -0.272 0 N-CA-C 109.009 -0.738 . . . . 0.0 109.009 177.943 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 19.9 mt -58.41 -40.19 81.8 Favored 'General case' 0 N--CA 1.447 -0.611 0 C-N-CA 123.755 0.822 . . . . 0.0 111.192 179.142 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 21.4 tptm -60.12 -53.05 62.36 Favored 'General case' 0 C--N 1.333 -0.131 0 CA-C-N 118.798 0.726 . . . . 0.0 110.898 171.054 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . -50.5 -52.2 29.55 Favored Glycine 0 CA--C 1.533 1.192 0 N-CA-C 111.269 -0.732 . . . . 0.0 111.269 179.15 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 9' ' ' ILE . . . . . . . . . . . . . 2.4 mm -56.04 -55.04 20.43 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.305 0 C-N-CA 126.475 1.91 . . . . 0.0 108.944 175.818 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 10' ' ' PHE . . . . . . . . . . . . . 38.6 t80 -49.1 -49.89 39.63 Favored 'General case' 0 N--CA 1.448 -0.534 0 O-C-N 121.725 -0.609 . . . . 0.0 109.846 179.797 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 51.0 mt-10 -62.05 -50.99 69.77 Favored 'General case' 0 N--CA 1.455 -0.197 0 C-N-CA 123.081 0.553 . . . . 0.0 110.567 179.417 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 68.9 tttt -44.52 -51.62 8.7 Favored 'General case' 0 CA--C 1.53 0.21 0 C-N-CA 124.341 1.057 . . . . 0.0 110.9 177.167 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 63.1 m-85 -78.4 -46.31 20.21 Favored 'General case' 0 CA--C 1.53 0.206 0 O-C-N 122.341 -0.224 . . . . 0.0 111.296 -176.403 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -57.23 -42.35 81.26 Favored 'General case' 0 C--N 1.329 -0.318 0 O-C-N 121.384 -0.823 . . . . 0.0 111.659 -178.427 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.533 0.308 0 C-N-CA 123.603 0.761 . . . . 0.0 111.921 173.772 . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' A' A ' 20' ' ' PRO . . . . . . . . . . . . . 36.4 Cg_endo . . . . . 0 N--CA 1.457 -0.62 0 N-CA-C 112.63 0.204 . . . . 0.0 112.63 . . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 48.5 m-80 -85.06 -1.16 56.52 Favored 'General case' 0 N--CA 1.453 -0.288 0 C-N-CA 124.481 1.112 . . . . 0.0 113.137 -173.17 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 23.6 tt0 -151.27 124.99 9.05 Favored 'General case' 0 CA--C 1.542 0.637 0 CA-C-N 119.749 1.159 . . . . 0.0 113.887 -169.271 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 82.7 mt -98.82 138.11 36.44 Favored 'General case' 0 C--N 1.345 0.386 0 C-N-CA 125.296 1.438 . . . . 0.0 111.632 178.376 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 88.9 p -80.69 174.17 11.88 Favored 'General case' 0 CA--C 1.532 0.283 0 C-N-CA 123.466 0.706 . . . . 0.0 109.734 168.3 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 7.6 mtpm? -56.92 -44.28 82.26 Favored 'General case' 0 C--O 1.226 -0.173 0 N-CA-C 109.721 -0.474 . . . . 0.0 109.721 171.352 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 1.8 mp0 -63.09 -51.95 64.61 Favored 'General case' 0 N--CA 1.451 -0.424 0 C-N-CA 123.285 0.634 . . . . 0.0 110.259 -176.861 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -57.67 -41.77 82.23 Favored 'General case' 0 N--CA 1.451 -0.401 0 CA-C-O 118.564 -0.731 . . . . 0.0 110.422 176.687 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 14.3 mt -57.79 -43.66 85.74 Favored 'General case' 0 CA--C 1.513 -0.446 0 CA-C-N 119.614 1.097 . . . . 0.0 113.126 169.744 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 21.0 ttmm -61.11 -49.36 77.61 Favored 'General case' 0 N--CA 1.449 -0.497 0 CA-C-N 118.773 0.715 . . . . 0.0 109.857 -178.163 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 95.9 mt -62.02 -45.49 93.35 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.39 -0.368 . . . . 0.0 111.169 179.156 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 7.6 tt -50.84 -57.85 7.42 Favored 'General case' 0 C--O 1.232 0.132 0 C-N-CA 124.098 0.959 . . . . 0.0 109.405 173.668 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 40.7 mt -55.56 -58.01 9.53 Favored 'General case' 0 N--CA 1.455 -0.179 0 N-CA-C 109.637 -0.505 . . . . 0.0 109.637 -178.794 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 22.8 tt0 -53.07 -50.45 64.35 Favored 'General case' 0 N--CA 1.452 -0.349 0 C-N-CA 124.202 1.001 . . . . 0.0 111.674 -176.012 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 15.0 m -74.48 -49.97 20.11 Favored 'General case' 0 N--CA 1.453 -0.303 0 CA-C-N 116.34 -0.391 . . . . 0.0 110.898 -173.017 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 73.2 mm-40 -94.58 -32.5 13.41 Favored 'General case' 0 N--CA 1.448 -0.554 0 N-CA-C 112.685 0.624 . . . . 0.0 112.685 -167.06 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 81.6 m-85 . . . . . 0 CA--C 1.538 0.494 0 C-N-CA 123.49 0.716 . . . . 0.0 112.443 -173.919 . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 57.3 tp . . . . . 0 C--O 1.223 -0.305 0 N-CA-C 109.936 -0.394 . . . . 0.0 109.936 . . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 5.6 m-20 -58.96 -52.62 64.98 Favored 'General case' 0 N--CA 1.449 -0.524 0 C-N-CA 123.734 0.814 . . . . 0.0 111.027 179.781 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 33.8 mt-10 -59.37 -45.59 91.0 Favored 'General case' 0 N--CA 1.455 -0.18 0 CA-C-N 116.618 -0.265 . . . . 0.0 111.125 177.88 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 59.7 mt -54.9 -54.72 38.98 Favored 'General case' 0 C--O 1.224 -0.238 0 N-CA-C 109.636 -0.505 . . . . 0.0 109.636 174.802 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 50' ' ' PHE . . . . . . . . . . . . . 80.4 t80 -52.43 -49.92 63.6 Favored 'General case' 0 N--CA 1.449 -0.475 0 C-N-CA 123.965 0.906 . . . . 0.0 110.36 -177.527 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 27.7 tp10 -58.72 -48.34 81.5 Favored 'General case' 0 N--CA 1.454 -0.268 0 CA-C-O 120.755 0.312 . . . . 0.0 110.83 177.143 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 42.8 tt0 -56.68 -39.71 74.28 Favored 'General case' 0 CA--C 1.53 0.174 0 C-N-CA 123.631 0.772 . . . . 0.0 111.156 179.598 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 38.1 mt -78.71 -43.99 24.56 Favored 'General case' 0 N--CA 1.448 -0.56 0 C-N-CA 122.952 0.501 . . . . 0.0 112.114 -178.636 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 53.1 t0 . . . . . 0 CA--C 1.538 0.493 0 C-N-CA 125.101 1.361 . . . . 0.0 111.361 -177.356 . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 31.5 mt-10 . . . . . 0 N--CA 1.452 -0.331 0 N-CA-C 104.944 -2.243 . . . . 0.0 104.944 . . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' A' A ' 61' ' ' VAL . . . . . . . . . . . . . 5.1 t -117.02 115.2 48.14 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.193 0 N-CA-C 109.685 -0.487 . . . . 0.0 109.685 -178.599 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 12.6 t -84.89 164.31 18.46 Favored 'General case' 0 CA--C 1.537 0.465 0 C-N-CA 122.65 0.38 . . . . 0.0 111.572 173.537 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 63' ' ' PHE . . . . . . . . . . . . . 64.4 t80 -62.01 -39.63 92.89 Favored 'General case' 0 N--CA 1.464 0.238 0 N-CA-C 112.65 0.611 . . . . 0.0 112.65 -170.044 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 50.9 mt-10 -62.33 -57.09 12.61 Favored 'General case' 0 N--CA 1.453 -0.292 0 N-CA-C 109.639 -0.504 . . . . 0.0 109.639 -178.471 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 20.3 pt-20 -64.28 -34.33 77.88 Favored 'General case' 0 CA--C 1.539 0.547 0 O-C-N 121.639 -0.663 . . . . 0.0 111.425 -179.692 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 17.8 t80 -52.03 -25.4 8.43 Favored 'General case' 0 CA--C 1.538 0.493 0 C-N-CA 123.828 0.851 . . . . 0.0 112.237 169.357 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 67' ' ' GLN . . . . . . . . . . . . . 45.6 mm-40 -54.64 -23.78 18.7 Favored 'General case' 0 CA--C 1.537 0.459 0 CA-C-N 119.745 1.157 . . . . 0.0 113.197 172.473 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 83.0 t -53.96 -33.16 23.55 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.485 0 CA-C-N 119.162 0.892 . . . . 0.0 110.817 170.469 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 19.3 tp -75.47 -53.11 9.2 Favored 'General case' 0 N--CA 1.452 -0.345 0 N-CA-C 108.134 -1.061 . . . . 0.0 108.134 173.163 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 70' ' ' VAL . . . . . . . . . . . . . 58.1 t . . . . . 0 CA--C 1.534 0.352 0 CA-C-N 118.324 0.511 . . . . 0.0 111.74 -175.295 . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 85.8 Cg_exo . . . . . 0 N--CA 1.455 -0.78 0 CA-C-O 120.347 0.061 . . . . 0.0 112.015 . . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 2.8 mp0 -61.3 -47.07 87.64 Favored 'General case' 0 N--CA 1.455 -0.175 0 C-N-CA 123.841 0.857 . . . . 0.0 111.942 176.607 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -62.88 -44.23 96.67 Favored 'General case' 0 C--N 1.331 -0.215 0 N-CA-C 108.974 -0.75 . . . . 0.0 108.974 178.108 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 12.8 mt -59.43 -40.58 87.2 Favored 'General case' 0 N--CA 1.449 -0.501 0 C-N-CA 122.646 0.379 . . . . 0.0 111.844 177.047 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 51.7 tptt -58.62 -47.11 85.46 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 118.414 0.552 . . . . 0.0 110.307 170.167 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . -52.89 -54.65 27.47 Favored Glycine 0 CA--C 1.53 0.989 0 N-CA-C 110.744 -0.943 . . . . 0.0 110.744 179.648 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 9' ' ' ILE . . . . . . . . . . . . . 65.9 mt -51.12 -58.14 2.25 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.13 0 C-N-CA 125.407 1.483 . . . . 0.0 109.523 171.639 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 10' ' ' PHE . . . . . . . . . . . . . 23.7 t80 -49.91 -48.11 51.84 Favored 'General case' 0 N--CA 1.442 -0.826 0 O-C-N 122.006 -0.434 . . . . 0.0 110.07 -175.883 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 55.3 mt-10 -64.88 -50.24 67.34 Favored 'General case' 0 N--CA 1.452 -0.33 0 C-N-CA 123.483 0.713 . . . . 0.0 110.636 179.118 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 21.8 ttpt -43.55 -50.37 7.22 Favored 'General case' 0 N--CA 1.461 0.114 0 C-N-CA 124.161 0.984 . . . . 0.0 110.384 175.422 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 59.6 m-85 -78.73 -44.97 22.24 Favored 'General case' 0 N--CA 1.449 -0.475 0 CA-C-N 116.47 -0.332 . . . . 0.0 111.862 -175.137 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -67.52 -35.04 78.34 Favored 'General case' 0 N--CA 1.466 0.342 0 C-N-CA 125.139 1.376 . . . . 0.0 113.24 -176.545 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.452 -0.373 0 C-N-CA 123.039 0.536 . . . . 0.0 111.455 -178.956 . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' A' A ' 20' ' ' PRO . . . . . . . . . . . . . 26.4 Cg_endo . . . . . 0 N--CA 1.456 -0.723 0 N-CA-C 112.66 0.215 . . . . 0.0 112.66 . . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 38.8 m-80 -87.56 -7.18 57.87 Favored 'General case' 0 N--CA 1.453 -0.316 0 C-N-CA 124.831 1.253 . . . . 0.0 112.962 -175.521 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 9.9 tt0 -144.89 125.1 13.71 Favored 'General case' 0 CA--C 1.539 0.523 0 CA-C-N 119.294 0.952 . . . . 0.0 113.256 -171.942 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 52.1 mt -96.07 142.98 27.62 Favored 'General case' 0 C--N 1.343 0.284 0 C-N-CA 124.8 1.24 . . . . 0.0 111.423 179.349 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 93.2 p -92.35 174.61 7.2 Favored 'General case' 0 CA--C 1.538 0.512 0 C-N-CA 124.091 0.956 . . . . 0.0 108.974 167.029 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 97.6 mttt -54.6 -49.4 70.51 Favored 'General case' 0 C--N 1.339 0.135 0 O-C-N 121.895 -0.503 . . . . 0.0 111.49 -179.173 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 24.2 mt-10 -63.73 -43.51 96.31 Favored 'General case' 0 CA--C 1.519 -0.215 0 CA-C-O 121.234 0.54 . . . . 0.0 110.414 -175.105 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 57.6 mt-10 -58.22 -47.55 83.14 Favored 'General case' 0 N--CA 1.45 -0.426 0 CA-C-N 115.929 -0.578 . . . . 0.0 109.709 176.149 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 11.4 mt -56.8 -41.3 77.51 Favored 'General case' 0 CA--C 1.511 -0.545 0 N-CA-C 112.932 0.716 . . . . 0.0 112.932 171.683 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 84.8 tttt -61.5 -49.74 75.53 Favored 'General case' 0 C--N 1.324 -0.515 0 CA-C-N 118.747 0.703 . . . . 0.0 109.604 -178.37 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 10.4 mp -60.15 -46.89 88.13 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.394 -0.366 . . . . 0.0 111.101 177.847 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 7.5 tt -51.9 -57.27 9.89 Favored 'General case' 0 C--N 1.333 -0.12 0 C-N-CA 123.652 0.781 . . . . 0.0 109.682 175.366 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 43.2 mt -55.44 -53.61 54.15 Favored 'General case' 0 N--CA 1.454 -0.252 0 C-N-CA 123.994 0.918 . . . . 0.0 109.246 -178.522 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 22.7 tt0 -55.21 -46.48 75.91 Favored 'General case' 0 N--CA 1.451 -0.386 0 C-N-CA 123.665 0.786 . . . . 0.0 111.629 -177.508 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 5.3 m -73.96 -53.11 10.8 Favored 'General case' 0 CA--C 1.532 0.258 0 C-N-CA 120.916 -0.314 . . . . 0.0 111.03 -176.307 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 79.4 mm-40 -91.82 -39.05 11.98 Favored 'General case' 0 N--CA 1.45 -0.442 0 C-N-CA 123.762 0.825 . . . . 0.0 112.751 -166.953 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 17.7 m-85 . . . . . 0 CA--C 1.539 0.541 0 N-CA-C 113.22 0.822 . . . . 0.0 113.22 -169.132 . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 52.6 tp . . . . . 0 N--CA 1.457 -0.115 0 N-CA-C 109.375 -0.602 . . . . 0.0 109.375 . . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 5.0 m-20 -55.78 -52.56 63.54 Favored 'General case' 0 N--CA 1.449 -0.495 0 C-N-CA 124.575 1.15 . . . . 0.0 110.602 177.805 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 4.0 tm-20 -53.49 -52.27 60.1 Favored 'General case' 0 C--N 1.331 -0.218 0 C-N-CA 122.512 0.325 . . . . 0.0 110.784 176.22 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 95.6 mt -55.18 -49.53 71.63 Favored 'General case' 0 CA--C 1.529 0.169 0 CA-C-O 121.282 0.563 . . . . 0.0 110.305 178.671 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 50' ' ' PHE . . . . . . . . . . . . . 62.4 t80 -55.49 -50.67 69.3 Favored 'General case' 0 N--CA 1.45 -0.426 0 C-N-CA 123.827 0.851 . . . . 0.0 110.828 -179.115 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 36.0 mt-10 -59.3 -45.93 89.94 Favored 'General case' 0 N--CA 1.454 -0.234 0 C-N-CA 123.289 0.636 . . . . 0.0 110.547 177.994 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 12.5 tm-20 -56.25 -46.16 79.73 Favored 'General case' 0 N--CA 1.456 -0.172 0 C-N-CA 123.358 0.663 . . . . 0.0 110.072 178.708 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 91.6 mt -72.6 -43.34 63.44 Favored 'General case' 0 N--CA 1.45 -0.435 0 C-N-CA 123.021 0.528 . . . . 0.0 112.04 -176.58 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 47.4 t0 . . . . . 0 CA--C 1.537 0.459 0 C-N-CA 124.206 1.002 . . . . 0.0 112.206 -172.616 . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 30.3 mt-10 . . . . . 0 CA--C 1.528 0.129 0 N-CA-C 105.924 -1.88 . . . . 0.0 105.924 . . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' A' A ' 61' ' ' VAL . . . . . . . . . . . . . 3.5 t -123.57 115.36 45.07 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.183 0 N-CA-C 109.373 -0.603 . . . . 0.0 109.373 179.582 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 62.4 p -77.95 156.96 29.92 Favored 'General case' 0 CA--C 1.532 0.267 0 C-N-CA 123.515 0.726 . . . . 0.0 110.395 177.794 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 63' ' ' PHE . . . . . . . . . . . . . 71.4 t80 -55.11 -34.97 64.15 Favored 'General case' 0 N--CA 1.463 0.207 0 N-CA-C 112.318 0.488 . . . . 0.0 112.318 178.042 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 45.8 mt-10 -58.1 -67.56 0.33 Allowed 'General case' 0 N--CA 1.452 -0.339 0 N-CA-C 109.903 -0.406 . . . . 0.0 109.903 176.78 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 9.8 pt-20 -65.24 -28.55 69.44 Favored 'General case' 0 CA--C 1.534 0.348 0 O-C-N 121.842 -0.536 . . . . 0.0 111.669 -175.015 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 8.2 t80 -49.15 -29.88 5.98 Favored 'General case' 0 CA--C 1.532 0.276 0 C-N-CA 123.391 0.677 . . . . 0.0 112.283 169.102 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 67' ' ' GLN . . . . . . . . . . . . . 97.8 mm-40 -56.86 -19.93 20.25 Favored 'General case' 0 CA--C 1.54 0.571 0 CA-C-N 119.661 1.119 . . . . 0.0 112.933 175.993 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 69.8 t -56.97 -34.29 44.23 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.552 0 CA-C-N 119.61 1.095 . . . . 0.0 110.878 169.472 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 9.4 tt -70.9 -44.36 66.42 Favored 'General case' 0 N--CA 1.456 -0.147 0 N-CA-C 107.179 -1.415 . . . . 0.0 107.179 -179.675 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 70' ' ' VAL . . . . . . . . . . . . . 22.2 t . . . . . 0 N--CA 1.452 -0.371 0 N-CA-C 109.913 -0.403 . . . . 0.0 109.913 176.879 . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 99.2 Cg_exo . . . . . 0 N--CA 1.458 -0.58 0 CA-C-O 120.602 0.167 . . . . 0.0 112.463 . . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 2.9 mp0 -58.59 -50.33 74.2 Favored 'General case' 0 N--CA 1.454 -0.246 0 C-N-CA 123.762 0.825 . . . . 0.0 111.971 176.473 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 31.9 mt-10 -60.35 -45.57 93.02 Favored 'General case' 0 C--N 1.332 -0.183 0 N-CA-C 109.101 -0.703 . . . . 0.0 109.101 178.254 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 20.2 mt -59.45 -38.03 79.67 Favored 'General case' 0 N--CA 1.446 -0.651 0 C-N-CA 122.841 0.457 . . . . 0.0 111.998 178.116 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 78.3 tttt -64.55 -44.48 90.62 Favored 'General case' 0 N--CA 1.449 -0.504 0 CA-C-N 118.292 0.496 . . . . 0.0 110.664 172.769 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . -54.55 -51.71 50.18 Favored Glycine 0 CA--C 1.529 0.966 0 N-CA-C 109.893 -1.283 . . . . 0.0 109.893 177.709 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 9' ' ' ILE . . . . . . . . . . . . . 63.1 mt -53.84 -56.79 7.46 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.23 0 C-N-CA 125.935 1.694 . . . . 0.0 110.055 173.245 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 10' ' ' PHE . . . . . . . . . . . . . 51.9 t80 -45.97 -53.43 10.01 Favored 'General case' 0 N--CA 1.451 -0.414 0 C-N-CA 123.169 0.588 . . . . 0.0 109.843 179.019 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 44.3 mt-10 -62.8 -51.92 65.21 Favored 'General case' 0 CA--C 1.532 0.265 0 C-N-CA 122.756 0.423 . . . . 0.0 110.731 -178.591 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 26.4 ttpt -45.8 -53.72 9.16 Favored 'General case' 0 C--N 1.338 0.102 0 C-N-CA 125.15 1.38 . . . . 0.0 111.077 178.186 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 57.0 m-85 -77.28 -44.36 30.03 Favored 'General case' 0 N--CA 1.45 -0.44 0 N-CA-C 110.107 -0.331 . . . . 0.0 110.107 -175.456 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -52.99 -45.92 68.07 Favored 'General case' 0 C--O 1.225 -0.204 0 C-N-CA 123.652 0.781 . . . . 0.0 111.897 178.956 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.331 -0.21 0 N-CA-C 113.007 0.743 . . . . 0.0 113.007 178.075 . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' A' A ' 20' ' ' PRO . . . . . . . . . . . . . 19.2 Cg_endo . . . . . 0 CA--C 1.535 0.567 0 N-CA-C 113.988 0.726 . . . . 0.0 113.988 . . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 44.8 m-80 -85.0 -7.59 59.08 Favored 'General case' 0 N--CA 1.453 -0.289 0 C-N-CA 123.779 0.832 . . . . 0.0 112.877 -178.523 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 11.4 tt0 -156.87 117.63 3.64 Favored 'General case' 0 CA--C 1.538 0.482 0 CA-C-N 119.648 1.113 . . . . 0.0 112.903 -169.017 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 19.2 mt -79.66 136.31 36.77 Favored 'General case' 0 C--O 1.234 0.278 0 C-N-CA 124.566 1.146 . . . . 0.0 110.918 179.43 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 12.4 p -97.42 -179.62 4.55 Favored 'General case' 0 CA--C 1.54 0.583 0 N-CA-C 107.322 -1.362 . . . . 0.0 107.322 164.796 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 62.4 mttp -55.14 -47.11 75.55 Favored 'General case' 0 C--O 1.226 -0.135 0 O-C-N 121.941 -0.475 . . . . 0.0 112.157 -173.097 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 34.4 tt0 -64.09 -46.3 84.88 Favored 'General case' 0 N--CA 1.456 -0.173 0 CA-C-N 118.16 0.436 . . . . 0.0 110.62 -174.54 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 2.6 mp0 -54.7 -49.93 69.52 Favored 'General case' 0 N--CA 1.451 -0.414 0 N-CA-C 109.578 -0.527 . . . . 0.0 109.578 175.214 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 9.6 mt -55.88 -43.74 77.48 Favored 'General case' 0 CA--C 1.51 -0.573 0 N-CA-C 113.266 0.839 . . . . 0.0 113.266 173.473 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 84.8 tttt -62.45 -48.54 79.21 Favored 'General case' 0 C--N 1.323 -0.567 0 CA-C-N 118.512 0.596 . . . . 0.0 109.769 -175.858 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 81.5 mt -62.44 -47.51 83.75 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.875 178.905 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 6.7 tt -49.5 -58.22 5.59 Favored 'General case' 0 CA--C 1.522 -0.12 0 C-N-CA 123.979 0.912 . . . . 0.0 109.264 174.023 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 39.9 mt -56.68 -57.99 10.01 Favored 'General case' 0 N--CA 1.451 -0.4 0 C-N-CA 123.533 0.733 . . . . 0.0 109.281 -177.404 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 7.0 tp-100 -52.2 -49.7 63.38 Favored 'General case' 0 N--CA 1.455 -0.206 0 C-N-CA 123.04 0.536 . . . . 0.0 111.161 -176.343 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 11.4 m -75.74 -49.38 18.37 Favored 'General case' 0 N--CA 1.454 -0.258 0 CA-C-N 116.223 -0.444 . . . . 0.0 111.069 -171.574 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 70.4 mm-40 -89.67 -29.25 18.92 Favored 'General case' 0 N--CA 1.45 -0.458 0 C-N-CA 123.362 0.665 . . . . 0.0 111.771 -169.465 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 94.1 m-85 . . . . . 0 CA--C 1.537 0.443 0 C-N-CA 124.425 1.09 . . . . 0.0 111.63 -174.66 . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 66.6 tp . . . . . 0 C--O 1.224 -0.246 0 N-CA-C 111.714 0.265 . . . . 0.0 111.714 . . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 5.3 m-20 -60.6 -46.11 91.46 Favored 'General case' 0 N--CA 1.451 -0.4 0 C-N-CA 123.339 0.656 . . . . 0.0 111.542 179.803 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 93.0 mt-10 -59.64 -52.12 66.91 Favored 'General case' 0 N--CA 1.455 -0.181 0 N-CA-C 109.557 -0.535 . . . . 0.0 109.557 177.383 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 46.9 tp -58.47 -46.39 86.71 Favored 'General case' 0 N--CA 1.452 -0.364 0 N-CA-C 109.416 -0.587 . . . . 0.0 109.416 -178.147 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 50' ' ' PHE . . . . . . . . . . . . . 71.2 t80 -54.6 -50.11 68.83 Favored 'General case' 0 N--CA 1.449 -0.497 0 C-N-CA 123.934 0.894 . . . . 0.0 110.249 177.281 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 41.2 tt0 -57.35 -49.84 74.88 Favored 'General case' 0 N--CA 1.453 -0.279 0 C-N-CA 122.275 0.23 . . . . 0.0 110.761 177.411 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 39.9 mt-10 -55.18 -44.57 75.36 Favored 'General case' 0 CA--C 1.53 0.196 0 C-N-CA 123.141 0.576 . . . . 0.0 111.458 178.931 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 84.7 mt -71.3 -42.66 68.38 Favored 'General case' 0 N--CA 1.451 -0.388 0 C-N-CA 122.955 0.502 . . . . 0.0 111.582 -178.879 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 21.4 t0 . . . . . 0 CA--C 1.534 0.331 0 C-N-CA 124.289 1.036 . . . . 0.0 110.363 177.553 . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 46.9 mt-10 . . . . . 0 CA--C 1.532 0.254 0 N-CA-C 107.466 -1.309 . . . . 0.0 107.466 . . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' A' A ' 61' ' ' VAL . . . . . . . . . . . . . 4.4 t -127.78 111.75 25.6 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.408 0 C-N-CA 123.006 0.522 . . . . 0.0 111.213 -169.679 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 8.6 t -83.3 177.4 8.53 Favored 'General case' 0 CA--C 1.537 0.467 0 CA-C-O 121.249 0.547 . . . . 0.0 111.991 172.572 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 63' ' ' PHE . . . . . . . . . . . . . 40.2 t80 -64.97 -47.59 77.06 Favored 'General case' 0 N--CA 1.461 0.086 0 C-N-CA 123.615 0.766 . . . . 0.0 112.723 -168.693 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 23.1 mp0 -59.87 -56.24 24.19 Favored 'General case' 0 N--CA 1.452 -0.342 0 N-CA-C 108.862 -0.792 . . . . 0.0 108.862 -175.984 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 18.0 pt-20 -62.84 -35.1 78.85 Favored 'General case' 0 CA--C 1.537 0.45 0 N-CA-C 112.102 0.408 . . . . 0.0 112.102 179.429 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 7.4 t80 -50.06 -31.73 13.81 Favored 'General case' 0 CA--C 1.535 0.397 0 O-C-N 121.172 -0.955 . . . . 0.0 112.403 169.542 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 67' ' ' GLN . . . . . . . . . . . . . 14.7 mm-40 -55.66 -20.43 14.07 Favored 'General case' 0 CA--C 1.54 0.593 0 CA-C-N 119.388 0.995 . . . . 0.0 113.372 174.265 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 76.8 t -53.63 -28.8 16.58 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.56 0 CA-C-N 119.654 1.116 . . . . 0.0 110.929 169.942 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 31.1 tp -70.69 -39.13 73.66 Favored 'General case' 0 CA--C 1.532 0.27 0 O-C-N 121.094 -1.004 . . . . 0.0 108.293 176.706 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 70' ' ' VAL . . . . . . . . . . . . . 11.5 t . . . . . 0 N--CA 1.454 -0.256 0 O-C-N 121.786 -0.571 . . . . 0.0 109.699 176.911 . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 98.0 Cg_exo . . . . . 0 N--CA 1.459 -0.501 0 CA-C-O 120.821 0.259 . . . . 0.0 112.619 . . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 45.0 mt-10 -61.79 -45.51 93.58 Favored 'General case' 0 N--CA 1.454 -0.256 0 C-N-CA 123.046 0.539 . . . . 0.0 111.249 178.152 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 31.7 mt-10 -65.28 -44.3 88.43 Favored 'General case' 0 N--CA 1.45 -0.436 0 N-CA-C 109.108 -0.701 . . . . 0.0 109.108 178.378 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 14.6 mt -55.02 -42.87 73.12 Favored 'General case' 0 N--CA 1.453 -0.323 0 C-N-CA 123.684 0.794 . . . . 0.0 111.075 175.843 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 23.3 tptm -61.53 -52.14 65.7 Favored 'General case' 0 C--O 1.226 -0.136 0 CA-C-N 118.483 0.583 . . . . 0.0 111.113 172.954 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . -51.06 -49.3 43.49 Favored Glycine 0 CA--C 1.533 1.18 0 N-CA-C 111.081 -0.808 . . . . 0.0 111.081 179.297 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 9' ' ' ILE . . . . . . . . . . . . . 3.0 mm -58.81 -55.48 22.9 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.257 0 C-N-CA 126.885 2.074 . . . . 0.0 109.037 176.46 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 10' ' ' PHE . . . . . . . . . . . . . 58.7 t80 -46.15 -52.24 12.61 Favored 'General case' 0 N--CA 1.451 -0.398 0 C-N-CA 123.242 0.617 . . . . 0.0 109.938 177.785 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 52.6 mt-10 -62.06 -51.56 67.49 Favored 'General case' 0 CA--C 1.532 0.287 0 C-N-CA 123.213 0.605 . . . . 0.0 110.738 -179.986 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 67.2 tttt -44.65 -51.91 8.7 Favored 'General case' 0 N--CA 1.462 0.15 0 C-N-CA 124.877 1.271 . . . . 0.0 111.128 177.7 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 58.1 m-85 -77.75 -46.24 22.3 Favored 'General case' 0 N--CA 1.454 -0.259 0 O-C-N 122.304 -0.248 . . . . 0.0 110.645 -175.532 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -56.34 -41.48 76.13 Favored 'General case' 0 C--N 1.332 -0.17 0 C-N-CA 123.491 0.716 . . . . 0.0 111.793 -179.655 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.53 0.181 0 C-N-CA 124.518 1.127 . . . . 0.0 112.232 177.8 . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' A' A ' 20' ' ' PRO . . . . . . . . . . . . . 41.4 Cg_endo . . . . . 0 N--CA 1.458 -0.598 0 N-CA-C 113.201 0.424 . . . . 0.0 113.201 . . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 51.0 m-80 -81.51 -4.12 55.04 Favored 'General case' 0 C--O 1.234 0.272 0 N-CA-C 113.58 0.955 . . . . 0.0 113.58 -169.21 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 43.5 tt0 -155.52 130.87 9.59 Favored 'General case' 0 CA--C 1.533 0.322 0 CA-C-N 119.333 0.969 . . . . 0.0 112.428 -168.311 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 40.2 mt -102.66 123.58 46.63 Favored 'General case' 0 N--CA 1.453 -0.283 0 C-N-CA 124.651 1.18 . . . . 0.0 111.85 179.13 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -84.21 170.84 13.33 Favored 'General case' 0 CA--C 1.537 0.471 0 C-N-CA 123.625 0.77 . . . . 0.0 109.591 165.202 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 98.4 mttt -51.14 -49.94 59.85 Favored 'General case' 0 C--N 1.339 0.123 0 N-CA-C 113.333 0.864 . . . . 0.0 113.333 -168.949 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 38.6 tp10 -63.2 -45.12 93.21 Favored 'General case' 0 N--CA 1.456 -0.152 0 O-C-N 121.983 -0.448 . . . . 0.0 111.045 -173.249 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 1.9 mp0 -53.66 -51.19 63.94 Favored 'General case' 0 N--CA 1.452 -0.358 0 N-CA-C 109.598 -0.519 . . . . 0.0 109.598 173.319 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 9.2 mt -55.73 -41.72 74.29 Favored 'General case' 0 CA--C 1.513 -0.472 0 N-CA-C 113.173 0.805 . . . . 0.0 113.173 173.748 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 60.0 tttm -61.82 -51.96 66.13 Favored 'General case' 0 C--N 1.325 -0.494 0 CA-C-N 118.67 0.668 . . . . 0.0 109.82 -177.249 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 10.5 mp -63.2 -44.09 96.32 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.146 -0.479 . . . . 0.0 110.606 -179.936 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 7.4 tt -50.32 -58.25 6.07 Favored 'General case' 0 C--N 1.332 -0.167 0 C-N-CA 123.789 0.835 . . . . 0.0 109.543 173.074 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 29.4 mt -54.19 -62.13 1.85 Allowed 'General case' 0 N--CA 1.455 -0.193 0 C-N-CA 123.561 0.744 . . . . 0.0 109.605 -179.103 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 25.5 tt0 -55.73 -45.08 78.05 Favored 'General case' 0 N--CA 1.452 -0.331 0 C-N-CA 123.575 0.75 . . . . 0.0 111.534 -173.096 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 19.8 m -78.44 -48.0 16.33 Favored 'General case' 0 C--N 1.33 -0.28 0 C-N-CA 122.367 0.267 . . . . 0.0 111.313 -173.376 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 66.7 mm-40 -96.42 -31.02 13.05 Favored 'General case' 0 N--CA 1.45 -0.463 0 N-CA-C 112.766 0.654 . . . . 0.0 112.766 -167.748 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 69.7 m-85 . . . . . 0 CA--C 1.53 0.197 0 C-N-CA 123.522 0.729 . . . . 0.0 110.462 -176.205 . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 58.8 tp . . . . . 0 C--O 1.226 -0.153 0 CA-C-O 120.787 0.327 . . . . 0.0 110.775 . . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 5.7 m-20 -61.03 -54.5 44.06 Favored 'General case' 0 N--CA 1.45 -0.431 0 C-N-CA 123.395 0.678 . . . . 0.0 110.788 -179.215 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 59.1 mm-40 -58.29 -43.67 88.17 Favored 'General case' 0 N--CA 1.455 -0.217 0 C-N-CA 120.681 -0.407 . . . . 0.0 110.535 178.676 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 46.5 tp -61.17 -47.47 86.02 Favored 'General case' 0 N--CA 1.452 -0.335 0 N-CA-C 109.746 -0.465 . . . . 0.0 109.746 179.816 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 50' ' ' PHE . . . . . . . . . . . . . 70.4 t80 -51.96 -49.61 62.87 Favored 'General case' 0 C--N 1.331 -0.209 0 C-N-CA 124.022 0.929 . . . . 0.0 110.367 176.595 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 36.0 mt-10 -62.46 -44.11 97.2 Favored 'General case' 0 CA--C 1.532 0.266 0 C-N-CA 122.45 0.3 . . . . 0.0 111.687 177.464 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 34.4 mt-10 -57.36 -40.75 78.75 Favored 'General case' 0 C--N 1.332 -0.183 0 C-N-CA 122.921 0.488 . . . . 0.0 110.962 176.097 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 94.6 mt -66.33 -67.32 0.46 Allowed 'General case' 0 N--CA 1.449 -0.499 0 C-N-CA 123.054 0.542 . . . . 0.0 109.971 176.732 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 39.8 t0 . . . . . 0 N--CA 1.454 -0.267 0 N-CA-C 108.192 -1.04 . . . . 0.0 108.192 177.368 . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 11.3 mp0 . . . . . 0 N--CA 1.454 -0.266 0 N-CA-C 108.375 -0.972 . . . . 0.0 108.375 . . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' A' A ' 61' ' ' VAL . . . . . . . . . . . . . 15.2 t -79.18 110.54 15.01 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.375 0 C-N-CA 123.399 0.68 . . . . 0.0 111.397 -166.42 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 8.7 t -79.36 172.91 13.14 Favored 'General case' 0 CA--C 1.537 0.465 0 CA-C-O 120.815 0.34 . . . . 0.0 111.316 169.668 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 63' ' ' PHE . . . . . . . . . . . . . 55.1 t80 -63.45 -36.83 85.04 Favored 'General case' 0 N--CA 1.464 0.265 0 N-CA-C 113.3 0.852 . . . . 0.0 113.3 -168.679 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 21.1 mp0 -67.55 -58.4 4.77 Favored 'General case' 0 N--CA 1.453 -0.321 0 N-CA-C 108.864 -0.791 . . . . 0.0 108.864 -177.857 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 17.8 pt-20 -59.58 -35.04 73.49 Favored 'General case' 0 CA--C 1.539 0.549 0 O-C-N 121.775 -0.578 . . . . 0.0 111.796 177.351 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 19.2 t80 -51.39 -28.6 13.13 Favored 'General case' 0 CA--C 1.534 0.344 0 O-C-N 121.288 -0.882 . . . . 0.0 112.489 169.89 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 67' ' ' GLN . . . . . . . . . . . . . 74.8 mm-40 -54.38 -23.73 16.85 Favored 'General case' 0 CA--C 1.538 0.497 0 CA-C-N 120.119 1.327 . . . . 0.0 113.063 174.04 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 86.5 t -55.64 -27.93 22.4 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.704 0 CA-C-N 119.44 1.018 . . . . 0.0 111.042 172.079 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 8.4 tt -71.44 -41.03 69.96 Favored 'General case' 0 CA--C 1.529 0.164 0 O-C-N 120.892 -1.13 . . . . 0.0 108.256 176.597 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 70' ' ' VAL . . . . . . . . . . . . . 15.7 t . . . . . 0 CA--C 1.538 0.498 0 O-C-N 121.705 -0.622 . . . . 0.0 109.812 176.642 . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 88.8 Cg_exo . . . . . 0 N--CA 1.458 -0.592 0 CA-C-O 120.647 0.186 . . . . 0.0 112.465 . . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 45.7 mt-10 -59.25 -48.14 82.72 Favored 'General case' 0 C--O 1.232 0.159 0 C-N-CA 123.504 0.722 . . . . 0.0 111.083 177.687 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 31.6 mt-10 -61.42 -46.22 91.04 Favored 'General case' 0 C--O 1.221 -0.41 0 N-CA-C 108.957 -0.757 . . . . 0.0 108.957 177.263 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 14.8 mt -59.25 -40.38 85.8 Favored 'General case' 0 N--CA 1.451 -0.417 0 C-N-CA 123.596 0.759 . . . . 0.0 111.477 -178.334 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -60.18 -53.93 51.89 Favored 'General case' 0 CA--C 1.53 0.206 0 C-N-CA 123.332 0.653 . . . . 0.0 110.73 170.987 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . -51.84 -49.03 49.57 Favored Glycine 0 CA--C 1.533 1.192 0 N-CA-C 111.295 -0.722 . . . . 0.0 111.295 179.205 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 9' ' ' ILE . . . . . . . . . . . . . 3.4 mm -59.41 -52.07 65.21 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.265 0 C-N-CA 127.416 2.286 . . . . 0.0 109.254 177.339 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 10' ' ' PHE . . . . . . . . . . . . . 51.9 t80 -48.13 -53.21 17.42 Favored 'General case' 0 N--CA 1.45 -0.463 0 N-CA-C 109.306 -0.627 . . . . 0.0 109.306 177.234 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 44.5 mt-10 -60.48 -52.97 62.94 Favored 'General case' 0 CA--C 1.53 0.173 0 C-N-CA 122.438 0.295 . . . . 0.0 110.682 179.411 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 39.4 tttm -43.06 -54.82 4.13 Favored 'General case' 0 N--CA 1.455 -0.177 0 C-N-CA 125.025 1.33 . . . . 0.0 110.668 179.832 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 70.0 m-85 -78.47 -44.1 25.43 Favored 'General case' 0 N--CA 1.454 -0.238 0 CA-C-O 119.533 -0.27 . . . . 0.0 111.386 -176.254 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -52.19 -37.96 56.41 Favored 'General case' 0 N--CA 1.463 0.208 0 C-N-CA 123.351 0.66 . . . . 0.0 112.086 179.118 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.402 0 N-CA-C 113.597 0.962 . . . . 0.0 113.597 179.589 . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' A' A ' 20' ' ' PRO . . . . . . . . . . . . . 17.8 Cg_endo . . . . . 0 CA--C 1.54 0.804 0 CA-C-O 120.451 0.104 . . . . 0.0 112.351 . . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 31.9 m-80 -86.22 -7.62 58.4 Favored 'General case' 0 CA--C 1.533 0.314 0 C-N-CA 124.615 1.166 . . . . 0.0 112.97 -179.1 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 25.3 tt0 -155.57 115.53 3.71 Favored 'General case' 0 CA--C 1.538 0.506 0 CA-C-N 119.443 1.02 . . . . 0.0 111.81 -168.907 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 32.3 mt -80.49 128.32 33.45 Favored 'General case' 0 C--O 1.234 0.283 0 C-N-CA 123.513 0.725 . . . . 0.0 112.015 -171.421 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -86.12 175.25 8.63 Favored 'General case' 0 CA--C 1.541 0.629 0 N-CA-C 108.108 -1.071 . . . . 0.0 108.108 166.13 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 98.6 mttt -56.15 -44.83 79.63 Favored 'General case' 0 N--CA 1.456 -0.165 0 C-N-CA 123.394 0.678 . . . . 0.0 112.187 -172.209 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 24.8 mt-10 -65.46 -46.84 78.23 Favored 'General case' 0 CA--C 1.521 -0.136 0 CA-C-O 121.116 0.484 . . . . 0.0 110.551 -173.56 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 2.0 mp0 -53.36 -51.32 62.85 Favored 'General case' 0 N--CA 1.451 -0.424 0 CA-C-N 115.734 -0.666 . . . . 0.0 109.257 174.089 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 8.6 mt -55.42 -42.17 73.77 Favored 'General case' 0 CA--C 1.511 -0.551 0 N-CA-C 113.646 0.98 . . . . 0.0 113.646 173.486 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 84.1 tttt -60.63 -56.67 18.54 Favored 'General case' 0 C--N 1.324 -0.533 0 N-CA-C 108.835 -0.802 . . . . 0.0 108.835 -178.291 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 4.2 mm? -58.37 -43.65 88.54 Favored 'General case' 0 C--N 1.328 -0.341 0 C-N-CA 120.887 -0.325 . . . . 0.0 110.92 -178.348 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 9.3 tt -51.99 -57.85 8.25 Favored 'General case' 0 CA--C 1.53 0.179 0 C-N-CA 123.533 0.733 . . . . 0.0 109.906 173.769 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 38.9 mt -54.46 -58.41 7.58 Favored 'General case' 0 C--N 1.332 -0.159 0 C-N-CA 123.739 0.816 . . . . 0.0 110.309 -178.596 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 23.8 mm100 -52.32 -55.01 24.32 Favored 'General case' 0 N--CA 1.453 -0.277 0 C-N-CA 124.603 1.161 . . . . 0.0 110.846 -176.96 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 11.9 m -74.42 -43.43 56.31 Favored 'General case' 0 N--CA 1.449 -0.479 0 CA-C-N 115.602 -0.727 . . . . 0.0 111.202 -169.558 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 71.8 mm-40 -100.1 -29.36 12.55 Favored 'General case' 0 N--CA 1.448 -0.572 0 N-CA-C 113.583 0.956 . . . . 0.0 113.583 -167.734 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 50.9 m-85 . . . . . 0 C--O 1.234 0.276 0 N-CA-C 113.157 0.799 . . . . 0.0 113.157 -171.23 . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 22.7 mt . . . . . 0 C--O 1.221 -0.438 0 N-CA-C 107.913 -1.143 . . . . 0.0 107.913 . . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 5.4 m-20 -53.28 -53.64 47.92 Favored 'General case' 0 N--CA 1.449 -0.521 0 C-N-CA 124.633 1.173 . . . . 0.0 111.66 176.901 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 19.9 tp10 -56.89 -52.06 66.65 Favored 'General case' 0 N--CA 1.456 -0.146 0 N-CA-C 110.403 -0.221 . . . . 0.0 110.403 177.513 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 3.9 mm? -56.08 -45.43 79.35 Favored 'General case' 0 C--O 1.225 -0.213 0 CA-C-O 120.969 0.414 . . . . 0.0 110.264 179.781 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 50' ' ' PHE . . . . . . . . . . . . . 64.9 t80 -58.86 -50.89 72.3 Favored 'General case' 0 N--CA 1.448 -0.533 0 C-N-CA 124.117 0.967 . . . . 0.0 110.084 -178.287 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 24.9 tp10 -59.46 -46.42 88.83 Favored 'General case' 0 N--CA 1.453 -0.306 0 N-CA-C 109.996 -0.372 . . . . 0.0 109.996 178.555 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 13.6 tm-20 -57.44 -44.24 84.54 Favored 'General case' 0 CA--C 1.531 0.231 0 C-N-CA 123.609 0.764 . . . . 0.0 110.493 -179.824 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 84.6 mt -72.09 -45.23 61.47 Favored 'General case' 0 N--CA 1.45 -0.429 0 C-N-CA 123.5 0.72 . . . . 0.0 111.568 -178.363 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 47.1 t0 . . . . . 0 CA--C 1.533 0.319 0 C-N-CA 123.699 0.8 . . . . 0.0 110.697 -177.786 . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 59.5 mt-10 . . . . . 0 CA--C 1.532 0.272 0 N-CA-C 106.431 -1.692 . . . . 0.0 106.431 . . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' A' A ' 61' ' ' VAL . . . . . . . . . . . . . 8.9 t -108.93 109.54 28.71 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.446 0 CA-C-N 118.554 0.616 . . . . 0.0 110.78 -175.911 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 3.8 m -78.76 154.03 30.31 Favored 'General case' 0 CA--C 1.537 0.45 0 C-N-CA 123.296 0.638 . . . . 0.0 111.107 173.418 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 63' ' ' PHE . . . . . . . . . . . . . 69.7 t80 -51.13 -42.37 60.7 Favored 'General case' 0 CA--C 1.534 0.358 0 C-N-CA 123.524 0.73 . . . . 0.0 112.711 -173.334 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 12.6 pt-20 -59.18 -37.09 76.52 Favored 'General case' 0 CA--C 1.534 0.349 0 N-CA-C 112.746 0.647 . . . . 0.0 112.746 -178.565 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 18.7 pt-20 -91.23 -30.52 16.59 Favored 'General case' 0 CA--C 1.531 0.239 0 C-N-CA 123.091 0.557 . . . . 0.0 110.062 -179.087 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 7.9 t80 -49.97 -27.28 5.17 Favored 'General case' 0 CA--C 1.536 0.421 0 C-N-CA 123.86 0.864 . . . . 0.0 111.071 167.815 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 67' ' ' GLN . . . . . . . . . . . . . 68.9 mm-40 -49.55 -27.61 4.63 Favored 'General case' 0 CA--C 1.537 0.47 0 CA-C-N 119.259 0.936 . . . . 0.0 113.448 171.586 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 69.2 t -53.17 -32.25 18.81 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.58 0 O-C-N 121.368 -0.833 . . . . 0.0 111.368 172.613 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 8.5 tt -71.54 -42.69 67.59 Favored 'General case' 0 N--CA 1.455 -0.192 0 N-CA-C 107.946 -1.131 . . . . 0.0 107.946 178.806 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 70' ' ' VAL . . . . . . . . . . . . . 19.0 t . . . . . 0 N--CA 1.453 -0.286 0 N-CA-C 109.721 -0.474 . . . . 0.0 109.721 177.272 . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 97.1 Cg_exo . . . . . 0 N--CA 1.458 -0.598 0 N-CA-C 112.821 0.277 . . . . 0.0 112.821 . . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 3.0 mp0 -59.06 -49.84 76.34 Favored 'General case' 0 N--CA 1.456 -0.125 0 C-N-CA 123.54 0.736 . . . . 0.0 111.757 176.751 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 46.6 mm-40 -62.63 -43.15 99.53 Favored 'General case' 0 C--N 1.331 -0.204 0 N-CA-C 109.201 -0.666 . . . . 0.0 109.201 179.165 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 12.8 mt -60.34 -36.66 78.49 Favored 'General case' 0 N--CA 1.446 -0.664 0 CA-C-O 119.266 -0.397 . . . . 0.0 111.916 175.67 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 79.3 tttt -64.64 -45.07 88.38 Favored 'General case' 0 N--CA 1.448 -0.55 0 CA-C-N 118.813 0.733 . . . . 0.0 110.526 172.294 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . -52.8 -52.36 39.26 Favored Glycine 0 CA--C 1.53 1.028 0 N-CA-C 110.169 -1.172 . . . . 0.0 110.169 177.253 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 9' ' ' ILE . . . . . . . . . . . . . 15.1 mm -54.19 -58.25 4.12 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.198 0 C-N-CA 125.631 1.572 . . . . 0.0 109.391 173.848 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 10' ' ' PHE . . . . . . . . . . . . . 28.5 t80 -46.05 -51.11 14.3 Favored 'General case' 0 N--CA 1.448 -0.566 0 C-N-CA 123.173 0.589 . . . . 0.0 109.995 179.854 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 48.0 mt-10 -63.4 -49.94 71.81 Favored 'General case' 0 CA--C 1.53 0.195 0 C-N-CA 123.657 0.783 . . . . 0.0 111.037 -179.385 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 41.1 tttp -42.57 -51.16 5.24 Favored 'General case' 0 C--N 1.341 0.212 0 C-N-CA 124.635 1.174 . . . . 0.0 110.649 176.693 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 81.2 m-85 -78.79 -51.27 9.99 Favored 'General case' 0 N--CA 1.452 -0.348 0 CA-C-N 116.521 -0.309 . . . . 0.0 110.504 -178.78 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -56.93 -25.56 57.76 Favored 'General case' 0 N--CA 1.465 0.287 0 C-N-CA 126.347 1.859 . . . . 0.0 114.436 -174.46 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.453 -0.318 0 CA-C-O 118.276 -0.868 . . . . 0.0 113.278 177.3 . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' A' A ' 20' ' ' PRO . . . . . . . . . . . . . 10.4 Cg_endo . . . . . 0 CA--C 1.542 0.902 0 N-CA-C 114.546 0.941 . . . . 0.0 114.546 . . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 38.9 m-80 -98.88 -1.96 38.85 Favored 'General case' 0 CA--C 1.538 0.486 0 C-N-CA 125.395 1.478 . . . . 0.0 112.827 -178.955 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 4.4 tp60 -145.22 116.84 8.1 Favored 'General case' 0 CA--C 1.55 0.964 0 C-N-CA 124.684 1.194 . . . . 0.0 112.42 -168.152 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 44.3 mt -91.71 128.83 37.7 Favored 'General case' 0 C--N 1.344 0.331 0 C-N-CA 124.592 1.157 . . . . 0.0 112.578 -175.354 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 98.3 p -79.4 167.71 20.48 Favored 'General case' 0 CA--C 1.537 0.462 0 C-N-CA 123.779 0.832 . . . . 0.0 109.316 167.665 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 97.4 mttt -54.79 -47.7 73.66 Favored 'General case' 0 C--N 1.339 0.141 0 O-C-N 121.866 -0.521 . . . . 0.0 111.342 -179.421 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 42.2 tt0 -61.41 -44.06 97.79 Favored 'General case' 0 N--CA 1.454 -0.234 0 CA-C-O 120.695 0.283 . . . . 0.0 110.729 -178.138 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 69.5 mt-10 -59.58 -48.8 80.25 Favored 'General case' 0 N--CA 1.448 -0.525 0 N-CA-C 109.717 -0.475 . . . . 0.0 109.717 177.329 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 7.5 mt -54.16 -42.53 69.71 Favored 'General case' 0 CA--C 1.511 -0.549 0 N-CA-C 113.084 0.772 . . . . 0.0 113.084 170.868 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 82.5 tttt -62.46 -50.1 72.81 Favored 'General case' 0 N--CA 1.448 -0.565 0 CA-C-N 118.68 0.673 . . . . 0.0 109.593 -177.304 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 79.1 mt -59.95 -45.43 92.66 Favored 'General case' 0 C--O 1.235 0.341 0 C-N-CA 122.725 0.41 . . . . 0.0 111.506 178.272 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 7.9 tt -53.63 -56.74 14.57 Favored 'General case' 0 N--CA 1.455 -0.188 0 C-N-CA 123.77 0.828 . . . . 0.0 109.169 174.851 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 50.2 mt -55.72 -51.08 68.56 Favored 'General case' 0 N--CA 1.454 -0.267 0 C-N-CA 123.813 0.845 . . . . 0.0 109.751 -178.569 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 35.5 mt-30 -49.51 -54.6 17.01 Favored 'General case' 0 N--CA 1.458 -0.032 0 C-N-CA 123.165 0.586 . . . . 0.0 111.236 176.982 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 6.0 m -70.71 -48.66 53.47 Favored 'General case' 0 N--CA 1.454 -0.267 0 CA-C-N 116.059 -0.519 . . . . 0.0 111.095 -170.93 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 19.6 mm-40 -97.57 -37.34 9.98 Favored 'General case' 0 N--CA 1.45 -0.445 0 C-N-CA 123.759 0.824 . . . . 0.0 113.131 -167.339 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 27.0 m-85 . . . . . 0 CA--C 1.536 0.411 0 C-N-CA 122.93 0.492 . . . . 0.0 112.155 -168.744 . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 65.1 tp . . . . . 0 C--O 1.223 -0.297 0 N-CA-C 111.982 0.364 . . . . 0.0 111.982 . . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 6.7 m-20 -58.09 -51.2 70.69 Favored 'General case' 0 N--CA 1.452 -0.369 0 C-N-CA 123.306 0.643 . . . . 0.0 111.392 179.276 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 3.2 mp0 -60.44 -46.93 88.28 Favored 'General case' 0 N--CA 1.457 -0.116 0 N-CA-C 109.983 -0.377 . . . . 0.0 109.983 177.955 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 94.5 mt -56.73 -46.19 81.49 Favored 'General case' 0 C--O 1.225 -0.236 0 N-CA-C 109.946 -0.39 . . . . 0.0 109.946 178.66 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 50' ' ' PHE . . . . . . . . . . . . . 68.7 t80 -57.23 -51.88 67.58 Favored 'General case' 0 N--CA 1.45 -0.446 0 C-N-CA 124.034 0.934 . . . . 0.0 110.457 179.561 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 53.5 mm-40 -57.39 -48.2 79.7 Favored 'General case' 0 CA--C 1.532 0.275 0 CA-C-O 120.594 0.235 . . . . 0.0 110.98 176.559 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 47.5 tp10 -55.3 -44.4 75.7 Favored 'General case' 0 CA--C 1.53 0.204 0 C-N-CA 123.759 0.824 . . . . 0.0 110.865 179.43 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 85.2 mt -69.32 -46.64 66.59 Favored 'General case' 0 N--CA 1.449 -0.5 0 C-N-CA 123.213 0.605 . . . . 0.0 110.923 179.902 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 55.2 t0 . . . . . 0 CA--C 1.535 0.402 0 C-N-CA 123.548 0.739 . . . . 0.0 110.57 179.309 . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' A' A ' 60' ' ' GLU . . . . . . . . . . . . 0.343 0.2 OUTLIER . . . . . 0 CA--C 1.537 0.469 0 N-CA-C 110.735 -0.098 . . . . 0.0 110.735 . . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 61' ' ' VAL . . . . . . . . . . . . . 13.6 t -77.23 122.53 32.02 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.42 0 N-CA-C 113.921 1.082 . . . . 0.0 113.921 -164.096 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -77.96 152.09 33.34 Favored 'General case' 0 CA--C 1.536 0.406 0 C-N-CA 123.838 0.855 . . . . 0.0 110.942 174.053 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 63' ' ' PHE . . . . . . . . . . . . . 59.7 t80 -53.81 -31.24 48.38 Favored 'General case' 0 N--CA 1.47 0.566 0 N-CA-C 113.862 1.06 . . . . 0.0 113.862 176.771 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 28.8 mp0 -68.65 -63.52 1.04 Allowed 'General case' 0 N--CA 1.453 -0.318 0 O-C-N 121.581 -0.7 . . . . 0.0 109.112 -179.977 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 18.5 pt-20 -62.27 -28.37 69.67 Favored 'General case' 0 CA--C 1.539 0.522 0 O-C-N 121.274 -0.891 . . . . 0.0 111.828 -179.631 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 12.7 t80 -50.01 -27.54 5.64 Favored 'General case' 0 CA--C 1.534 0.342 0 C-N-CA 123.662 0.785 . . . . 0.0 112.622 169.304 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 67' ' ' GLN . . . . . . . . . . . . . 71.6 mm-40 -55.4 -22.09 18.43 Favored 'General case' 0 CA--C 1.543 0.706 0 CA-C-N 119.812 1.187 . . . . 0.0 112.901 173.925 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 72.5 t -53.23 -29.15 15.65 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.589 0 O-C-N 120.98 -1.075 . . . . 0.0 111.175 169.889 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 18.7 tp -70.91 -42.06 70.42 Favored 'General case' 0 N--CA 1.452 -0.331 0 N-CA-C 107.872 -1.158 . . . . 0.0 107.872 177.438 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 70' ' ' VAL . . . . . . . . . . . . . 24.2 t . . . . . 0 N--CA 1.456 -0.169 0 N-CA-C 109.863 -0.421 . . . . 0.0 109.863 177.077 . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 88.1 Cg_exo . . . . . 0 N--CA 1.456 -0.685 0 CA-C-O 120.24 0.017 . . . . 0.0 112.107 . . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 40.0 tt0 -63.62 -47.03 83.02 Favored 'General case' 0 N--CA 1.456 -0.164 0 C-N-CA 123.327 0.651 . . . . 0.0 111.293 177.129 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 25.9 mt-10 -60.46 -47.53 85.74 Favored 'General case' 0 N--CA 1.454 -0.241 0 N-CA-C 108.48 -0.933 . . . . 0.0 108.48 176.997 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 17.9 mt -57.75 -37.7 74.08 Favored 'General case' 0 N--CA 1.45 -0.462 0 C-N-CA 123.639 0.776 . . . . 0.0 111.947 178.127 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 21.1 tptm -62.4 -51.84 65.96 Favored 'General case' 0 C--N 1.332 -0.188 0 CA-C-N 118.728 0.695 . . . . 0.0 111.089 171.986 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . -53.95 -50.61 54.16 Favored Glycine 0 CA--C 1.531 1.035 0 N-CA-C 110.136 -1.186 . . . . 0.0 110.136 -179.811 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 9' ' ' ILE . . . . . . . . . . . . . 69.3 mt -55.01 -53.63 32.1 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.385 0 C-N-CA 125.772 1.629 . . . . 0.0 110.27 174.053 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 10' ' ' PHE . . . . . . . . . . . . . 41.0 t80 -49.17 -52.76 24.55 Favored 'General case' 0 N--CA 1.45 -0.457 0 N-CA-C 109.208 -0.664 . . . . 0.0 109.208 179.153 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 50.0 mt-10 -58.91 -50.9 72.3 Favored 'General case' 0 N--CA 1.453 -0.292 0 C-N-CA 122.898 0.479 . . . . 0.0 110.289 -179.468 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 41.0 tttm -48.63 -59.76 3.26 Favored 'General case' 0 CA--C 1.532 0.268 0 C-N-CA 123.462 0.705 . . . . 0.0 111.243 176.879 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 57.8 m-85 -76.57 -30.01 56.87 Favored 'General case' 0 C--O 1.224 -0.26 0 O-C-N 121.913 -0.492 . . . . 0.0 110.946 -169.955 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -66.2 -46.52 77.01 Favored 'General case' 0 N--CA 1.453 -0.275 0 O-C-N 121.932 -0.48 . . . . 0.0 110.259 173.878 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.333 -0.128 0 C-N-CA 123.545 0.738 . . . . 0.0 111.572 176.987 . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' A' A ' 20' ' ' PRO . . . . . . . . . . . . . 13.3 Cg_endo . . . . . 0 CA--C 1.535 0.525 0 N-CA-C 114.893 1.074 . . . . 0.0 114.893 . . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 46.4 m-80 -90.39 -2.29 57.96 Favored 'General case' 0 N--CA 1.452 -0.358 0 C-N-CA 123.9 0.88 . . . . 0.0 112.583 -177.257 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 43.6 tt0 -155.79 122.67 5.32 Favored 'General case' 0 CA--C 1.539 0.553 0 CA-C-N 119.799 1.181 . . . . 0.0 113.432 -167.677 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 56.8 mt -89.05 133.16 34.46 Favored 'General case' 0 CA--C 1.532 0.281 0 C-N-CA 124.252 1.021 . . . . 0.0 112.055 -178.682 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 45.1 p -78.27 172.46 13.55 Favored 'General case' 0 CA--C 1.535 0.377 0 C-N-CA 123.534 0.734 . . . . 0.0 109.413 167.676 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 98.0 mttt -57.97 -45.91 85.99 Favored 'General case' 0 C--O 1.226 -0.177 0 O-C-N 121.746 -0.596 . . . . 0.0 109.752 174.34 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 2.0 mp0 -62.57 -48.29 80.12 Favored 'General case' 0 CA--C 1.516 -0.345 0 CA-C-O 121.194 0.521 . . . . 0.0 109.948 -177.311 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 34.2 mt-10 -56.29 -47.37 78.79 Favored 'General case' 0 N--CA 1.449 -0.487 0 CA-C-N 115.467 -0.788 . . . . 0.0 109.661 177.104 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 11.0 mt -55.16 -44.83 75.55 Favored 'General case' 0 CA--C 1.512 -0.496 0 N-CA-C 113.051 0.76 . . . . 0.0 113.051 170.003 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 62.5 tttm -61.73 -48.9 78.64 Favored 'General case' 0 C--N 1.324 -0.533 0 CA-C-N 118.732 0.697 . . . . 0.0 110.019 -176.093 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 4.2 mm? -61.53 -46.07 91.52 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.375 -0.375 . . . . 0.0 111.056 178.142 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 6.0 tt -49.87 -59.17 4.1 Favored 'General case' 0 C--N 1.333 -0.127 0 C-N-CA 123.648 0.779 . . . . 0.0 109.332 173.859 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 49.4 mt -55.78 -58.26 8.58 Favored 'General case' 0 N--CA 1.454 -0.265 0 C-N-CA 123.563 0.745 . . . . 0.0 109.817 -177.738 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 30.0 tt0 -50.97 -52.2 45.03 Favored 'General case' 0 N--CA 1.452 -0.349 0 C-N-CA 124.361 1.064 . . . . 0.0 111.438 -177.807 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 16.3 m -74.54 -49.31 22.4 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.235 -0.439 . . . . 0.0 110.861 -171.26 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 70.8 mm-40 -89.5 -31.99 17.4 Favored 'General case' 0 N--CA 1.449 -0.483 0 C-N-CA 122.7 0.4 . . . . 0.0 111.77 -169.4 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 76.4 m-85 . . . . . 0 CA--C 1.535 0.366 0 C-N-CA 124.268 1.027 . . . . 0.0 110.235 -175.541 . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 62.6 tp . . . . . 0 C--O 1.227 -0.084 0 N-CA-C 112.606 0.595 . . . . 0.0 112.606 . . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 5.9 m-20 -57.87 -56.62 19.66 Favored 'General case' 0 N--CA 1.451 -0.415 0 CA-C-O 121.408 0.623 . . . . 0.0 110.129 178.899 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 70.0 mm-40 -54.23 -47.35 72.28 Favored 'General case' 0 N--CA 1.453 -0.323 0 CA-C-N 115.911 -0.586 . . . . 0.0 110.222 178.555 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 6.2 tp -52.8 -53.5 47.55 Favored 'General case' 0 C--O 1.224 -0.283 0 C-N-CA 123.096 0.558 . . . . 0.0 109.921 176.172 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 50' ' ' PHE . . . . . . . . . . . . . 63.1 t80 -52.6 -51.35 60.34 Favored 'General case' 0 N--CA 1.453 -0.299 0 C-N-CA 124.232 1.013 . . . . 0.0 110.486 -179.194 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 2.2 mp0 -56.18 -50.03 72.35 Favored 'General case' 0 CA--C 1.533 0.31 0 CA-C-O 120.529 0.204 . . . . 0.0 111.18 174.89 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 34.6 mt-10 -55.62 -41.75 73.95 Favored 'General case' 0 CA--C 1.531 0.217 0 C-N-CA 123.024 0.53 . . . . 0.0 111.673 179.983 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 76.4 mt -67.04 -54.9 17.16 Favored 'General case' 0 N--CA 1.449 -0.523 0 C-N-CA 122.921 0.488 . . . . 0.0 110.339 177.689 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 11.4 t70 . . . . . 0 N--CA 1.453 -0.296 0 CA-C-O 121.627 0.727 . . . . 0.0 109.332 -179.136 . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 39.7 mt-10 . . . . . 0 N--CA 1.455 -0.204 0 N-CA-C 107.615 -1.254 . . . . 0.0 107.615 . . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' A' A ' 61' ' ' VAL . . . . . . . . . . . . . 3.8 t -88.77 111.24 22.35 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.308 0 N-CA-C 112.754 0.65 . . . . 0.0 112.754 -163.913 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 34.3 m -79.45 162.36 25.51 Favored 'General case' 0 CA--C 1.533 0.326 0 C-N-CA 123.094 0.558 . . . . 0.0 111.989 169.876 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 63' ' ' PHE . . . . . . . . . . . . . 57.7 t80 -54.2 -37.89 65.05 Favored 'General case' 0 N--CA 1.464 0.257 0 N-CA-C 113.388 0.885 . . . . 0.0 113.388 -169.568 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 25.3 mp0 -65.39 -57.69 7.72 Favored 'General case' 0 N--CA 1.451 -0.404 0 N-CA-C 109.081 -0.711 . . . . 0.0 109.081 -176.565 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 17.1 pt-20 -61.43 -36.49 80.5 Favored 'General case' 0 CA--C 1.541 0.623 0 O-C-N 121.823 -0.548 . . . . 0.0 111.347 177.478 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 14.6 t80 -52.76 -26.12 13.29 Favored 'General case' 0 CA--C 1.537 0.474 0 C-N-CA 123.943 0.897 . . . . 0.0 112.335 169.922 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 67' ' ' GLN . . . . . . . . . . . . . 60.3 mm-40 -54.82 -23.17 17.06 Favored 'General case' 0 CA--C 1.534 0.337 0 CA-C-N 119.83 1.195 . . . . 0.0 113.077 173.356 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 98.6 t -55.89 -33.76 35.77 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.516 0 CA-C-N 119.341 0.973 . . . . 0.0 110.528 171.526 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 22.5 tp -74.12 -49.92 21.77 Favored 'General case' 0 N--CA 1.455 -0.203 0 N-CA-C 107.754 -1.202 . . . . 0.0 107.754 177.264 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 70' ' ' VAL . . . . . . . . . . . . . 58.9 t . . . . . 0 CA--C 1.536 0.408 0 C-N-CA 123.642 0.777 . . . . 0.0 110.472 179.63 . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 76.3 Cg_exo . . . . . 0 N--CA 1.453 -0.856 0 N-CA-C 111.821 -0.107 . . . . 0.0 111.821 . . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 44.9 mt-10 -62.46 -53.07 60.31 Favored 'General case' 0 CA--C 1.531 0.234 0 C-N-CA 123.807 0.843 . . . . 0.0 111.327 176.77 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 28.7 mt-10 -55.28 -46.85 76.18 Favored 'General case' 0 C--N 1.335 -0.057 0 CA-C-O 121.599 0.714 . . . . 0.0 109.19 176.37 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 58.9 mt -60.65 -35.75 76.98 Favored 'General case' 0 N--CA 1.446 -0.626 0 C-N-CA 124.118 0.967 . . . . 0.0 112.757 178.344 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER -62.24 -47.95 82.11 Favored 'General case' 0 N--CA 1.454 -0.254 0 CA-C-N 119.031 0.832 . . . . 0.0 109.633 170.629 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . -53.75 -52.02 45.07 Favored Glycine 0 CA--C 1.532 1.106 0 N-CA-C 110.698 -0.961 . . . . 0.0 110.698 177.316 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 9' ' ' ILE . . . . . . . . . . . . . 24.0 mm -55.45 -54.45 25.18 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.235 0 C-N-CA 125.341 1.457 . . . . 0.0 109.775 175.152 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 10' ' ' PHE . . . . . . . . . . . . . 34.4 t80 -47.56 -50.75 23.08 Favored 'General case' 0 N--CA 1.45 -0.45 0 C-N-CA 123.445 0.698 . . . . 0.0 109.878 178.872 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 57.7 mt-10 -61.97 -53.14 59.73 Favored 'General case' 0 CA--C 1.53 0.173 0 C-N-CA 122.59 0.356 . . . . 0.0 110.781 178.385 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 39.4 tttm -44.0 -49.64 8.56 Favored 'General case' 0 CA--C 1.527 0.092 0 C-N-CA 124.986 1.314 . . . . 0.0 111.022 178.624 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 57.6 m-85 -78.38 -52.41 8.62 Favored 'General case' 0 N--CA 1.45 -0.437 0 CA-C-O 119.409 -0.329 . . . . 0.0 110.613 -177.64 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -48.01 -60.65 2.45 Favored 'General case' 0 C--N 1.331 -0.199 0 C-N-CA 124.083 0.953 . . . . 0.0 111.043 -179.444 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.529 0.167 0 C-N-CA 125.148 1.379 . . . . 0.0 113.051 -177.411 . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' A' A ' 20' ' ' PRO . . . . . . . . . . . . . 12.0 Cg_endo . . . . . 0 CA--C 1.536 0.583 0 N-CA-C 114.533 0.936 . . . . 0.0 114.533 . . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 51.8 m-80 -88.58 2.9 52.17 Favored 'General case' 0 CA--C 1.536 0.429 0 C-N-CA 124.77 1.228 . . . . 0.0 113.105 -179.611 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -149.38 116.43 6.01 Favored 'General case' 0 CA--C 1.541 0.619 0 CA-C-N 119.187 0.903 . . . . 0.0 112.683 -169.039 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 77.9 mt -88.2 134.3 33.82 Favored 'General case' 0 CA--C 1.532 0.288 0 C-N-CA 124.563 1.145 . . . . 0.0 111.095 173.654 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 27.5 p -80.38 178.73 8.1 Favored 'General case' 0 CA--C 1.534 0.341 0 N-CA-C 108.543 -0.91 . . . . 0.0 108.543 166.389 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 64.4 mttp -57.98 -38.95 77.01 Favored 'General case' 0 N--CA 1.455 -0.218 0 N-CA-C 109.806 -0.442 . . . . 0.0 109.806 170.127 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 1.8 mp0 -67.95 -50.74 54.13 Favored 'General case' 0 N--CA 1.45 -0.433 0 C-N-CA 122.883 0.473 . . . . 0.0 110.035 -175.755 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 3.0 mp0 -55.79 -44.77 78.1 Favored 'General case' 0 N--CA 1.452 -0.361 0 C-N-CA 119.826 -0.75 . . . . 0.0 110.236 174.87 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 12.7 mt -56.85 -43.43 81.13 Favored 'General case' 0 CA--C 1.513 -0.454 0 CA-C-N 119.067 0.849 . . . . 0.0 113.153 171.798 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 64.5 tttm -60.31 -48.76 80.38 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-N 118.505 0.593 . . . . 0.0 109.679 -178.444 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 87.2 mt -60.16 -47.47 85.8 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.179 -0.464 . . . . 0.0 111.375 178.166 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 7.6 tt -51.99 -57.64 8.87 Favored 'General case' 0 N--CA 1.456 -0.143 0 C-N-CA 124.175 0.99 . . . . 0.0 109.497 175.721 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 47.6 mt -56.0 -54.24 47.21 Favored 'General case' 0 C--O 1.223 -0.298 0 N-CA-C 108.717 -0.845 . . . . 0.0 108.717 -178.54 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 28.3 tt0 -53.65 -49.77 67.21 Favored 'General case' 0 N--CA 1.451 -0.387 0 C-N-CA 123.777 0.831 . . . . 0.0 111.652 -176.296 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 2.1 m -73.75 -52.76 12.1 Favored 'General case' 0 CA--C 1.531 0.223 0 C-N-CA 120.684 -0.407 . . . . 0.0 110.984 -175.546 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 57.3 mm-40 -87.22 -31.91 20.06 Favored 'General case' 0 N--CA 1.448 -0.555 0 C-N-CA 123.183 0.593 . . . . 0.0 112.426 -166.595 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 74.5 m-85 . . . . . 0 CA--C 1.534 0.335 0 C-N-CA 123.425 0.69 . . . . 0.0 111.604 -172.341 . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 19.5 mt . . . . . 0 CA--C 1.517 -0.316 0 N-CA-C 108.658 -0.867 . . . . 0.0 108.658 . . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 3.4 m-20 -50.3 -44.89 54.23 Favored 'General case' 0 N--CA 1.453 -0.29 0 C-N-CA 125.261 1.425 . . . . 0.0 111.528 -176.219 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 5.9 mp0 -59.57 -48.21 82.53 Favored 'General case' 0 C--N 1.328 -0.327 0 C-N-CA 123.702 0.801 . . . . 0.0 110.468 176.907 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 1.3 tt -58.64 -50.96 71.94 Favored 'General case' 0 CA--C 1.534 0.335 0 CA-C-O 121.824 0.821 . . . . 0.0 109.264 177.573 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 50' ' ' PHE . . . . . . . . . . . . . 52.4 t80 -51.55 -50.55 59.83 Favored 'General case' 0 N--CA 1.452 -0.336 0 C-N-CA 124.778 1.231 . . . . 0.0 110.537 178.246 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 27.0 tp10 -60.81 -43.54 98.06 Favored 'General case' 0 N--CA 1.454 -0.253 0 C-N-CA 122.879 0.472 . . . . 0.0 110.587 177.528 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 12.8 tm-20 -54.61 -43.27 72.05 Favored 'General case' 0 CA--C 1.533 0.316 0 C-N-CA 122.763 0.425 . . . . 0.0 110.756 177.079 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 92.1 mt -68.28 -64.42 0.87 Allowed 'General case' 0 N--CA 1.452 -0.341 0 C-N-CA 122.698 0.399 . . . . 0.0 110.918 175.486 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 18.2 t0 . . . . . 0 N--CA 1.455 -0.202 0 C-N-CA 124.466 1.106 . . . . 0.0 109.438 178.935 . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 31.7 mt-10 . . . . . 0 N--CA 1.456 -0.14 0 N-CA-C 106.722 -1.584 . . . . 0.0 106.722 . . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' A' A ' 61' ' ' VAL . . . . . . . . . . . . . 65.5 t -109.92 103.05 14.87 Favored 'Isoleucine or valine' 0 CA--C 1.529 0.137 0 CA-C-N 118.184 0.447 . . . . 0.0 110.231 -169.164 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 11.9 t -78.81 170.96 15.86 Favored 'General case' 0 CA--C 1.535 0.374 0 CA-C-O 121.16 0.505 . . . . 0.0 111.383 172.52 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 63' ' ' PHE . . . . . . . . . . . . . 57.3 t80 -63.85 -39.58 94.54 Favored 'General case' 0 C--O 1.232 0.137 0 C-N-CA 122.713 0.405 . . . . 0.0 111.332 -173.062 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 50.2 mt-10 -61.4 -58.39 8.41 Favored 'General case' 0 N--CA 1.452 -0.359 0 O-C-N 122.088 -0.383 . . . . 0.0 110.025 -178.745 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 10.8 pt-20 -61.27 -36.4 79.94 Favored 'General case' 0 CA--C 1.537 0.458 0 O-C-N 121.707 -0.621 . . . . 0.0 111.547 178.574 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 24.7 t80 -52.97 -26.68 15.98 Favored 'General case' 0 CA--C 1.54 0.562 0 O-C-N 121.313 -0.867 . . . . 0.0 112.585 169.777 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 67' ' ' GLN . . . . . . . . . . . . . 40.2 mm-40 -54.81 -25.64 29.67 Favored 'General case' 0 CA--C 1.537 0.463 0 CA-C-N 119.819 1.191 . . . . 0.0 112.926 173.051 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 96.5 t -54.58 -32.69 25.53 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.605 0 CA-C-N 118.685 0.675 . . . . 0.0 110.458 172.238 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -77.16 -50.28 13.34 Favored 'General case' 0 N--CA 1.455 -0.211 0 C-N-CA 124.684 1.193 . . . . 0.0 108.696 172.931 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 70' ' ' VAL . . . . . . . . . . . . . 98.0 t . . . . . 0 N--CA 1.465 0.314 0 O-C-N 121.861 -0.525 . . . . 0.0 111.702 -177.674 . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 88.6 Cg_exo . . . . . 0 N--CA 1.458 -0.587 0 N-CA-C 112.58 0.185 . . . . 0.0 112.58 . . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 48.4 mt-10 -60.93 -50.23 74.24 Favored 'General case' 0 C--O 1.232 0.177 0 C-N-CA 123.335 0.654 . . . . 0.0 110.841 177.357 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 45.1 mm-40 -59.58 -46.01 90.18 Favored 'General case' 0 N--CA 1.453 -0.281 0 N-CA-C 108.794 -0.817 . . . . 0.0 108.794 178.008 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 25.6 mt -57.9 -40.1 79.5 Favored 'General case' 0 N--CA 1.445 -0.703 0 CA-C-O 118.653 -0.689 . . . . 0.0 112.333 178.235 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 20.6 tptm -59.5 -52.33 66.02 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 119.506 1.048 . . . . 0.0 110.168 171.94 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . -49.89 -53.84 20.63 Favored Glycine 0 CA--C 1.536 1.372 0 N-CA-C 111.699 -0.561 . . . . 0.0 111.699 177.927 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 9' ' ' ILE . . . . . . . . . . . . . 1.6 mm -53.7 -56.4 9.08 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.163 0 C-N-CA 127.007 2.123 . . . . 0.0 108.825 175.826 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 10' ' ' PHE . . . . . . . . . . . . . 24.0 t80 -49.36 -50.53 39.56 Favored 'General case' 0 N--CA 1.444 -0.732 0 C-N-CA 123.406 0.683 . . . . 0.0 109.374 -179.27 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 53.1 mt-10 -62.41 -48.07 81.31 Favored 'General case' 0 N--CA 1.453 -0.29 0 C-N-CA 123.196 0.598 . . . . 0.0 110.833 -179.147 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 37.1 tttm -44.2 -51.45 8.18 Favored 'General case' 0 CA--C 1.529 0.163 0 C-N-CA 124.006 0.923 . . . . 0.0 111.002 177.207 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 85.1 m-85 -79.38 -49.28 12.61 Favored 'General case' 0 CA--C 1.535 0.376 0 CA-C-O 120.546 0.212 . . . . 0.0 111.12 -177.245 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -55.67 -39.02 70.39 Favored 'General case' 0 N--CA 1.464 0.243 0 C-N-CA 124.532 1.133 . . . . 0.0 112.558 -177.428 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.532 0.279 0 C-N-CA 123.411 0.684 . . . . 0.0 111.807 175.794 . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' A' A ' 20' ' ' PRO . . . . . . . . . . . . . 32.8 Cg_endo . . . . . 0 N--CA 1.456 -0.725 0 N-CA-C 112.414 0.121 . . . . 0.0 112.414 . . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 41.9 m-80 -85.42 -5.02 59.33 Favored 'General case' 0 N--CA 1.452 -0.331 0 C-N-CA 124.526 1.13 . . . . 0.0 113.205 -174.167 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 27.8 tt0 -142.91 126.34 16.72 Favored 'General case' 0 CA--C 1.543 0.679 0 CA-C-N 119.513 1.051 . . . . 0.0 113.823 -169.553 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 70.4 mt -103.94 138.27 40.75 Favored 'General case' 0 C--N 1.345 0.393 0 C-N-CA 125.451 1.5 . . . . 0.0 112.15 -179.413 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 77.9 p -80.56 172.76 13.34 Favored 'General case' 0 C--O 1.234 0.259 0 C-N-CA 123.966 0.906 . . . . 0.0 109.722 168.021 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 98.3 mttt -55.41 -45.07 76.71 Favored 'General case' 0 C--O 1.226 -0.172 0 N-CA-C 110.169 -0.308 . . . . 0.0 110.169 172.045 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 22.9 mt-10 -65.85 -46.99 76.45 Favored 'General case' 0 CA--C 1.516 -0.336 0 CA-C-O 120.785 0.326 . . . . 0.0 110.559 -175.96 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -61.67 -39.92 93.12 Favored 'General case' 0 C--N 1.327 -0.374 0 C-N-CA 120.062 -0.655 . . . . 0.0 110.056 177.844 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 13.5 mt -57.47 -47.59 81.45 Favored 'General case' 0 C--O 1.218 -0.593 0 CA-C-N 119.346 0.975 . . . . 0.0 111.897 168.554 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 38.4 ttpt -58.08 -47.26 83.75 Favored 'General case' 0 C--N 1.323 -0.582 0 CA-C-N 119.002 0.819 . . . . 0.0 110.077 -175.95 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 3.7 mm? -59.59 -48.04 83.2 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.351 -0.386 . . . . 0.0 111.475 175.498 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 7.9 tt -51.23 -57.49 8.67 Favored 'General case' 0 N--CA 1.456 -0.136 0 C-N-CA 123.563 0.745 . . . . 0.0 109.896 176.061 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 48.0 mt -57.93 -51.2 70.62 Favored 'General case' 0 C--O 1.223 -0.292 0 N-CA-C 109.546 -0.539 . . . . 0.0 109.546 -179.247 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 17.5 tt0 -54.67 -44.15 73.05 Favored 'General case' 0 N--CA 1.452 -0.344 0 O-C-N 121.744 -0.597 . . . . 0.0 111.755 -176.598 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 2.1 m -77.85 -49.03 15.07 Favored 'General case' 0 CA--C 1.534 0.36 0 C-N-CA 120.92 -0.312 . . . . 0.0 111.316 -177.611 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 67.1 mm-40 -96.79 -27.9 14.52 Favored 'General case' 0 N--CA 1.451 -0.383 0 N-CA-C 114.015 1.117 . . . . 0.0 114.015 -165.716 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 97.9 m-85 . . . . . 0 CA--C 1.538 0.513 0 C-N-CA 124.559 1.144 . . . . 0.0 112.2 -176.592 . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 66.9 tp . . . . . 0 C--O 1.225 -0.192 0 N-CA-C 112.274 0.472 . . . . 0.0 112.274 . . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 6.2 m-20 -59.21 -51.51 69.66 Favored 'General case' 0 N--CA 1.45 -0.431 0 C-N-CA 123.017 0.527 . . . . 0.0 110.829 -179.54 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 38.1 mm-40 -61.41 -43.96 97.96 Favored 'General case' 0 N--CA 1.453 -0.317 0 CA-C-N 116.291 -0.413 . . . . 0.0 110.394 -179.905 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 67.0 tp -56.99 -50.65 72.05 Favored 'General case' 0 N--CA 1.451 -0.38 0 N-CA-C 109.431 -0.581 . . . . 0.0 109.431 175.724 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 50' ' ' PHE . . . . . . . . . . . . . 65.4 t80 -54.06 -50.85 65.82 Favored 'General case' 0 N--CA 1.45 -0.439 0 C-N-CA 123.806 0.842 . . . . 0.0 110.508 -178.982 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 59.0 mm-40 -58.22 -47.51 83.27 Favored 'General case' 0 CA--C 1.532 0.267 0 CA-C-O 120.629 0.252 . . . . 0.0 111.151 175.683 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 40.7 tt0 -55.28 -40.3 70.87 Favored 'General case' 0 CA--C 1.531 0.238 0 C-N-CA 123.526 0.73 . . . . 0.0 111.338 179.279 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 84.3 mt -77.18 -49.28 15.52 Favored 'General case' 0 N--CA 1.448 -0.567 0 C-N-CA 122.99 0.516 . . . . 0.0 111.492 -179.341 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 43.8 t0 . . . . . 0 CA--C 1.536 0.409 0 C-N-CA 123.828 0.851 . . . . 0.0 111.586 -175.799 . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 42.0 mt-10 . . . . . 0 N--CA 1.452 -0.338 0 N-CA-C 106.137 -1.801 . . . . 0.0 106.137 . . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' A' A ' 61' ' ' VAL . . . . . . . . . . . . . 16.1 t -102.32 116.22 45.61 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.149 0 N-CA-C 108.807 -0.812 . . . . 0.0 108.807 -179.028 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 78.3 p -79.99 156.67 27.08 Favored 'General case' 0 CA--C 1.537 0.458 0 C-N-CA 122.934 0.493 . . . . 0.0 111.248 174.966 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 63' ' ' PHE . . . . . . . . . . . . . 77.2 t80 -56.11 -32.88 64.59 Favored 'General case' 0 N--CA 1.467 0.383 0 N-CA-C 113.31 0.856 . . . . 0.0 113.31 -178.361 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 13.0 tp10 -65.42 -62.45 1.52 Allowed 'General case' 0 N--CA 1.453 -0.288 0 O-C-N 121.882 -0.511 . . . . 0.0 109.624 178.495 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 12.0 pt-20 -64.97 -27.15 68.64 Favored 'General case' 0 CA--C 1.54 0.578 0 O-C-N 121.182 -0.948 . . . . 0.0 111.553 -177.023 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 15.5 t80 -50.97 -27.53 7.86 Favored 'General case' 0 CA--C 1.534 0.33 0 C-N-CA 123.499 0.72 . . . . 0.0 112.176 168.828 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 67' ' ' GLN . . . . . . . . . . . . . 66.8 mm-40 -53.88 -24.29 15.45 Favored 'General case' 0 CA--C 1.54 0.559 0 CA-C-N 119.814 1.188 . . . . 0.0 113.058 173.314 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 97.2 t -57.06 -31.26 36.46 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.631 0 O-C-N 121.043 -1.036 . . . . 0.0 111.24 171.796 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 7.5 tt -71.93 -44.22 63.99 Favored 'General case' 0 N--CA 1.457 -0.094 0 N-CA-C 107.721 -1.214 . . . . 0.0 107.721 177.959 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 70' ' ' VAL . . . . . . . . . . . . . 18.2 t . . . . . 0 CA--C 1.532 0.286 0 N-CA-C 109.804 -0.443 . . . . 0.0 109.804 178.07 . . . . . . . . 0 0 . 1 . 011 nuclear orig core ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 84.8 Cg_exo . . . . . 0 N--CA 1.456 -0.71 0 N-CA-C 112.364 0.102 . . . . 0.0 112.364 . . . . . . . . . 0 0 . 1 . 011 nuclear orig core ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 44.7 mt-10 -62.71 -48.94 77.06 Favored 'General case' 0 CA--C 1.529 0.162 0 C-N-CA 123.657 0.783 . . . . 0.0 111.395 176.652 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 29.0 mt-10 -60.11 -46.46 89.55 Favored 'General case' 0 C--N 1.332 -0.164 0 N-CA-C 109.148 -0.686 . . . . 0.0 109.148 177.18 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 27.4 mt -60.29 -39.34 86.55 Favored 'General case' 0 N--CA 1.447 -0.585 0 C-N-CA 123.031 0.532 . . . . 0.0 111.953 179.087 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 19.7 tptm -58.86 -49.12 78.92 Favored 'General case' 0 C--N 1.332 -0.175 0 O-C-N 121.678 -0.639 . . . . 0.0 110.046 170.029 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . -51.66 -50.68 41.87 Favored Glycine 0 CA--C 1.529 0.941 0 N-CA-C 110.401 -1.08 . . . . 0.0 110.401 178.686 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 9' ' ' ILE . . . . . . . . . . . . . 24.4 mm -57.6 -54.95 24.52 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.252 0 C-N-CA 125.324 1.45 . . . . 0.0 109.894 175.795 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 10' ' ' PHE . . . . . . . . . . . . . 25.6 t80 -48.36 -50.84 28.97 Favored 'General case' 0 N--CA 1.446 -0.673 0 O-C-N 121.747 -0.596 . . . . 0.0 109.673 179.815 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 43.6 mt-10 -64.4 -46.69 82.21 Favored 'General case' 0 N--CA 1.453 -0.298 0 CA-C-O 118.687 -0.673 . . . . 0.0 111.429 179.596 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 29.2 ttmt -43.37 -53.3 5.41 Favored 'General case' 0 N--CA 1.464 0.24 0 C-N-CA 124.072 0.949 . . . . 0.0 110.469 175.947 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 80.3 m-85 -78.86 -47.84 15.82 Favored 'General case' 0 N--CA 1.451 -0.392 0 CA-C-N 116.544 -0.298 . . . . 0.0 110.829 -175.346 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -56.75 -45.48 81.99 Favored 'General case' 0 CA--C 1.533 0.32 0 CA-C-O 121.654 0.74 . . . . 0.0 112.1 -177.919 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.53 0.193 0 C-N-CA 123.96 0.904 . . . . 0.0 111.777 175.967 . . . . . . . . 0 0 . 1 . 011 nuclear orig core ' A' A ' 20' ' ' PRO . . . . . . . . . . . . . 29.3 Cg_endo . . . . . 0 N--CA 1.456 -0.702 0 N-CA-C 113.124 0.394 . . . . 0.0 113.124 . . . . . . . . . 0 0 . 1 . 011 nuclear orig core ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 43.1 m-80 -89.81 -6.14 56.22 Favored 'General case' 0 CA--C 1.531 0.228 0 C-N-CA 124.539 1.136 . . . . 0.0 113.601 -170.571 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 30.0 tt0 -148.09 126.35 12.24 Favored 'General case' 0 CA--C 1.541 0.606 0 CA-C-N 119.39 0.995 . . . . 0.0 112.492 -168.138 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 51.2 mt -103.31 135.88 44.13 Favored 'General case' 0 C--N 1.344 0.361 0 C-N-CA 125.295 1.438 . . . . 0.0 111.117 -178.649 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 7.0 p -88.6 178.06 6.61 Favored 'General case' 0 C--O 1.236 0.376 0 N-CA-C 108.475 -0.935 . . . . 0.0 108.475 167.162 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 99.1 mttt -54.16 -43.65 70.77 Favored 'General case' 0 N--CA 1.454 -0.231 0 C-N-CA 122.991 0.516 . . . . 0.0 111.299 -179.754 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 34.3 tt0 -65.84 -46.38 78.73 Favored 'General case' 0 N--CA 1.456 -0.14 0 O-C-N 121.995 -0.441 . . . . 0.0 110.602 -175.636 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 4.1 mp0 -58.39 -45.31 88.57 Favored 'General case' 0 N--CA 1.453 -0.322 0 N-CA-C 109.474 -0.565 . . . . 0.0 109.474 176.609 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 18.9 mt -57.39 -42.02 81.37 Favored 'General case' 0 CA--C 1.512 -0.489 0 C-N-CA 120.288 -0.565 . . . . 0.0 112.262 173.279 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 25.3 ttpp -61.71 -50.96 70.34 Favored 'General case' 0 N--CA 1.447 -0.582 0 CA-C-N 118.725 0.693 . . . . 0.0 109.479 -178.113 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 83.3 mt -59.83 -46.02 90.56 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-O 120.847 0.356 . . . . 0.0 111.398 178.972 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 8.0 tt -53.31 -55.92 20.78 Favored 'General case' 0 C--N 1.332 -0.168 0 C-N-CA 124.002 0.921 . . . . 0.0 109.518 174.695 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 38.4 mt -54.14 -54.39 40.24 Favored 'General case' 0 C--O 1.226 -0.178 0 C-N-CA 123.517 0.727 . . . . 0.0 109.689 -179.412 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 41.2 mt-30 -51.32 -51.84 50.68 Favored 'General case' 0 N--CA 1.457 -0.087 0 C-N-CA 122.954 0.502 . . . . 0.0 111.432 179.249 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 7.0 m -70.19 -53.95 14.93 Favored 'General case' 0 N--CA 1.455 -0.205 0 CA-C-N 116.485 -0.325 . . . . 0.0 111.149 -172.483 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 42.5 mm-40 -94.05 -34.84 12.85 Favored 'General case' 0 N--CA 1.45 -0.438 0 N-CA-C 113.134 0.79 . . . . 0.0 113.134 -167.671 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 17.3 m-85 . . . . . 0 CA--C 1.53 0.209 0 C-N-CA 122.626 0.37 . . . . 0.0 111.82 -170.571 . . . . . . . . 0 0 . 1 . 011 nuclear orig core ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 56.8 tp . . . . . 0 C--O 1.224 -0.265 0 CA-C-O 120.781 0.324 . . . . 0.0 110.254 . . . . . . . . . 0 0 . 1 . 011 nuclear orig core ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 5.5 m-20 -56.88 -55.48 33.92 Favored 'General case' 0 N--CA 1.452 -0.325 0 C-N-CA 124.271 1.028 . . . . 0.0 111.313 177.571 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 31.1 mm-40 -59.08 -42.83 91.38 Favored 'General case' 0 C--N 1.331 -0.213 0 O-C-N 122.222 -0.299 . . . . 0.0 111.119 178.692 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 59.1 tp -59.19 -47.42 85.37 Favored 'General case' 0 CA--C 1.531 0.233 0 CA-C-O 121.207 0.527 . . . . 0.0 110.055 176.485 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 50' ' ' PHE . . . . . . . . . . . . . 59.7 t80 -55.03 -49.35 71.78 Favored 'General case' 0 N--CA 1.452 -0.371 0 C-N-CA 123.914 0.885 . . . . 0.0 109.888 178.989 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 78.3 mm-40 -59.2 -46.07 89.4 Favored 'General case' 0 N--CA 1.455 -0.209 0 CA-C-O 120.443 0.163 . . . . 0.0 111.42 175.11 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 36.8 tt0 -52.14 -45.08 64.87 Favored 'General case' 0 CA--C 1.531 0.224 0 C-N-CA 122.735 0.414 . . . . 0.0 111.016 177.651 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 96.4 mt -68.68 -59.58 3.01 Favored 'General case' 0 N--CA 1.451 -0.393 0 C-N-CA 122.982 0.513 . . . . 0.0 110.846 177.655 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 12.0 t0 . . . . . 0 N--CA 1.455 -0.202 0 C-N-CA 125.648 1.579 . . . . 0.0 110.136 178.209 . . . . . . . . 0 0 . 1 . 011 nuclear orig core ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 25.6 mt-10 . . . . . 0 N--CA 1.453 -0.299 0 N-CA-C 105.829 -1.915 . . . . 0.0 105.829 . . . . . . . . . 0 0 . 1 . 011 nuclear orig core ' A' A ' 61' ' ' VAL . . . . . . . . . . . . . 98.7 t -113.68 110.2 31.27 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.248 0 N-CA-C 108.924 -0.769 . . . . 0.0 108.924 -179.248 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 4.6 m -79.23 163.21 25.16 Favored 'General case' 0 CA--C 1.535 0.39 0 C-N-CA 124.699 1.2 . . . . 0.0 110.648 174.126 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 63' ' ' PHE . . . . . . . . . . . . . 64.9 t80 -58.48 -34.63 71.1 Favored 'General case' 0 N--CA 1.466 0.33 0 N-CA-C 113.084 0.772 . . . . 0.0 113.084 -177.563 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 12.7 tp10 -65.17 -60.63 2.79 Favored 'General case' 0 CA--C 1.533 0.32 0 O-C-N 121.931 -0.481 . . . . 0.0 109.896 178.255 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 9.9 pt-20 -61.83 -30.9 71.14 Favored 'General case' 0 CA--C 1.539 0.52 0 O-C-N 121.376 -0.827 . . . . 0.0 111.679 -178.506 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 20.6 t80 -51.35 -30.53 18.97 Favored 'General case' 0 CA--C 1.535 0.396 0 O-C-N 121.462 -0.774 . . . . 0.0 112.476 169.019 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 67' ' ' GLN . . . . . . . . . . . . . 77.9 mm-40 -55.52 -23.52 26.77 Favored 'General case' 0 CA--C 1.537 0.461 0 CA-C-N 119.723 1.147 . . . . 0.0 112.769 174.224 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 90.7 t -60.35 -33.09 52.67 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.563 0 CA-C-N 119.512 1.051 . . . . 0.0 110.789 172.068 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 3.2 tm? -72.71 -49.69 29.57 Favored 'General case' 0 N--CA 1.457 -0.085 0 N-CA-C 106.997 -1.483 . . . . 0.0 106.997 -179.35 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 70' ' ' VAL . . . . . . . . . . . . . 22.0 t . . . . . 0 CA--C 1.536 0.406 0 C-N-CA 122.845 0.458 . . . . 0.0 109.982 176.705 . . . . . . . . 0 0 . 1 . 012 nuclear orig core ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 86.2 Cg_exo . . . . . 0 N--CA 1.458 -0.616 0 CA-C-O 120.571 0.155 . . . . 0.0 112.015 . . . . . . . . . 0 0 . 1 . 012 nuclear orig core ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 48.9 mt-10 -62.2 -49.43 75.81 Favored 'General case' 0 N--CA 1.455 -0.191 0 C-N-CA 123.534 0.734 . . . . 0.0 111.105 177.578 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 2.4 tm-20 -62.4 -43.33 99.08 Favored 'General case' 0 CA--C 1.531 0.215 0 N-CA-C 108.414 -0.958 . . . . 0.0 108.414 -179.483 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 31.7 mt -59.99 -39.85 87.15 Favored 'General case' 0 N--CA 1.45 -0.475 0 C-N-CA 124.245 1.018 . . . . 0.0 111.732 176.827 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 54.8 tptt -59.35 -50.46 73.87 Favored 'General case' 0 C--N 1.333 -0.14 0 CA-C-N 118.986 0.812 . . . . 0.0 110.157 170.575 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . -49.22 -53.65 18.57 Favored Glycine 0 CA--C 1.532 1.127 0 N-CA-C 111.246 -0.742 . . . . 0.0 111.246 177.346 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 9' ' ' ILE . . . . . . . . . . . . . 1.6 mm -56.52 -54.49 27.93 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.226 0 C-N-CA 125.81 1.644 . . . . 0.0 109.209 176.565 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 10' ' ' PHE . . . . . . . . . . . . . 19.6 t80 -48.03 -51.35 24.47 Favored 'General case' 0 N--CA 1.447 -0.607 0 C-N-CA 123.304 0.642 . . . . 0.0 109.562 179.574 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 52.8 mt-10 -62.41 -49.89 73.67 Favored 'General case' 0 N--CA 1.455 -0.196 0 C-N-CA 123.374 0.67 . . . . 0.0 110.727 -179.749 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 45.4 tttp -43.78 -50.9 7.63 Favored 'General case' 0 CA--C 1.528 0.098 0 C-N-CA 124.094 0.958 . . . . 0.0 110.87 177.606 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 75.4 m-85 -79.56 -47.92 14.7 Favored 'General case' 0 CA--C 1.528 0.13 0 N-CA-C 111.836 0.31 . . . . 0.0 111.836 -177.937 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -57.07 -31.21 64.98 Favored 'General case' 0 N--CA 1.466 0.354 0 C-N-CA 124.902 1.281 . . . . 0.0 112.859 -178.628 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.421 0 O-C-N 121.872 -0.517 . . . . 0.0 111.472 174.767 . . . . . . . . 0 0 . 1 . 012 nuclear orig core ' A' A ' 20' ' ' PRO . . . . . . . . . . . . . 22.9 Cg_endo . . . . . 0 CA--C 1.536 0.593 0 N-CA-C 113.35 0.481 . . . . 0.0 113.35 . . . . . . . . . 0 0 . 1 . 012 nuclear orig core ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 41.9 m-80 -94.05 3.28 55.55 Favored 'General case' 0 CA--C 1.533 0.315 0 C-N-CA 125.303 1.441 . . . . 0.0 113.205 -178.487 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 51.0 tt0 -139.59 124.12 18.25 Favored 'General case' 0 CA--C 1.539 0.555 0 CA-C-N 119.109 0.868 . . . . 0.0 112.134 -176.891 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 60.4 mt -100.16 136.55 39.89 Favored 'General case' 0 C--N 1.343 0.311 0 C-N-CA 123.908 0.883 . . . . 0.0 110.667 175.768 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 99.0 p -88.07 175.44 7.74 Favored 'General case' 0 CA--C 1.535 0.371 0 C-N-CA 123.75 0.82 . . . . 0.0 108.956 167.107 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 98.7 mttt -56.28 -46.17 79.85 Favored 'General case' 0 C--O 1.226 -0.148 0 O-C-N 121.968 -0.457 . . . . 0.0 111.288 179.556 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 29.0 tp10 -64.74 -45.14 87.76 Favored 'General case' 0 N--CA 1.455 -0.177 0 CA-C-O 121.034 0.445 . . . . 0.0 110.719 -177.312 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 58.8 mt-10 -56.88 -47.59 80.12 Favored 'General case' 0 N--CA 1.451 -0.42 0 N-CA-C 109.725 -0.472 . . . . 0.0 109.725 176.069 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 16.1 mt -55.86 -43.85 77.51 Favored 'General case' 0 CA--C 1.513 -0.474 0 N-CA-C 112.783 0.66 . . . . 0.0 112.783 170.994 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 63.3 tttp -59.09 -52.27 66.45 Favored 'General case' 0 C--N 1.323 -0.563 0 CA-C-N 118.839 0.745 . . . . 0.0 109.624 -177.145 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 81.2 mt -58.72 -48.97 79.32 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 115.816 -0.629 . . . . 0.0 110.748 178.866 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 9.6 tt -50.64 -55.12 17.86 Favored 'General case' 0 C--O 1.233 0.216 0 C-N-CA 124.007 0.923 . . . . 0.0 110.17 175.914 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 38.3 mt -56.81 -56.85 16.3 Favored 'General case' 0 N--CA 1.456 -0.174 0 C-N-CA 124.061 0.944 . . . . 0.0 110.086 -178.601 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -57.93 -50.37 73.59 Favored 'General case' 0 N--CA 1.455 -0.217 0 C-N-CA 122.552 0.341 . . . . 0.0 110.635 -175.568 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 9.1 m -65.11 -52.49 55.09 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.477 -0.329 . . . . 0.0 111.232 -175.036 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 76.1 mm-40 -103.58 -24.44 13.4 Favored 'General case' 0 N--CA 1.452 -0.348 0 N-CA-C 114.906 1.447 . . . . 0.0 114.906 -165.361 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 46.5 m-85 . . . . . 0 C--O 1.235 0.332 0 CA-C-N 119.263 0.938 . . . . 0.0 112.624 -171.795 . . . . . . . . 0 0 . 1 . 012 nuclear orig core ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 18.5 mt . . . . . 0 N--CA 1.451 -0.394 0 N-CA-C 108.152 -1.055 . . . . 0.0 108.152 . . . . . . . . . 0 0 . 1 . 012 nuclear orig core ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 5.5 m-20 -54.99 -56.38 20.4 Favored 'General case' 0 N--CA 1.451 -0.424 0 C-N-CA 124.527 1.131 . . . . 0.0 111.633 177.425 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 32.5 mt-10 -55.15 -48.1 74.2 Favored 'General case' 0 C--N 1.334 -0.089 0 C-N-CA 122.097 0.159 . . . . 0.0 110.706 176.377 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 55.9 tp -57.66 -47.6 81.83 Favored 'General case' 0 CA--C 1.532 0.263 0 CA-C-O 121.385 0.612 . . . . 0.0 110.47 179.649 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 50' ' ' PHE . . . . . . . . . . . . . 50.0 t80 -57.04 -48.93 77.34 Favored 'General case' 0 N--CA 1.452 -0.368 0 C-N-CA 124.467 1.107 . . . . 0.0 109.864 -179.874 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 33.9 tt0 -61.76 -40.44 95.17 Favored 'General case' 0 N--CA 1.453 -0.284 0 C-N-CA 122.788 0.435 . . . . 0.0 111.16 177.93 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 70.2 tt0 -59.0 -46.51 87.98 Favored 'General case' 0 C--N 1.331 -0.203 0 C-N-CA 123.092 0.557 . . . . 0.0 110.422 176.384 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 84.4 mt -66.38 -56.29 11.77 Favored 'General case' 0 N--CA 1.452 -0.345 0 C-N-CA 123.465 0.706 . . . . 0.0 111.133 -179.52 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 14.2 t0 . . . . . 0 N--CA 1.453 -0.307 0 C-N-CA 124.376 1.07 . . . . 0.0 108.985 -176.367 . . . . . . . . 0 0 . 1 . 012 nuclear orig core ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 42.6 mp0 . . . . . 0 N--CA 1.457 -0.098 0 N-CA-C 105.94 -1.874 . . . . 0.0 105.94 . . . . . . . . . 0 0 . 1 . 012 nuclear orig core ' A' A ' 61' ' ' VAL . . . . . . . . . . . . . 39.9 t -118.28 103.79 15.19 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.241 0 N-CA-C 109.136 -0.69 . . . . 0.0 109.136 176.678 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 18.6 t -79.2 167.37 21.07 Favored 'General case' 0 CA--C 1.532 0.282 0 C-N-CA 123.01 0.524 . . . . 0.0 111.345 172.335 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 63' ' ' PHE . . . . . . . . . . . . . 63.1 t80 -60.41 -34.8 74.47 Favored 'General case' 0 CA--C 1.53 0.211 0 C-N-CA 123.204 0.602 . . . . 0.0 112.518 -172.733 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 7.6 tm-20 -64.17 -61.77 2.05 Favored 'General case' 0 CA--C 1.533 0.327 0 N-CA-C 109.476 -0.565 . . . . 0.0 109.476 178.11 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 14.7 pt-20 -59.86 -33.44 71.81 Favored 'General case' 0 CA--C 1.537 0.463 0 O-C-N 121.62 -0.675 . . . . 0.0 111.741 -179.472 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 19.6 t80 -53.03 -25.76 13.48 Favored 'General case' 0 CA--C 1.536 0.415 0 C-N-CA 123.902 0.881 . . . . 0.0 112.897 169.668 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 67' ' ' GLN . . . . . . . . . . . . . 73.2 mm-40 -55.81 -24.75 37.92 Favored 'General case' 0 CA--C 1.538 0.492 0 O-C-N 120.785 -1.197 . . . . 0.0 112.435 171.795 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 74.0 t -61.01 -33.98 58.02 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.547 0 O-C-N 121.086 -1.009 . . . . 0.0 110.339 170.467 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 14.1 tp -73.07 -39.82 65.55 Favored 'General case' 0 C--O 1.225 -0.223 0 O-C-N 120.885 -1.134 . . . . 0.0 108.15 176.494 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 70' ' ' VAL . . . . . . . . . . . . . 40.9 t . . . . . 0 CA--C 1.539 0.544 0 O-C-N 121.939 -0.475 . . . . 0.0 110.54 173.159 . . . . . . . . 0 0 . 1 . 013 nuclear orig core ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 82.2 Cg_exo . . . . . 0 N--CA 1.456 -0.726 0 N-CA-C 111.621 -0.184 . . . . 0.0 111.621 . . . . . . . . . 0 0 . 1 . 013 nuclear orig core ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 3.1 mp0 -59.39 -50.83 72.43 Favored 'General case' 0 N--CA 1.454 -0.229 0 C-N-CA 123.817 0.847 . . . . 0.0 112.154 176.236 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 15.3 tp10 -57.96 -46.89 84.4 Favored 'General case' 0 N--CA 1.454 -0.239 0 N-CA-C 108.211 -1.033 . . . . 0.0 108.211 178.502 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 25.8 mt -59.59 -37.83 79.6 Favored 'General case' 0 N--CA 1.445 -0.712 0 C-N-CA 124.216 1.007 . . . . 0.0 111.831 179.266 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 1.2 tmtm? -61.86 -48.0 82.51 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 118.843 0.747 . . . . 0.0 109.949 171.94 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . -54.77 -54.67 31.76 Favored Glycine 0 CA--C 1.528 0.867 0 N-CA-C 110.49 -1.044 . . . . 0.0 110.49 178.758 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 9' ' ' ILE . . . . . . . . . . . . . 72.9 mt -50.98 -54.26 11.1 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.184 0 C-N-CA 125.278 1.431 . . . . 0.0 109.967 172.781 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 10' ' ' PHE . . . . . . . . . . . . . 29.5 t80 -51.97 -49.79 62.54 Favored 'General case' 0 N--CA 1.447 -0.609 0 O-C-N 121.715 -0.616 . . . . 0.0 109.719 -176.863 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 54.8 mt-10 -61.85 -53.05 61.18 Favored 'General case' 0 N--CA 1.457 -0.082 0 N-CA-C 110.292 -0.262 . . . . 0.0 110.292 178.847 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 48.9 tttp -44.24 -53.71 6.36 Favored 'General case' 0 C--O 1.227 -0.124 0 C-N-CA 124.52 1.128 . . . . 0.0 110.586 178.064 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 41.8 m-85 -77.4 -41.28 40.63 Favored 'General case' 0 N--CA 1.454 -0.273 0 CA-C-O 119.629 -0.224 . . . . 0.0 111.491 -173.909 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -58.7 -58.73 7.29 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-O 120.848 0.356 . . . . 0.0 110.847 179.036 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.531 0.222 0 C-N-CA 125.121 1.368 . . . . 0.0 113.111 -169.941 . . . . . . . . 0 0 . 1 . 013 nuclear orig core ' A' A ' 20' ' ' PRO . . . . . . . . . . . . . 12.9 Cg_endo . . . . . 0 CA--C 1.537 0.657 0 N-CA-C 114.145 0.787 . . . . 0.0 114.145 . . . . . . . . . 0 0 . 1 . 013 nuclear orig core ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 44.1 m-80 -88.38 -5.67 58.16 Favored 'General case' 0 CA--C 1.535 0.381 0 C-N-CA 124.912 1.285 . . . . 0.0 113.186 -177.214 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 37.4 tt0 -148.64 119.57 7.64 Favored 'General case' 0 CA--C 1.539 0.556 0 CA-C-N 118.797 0.726 . . . . 0.0 112.82 -169.446 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 69.5 mt -88.98 133.91 34.16 Favored 'General case' 0 C--N 1.343 0.312 0 C-N-CA 124.139 0.976 . . . . 0.0 112.544 -175.529 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 27.9 p -77.83 171.71 14.56 Favored 'General case' 0 C--O 1.235 0.29 0 C-N-CA 123.626 0.77 . . . . 0.0 109.457 168.268 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 97.8 mttt -57.99 -46.76 84.67 Favored 'General case' 0 N--CA 1.454 -0.237 0 N-CA-C 110.156 -0.313 . . . . 0.0 110.156 174.245 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 27.4 tp10 -65.08 -44.45 88.86 Favored 'General case' 0 N--CA 1.453 -0.283 0 CA-C-O 120.89 0.376 . . . . 0.0 110.34 -176.895 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 21.1 mt-10 -56.1 -49.51 73.64 Favored 'General case' 0 CA--C 1.536 0.433 0 N-CA-C 109.443 -0.577 . . . . 0.0 109.443 175.289 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 10.2 mt -55.75 -41.88 74.62 Favored 'General case' 0 CA--C 1.514 -0.405 0 N-CA-C 113.324 0.861 . . . . 0.0 113.324 171.661 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 89.1 tttt -59.81 -53.29 59.65 Favored 'General case' 0 C--N 1.323 -0.566 0 CA-C-N 118.737 0.699 . . . . 0.0 109.8 -178.637 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 82.9 mt -58.27 -46.78 85.39 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.968 178.875 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 6.4 tt -51.15 -57.65 8.19 Favored 'General case' 0 C--N 1.332 -0.156 0 C-N-CA 123.836 0.854 . . . . 0.0 109.9 175.415 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 40.0 mt -54.73 -55.13 33.21 Favored 'General case' 0 C--N 1.331 -0.196 0 C-N-CA 124.27 1.028 . . . . 0.0 109.724 -178.433 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 24.2 mt-30 -53.13 -50.95 63.46 Favored 'General case' 0 N--CA 1.454 -0.245 0 C-N-CA 123.484 0.714 . . . . 0.0 111.343 -177.556 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 1.6 m -73.54 -51.15 17.99 Favored 'General case' 0 CA--C 1.532 0.264 0 C-N-CA 120.174 -0.61 . . . . 0.0 111.322 -173.898 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 45.0 mm-40 -94.4 -29.62 14.89 Favored 'General case' 0 N--CA 1.449 -0.5 0 N-CA-C 113.622 0.971 . . . . 0.0 113.622 -166.123 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 75.4 m-85 . . . . . 0 CA--C 1.534 0.365 0 N-CA-C 113.053 0.76 . . . . 0.0 113.053 -173.249 . . . . . . . . 0 0 . 1 . 013 nuclear orig core ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 18.8 mt . . . . . 0 N--CA 1.451 -0.375 0 N-CA-C 108.275 -1.009 . . . . 0.0 108.275 . . . . . . . . . 0 0 . 1 . 013 nuclear orig core ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 5.7 m-20 -58.38 -49.07 78.57 Favored 'General case' 0 N--CA 1.447 -0.595 0 CA-C-N 115.006 -0.997 . . . . 0.0 111.39 178.503 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 51.0 mt-10 -57.9 -50.64 72.65 Favored 'General case' 0 C--N 1.333 -0.125 0 CA-C-N 117.379 0.081 . . . . 0.0 110.931 175.962 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 81.6 mt -57.64 -48.34 79.73 Favored 'General case' 0 CA--C 1.531 0.22 0 CA-C-O 121.376 0.608 . . . . 0.0 109.926 -179.936 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 50' ' ' PHE . . . . . . . . . . . . . 54.6 t80 -55.03 -53.29 57.75 Favored 'General case' 0 N--CA 1.45 -0.466 0 C-N-CA 123.882 0.873 . . . . 0.0 109.879 178.965 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 42.8 tt0 -57.51 -45.74 84.62 Favored 'General case' 0 N--CA 1.454 -0.264 0 C-N-CA 122.895 0.478 . . . . 0.0 110.771 179.503 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 8.5 tm-20 -55.99 -45.97 78.83 Favored 'General case' 0 N--CA 1.454 -0.264 0 C-N-CA 122.998 0.519 . . . . 0.0 110.308 179.433 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 95.8 mt -78.25 -38.21 43.38 Favored 'General case' 0 CA--C 1.533 0.299 0 N-CA-C 112.592 0.59 . . . . 0.0 112.592 -175.364 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 27.5 t0 . . . . . 0 C--N 1.33 -0.274 0 C-N-CA 126.876 2.07 . . . . 0.0 109.674 177.607 . . . . . . . . 0 0 . 1 . 013 nuclear orig core ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 62.4 mt-10 . . . . . 0 N--CA 1.456 -0.157 0 N-CA-C 108.906 -0.775 . . . . 0.0 108.906 . . . . . . . . . 0 0 . 1 . 013 nuclear orig core ' A' A ' 61' ' ' VAL . . . . . . . . . . . . . 2.8 t -83.87 109.77 17.76 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.203 0 O-C-N 122.221 -0.3 . . . . 0.0 111.585 -165.814 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 1.7 m -77.78 153.47 32.82 Favored 'General case' 0 CA--C 1.534 0.352 0 C-N-CA 124.123 0.969 . . . . 0.0 110.741 -177.586 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 63' ' ' PHE . . . . . . . . . . . . . 69.1 t80 -55.31 -38.69 69.0 Favored 'General case' 0 N--CA 1.468 0.472 0 N-CA-C 113.072 0.767 . . . . 0.0 113.072 -174.336 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 12.5 tp10 -61.92 -59.92 4.4 Favored 'General case' 0 CA--C 1.534 0.33 0 O-C-N 121.994 -0.441 . . . . 0.0 110.012 179.865 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 16.6 pt-20 -59.35 -36.19 75.25 Favored 'General case' 0 CA--C 1.535 0.388 0 O-C-N 121.394 -0.816 . . . . 0.0 111.798 179.739 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 23.7 t80 -51.94 -26.24 9.97 Favored 'General case' 0 CA--C 1.54 0.578 0 C-N-CA 123.788 0.835 . . . . 0.0 112.408 171.682 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 67' ' ' GLN . . . . . . . . . . . . . 36.2 mm-40 -53.23 -27.84 24.12 Favored 'General case' 0 CA--C 1.54 0.567 0 O-C-N 120.985 -1.072 . . . . 0.0 113.117 172.625 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 85.8 t -56.22 -30.58 30.21 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.436 0 C-N-CA 122.966 0.506 . . . . 0.0 110.967 173.206 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 16.8 tp -78.17 -51.32 10.4 Favored 'General case' 0 N--CA 1.455 -0.178 0 N-CA-C 109.221 -0.659 . . . . 0.0 109.221 170.664 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 70' ' ' VAL . . . . . . . . . . . . . 84.4 t . . . . . 0 N--CA 1.463 0.22 0 C-N-CA 122.88 0.472 . . . . 0.0 111.591 -175.695 . . . . . . . . 0 0 . 1 . 014 nuclear orig core ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 83.9 Cg_exo . . . . . 0 N--CA 1.456 -0.692 0 N-CA-C 112.322 0.085 . . . . 0.0 112.322 . . . . . . . . . 0 0 . 1 . 014 nuclear orig core ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 3.1 mp0 -62.54 -48.66 78.52 Favored 'General case' 0 CA--C 1.53 0.202 0 C-N-CA 123.793 0.837 . . . . 0.0 111.917 175.966 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 9.6 tm-20 -60.33 -44.47 95.46 Favored 'General case' 0 CA--C 1.53 0.206 0 N-CA-C 108.739 -0.837 . . . . 0.0 108.739 178.074 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 14.5 mt -60.98 -37.18 81.56 Favored 'General case' 0 N--CA 1.447 -0.6 0 C-N-CA 123.614 0.766 . . . . 0.0 112.568 175.803 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 54.5 tptt -59.24 -47.45 85.29 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 119.232 0.924 . . . . 0.0 109.724 169.752 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . -51.18 -54.21 24.27 Favored Glycine 0 CA--C 1.531 1.072 0 N-CA-C 110.696 -0.962 . . . . 0.0 110.696 176.793 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 9' ' ' ILE . . . . . . . . . . . . . 4.2 mm -54.56 -56.12 11.85 Favored 'Isoleucine or valine' 0 CA--C 1.529 0.166 0 C-N-CA 125.063 1.345 . . . . 0.0 109.321 175.99 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 10' ' ' PHE . . . . . . . . . . . . . 23.2 t80 -49.56 -49.33 46.75 Favored 'General case' 0 N--CA 1.444 -0.753 0 C-N-CA 123.612 0.765 . . . . 0.0 109.772 -178.65 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 52.1 mt-10 -63.35 -48.77 76.55 Favored 'General case' 0 N--CA 1.453 -0.288 0 C-N-CA 123.504 0.722 . . . . 0.0 110.613 179.638 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 64.6 tttt -44.39 -51.84 8.25 Favored 'General case' 0 CA--C 1.53 0.21 0 C-N-CA 123.893 0.877 . . . . 0.0 110.756 176.592 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 83.0 m-85 -80.68 -38.54 28.81 Favored 'General case' 0 CA--C 1.533 0.295 0 N-CA-C 112.379 0.511 . . . . 0.0 112.379 -176.723 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -69.05 -52.63 26.52 Favored 'General case' 0 C--N 1.333 -0.147 0 C-N-CA 123.552 0.741 . . . . 0.0 111.757 -176.908 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.332 -0.188 0 C-N-CA 124.124 0.97 . . . . 0.0 112.255 -178.57 . . . . . . . . 0 0 . 1 . 014 nuclear orig core ' A' A ' 20' ' ' PRO . . . . . . . . . . . . . 11.1 Cg_endo . . . . . 0 CA--C 1.537 0.649 0 N-CA-C 114.538 0.938 . . . . 0.0 114.538 . . . . . . . . . 0 0 . 1 . 014 nuclear orig core ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 49.2 m-80 -96.56 -1.17 47.6 Favored 'General case' 0 CA--C 1.533 0.3 0 C-N-CA 124.956 1.302 . . . . 0.0 113.314 -177.743 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 30.7 tt0 -141.51 116.98 10.21 Favored 'General case' 0 CA--C 1.538 0.514 0 C-N-CA 123.869 0.868 . . . . 0.0 112.579 -176.712 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 46.9 mt -90.56 136.74 32.87 Favored 'General case' 0 C--N 1.342 0.26 0 C-N-CA 124.564 1.145 . . . . 0.0 110.857 179.875 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 98.0 p -78.5 168.05 20.37 Favored 'General case' 0 CA--C 1.532 0.273 0 N-CA-C 108.572 -0.899 . . . . 0.0 108.572 167.133 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 1.1 ttmp? -59.11 -38.12 78.8 Favored 'General case' 0 CA--C 1.535 0.395 0 O-C-N 122.017 -0.427 . . . . 0.0 110.739 177.985 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 26.9 mt-10 -68.24 -47.49 67.64 Favored 'General case' 0 N--CA 1.454 -0.23 0 CA-C-O 121.162 0.506 . . . . 0.0 110.516 -179.576 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 60.2 mt-10 -58.06 -43.94 87.22 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.027 -0.533 . . . . 0.0 109.814 176.183 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 12.3 mt -54.59 -47.37 73.42 Favored 'General case' 0 CA--C 1.507 -0.676 0 CA-C-N 118.387 0.54 . . . . 0.0 112.233 169.608 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 61.9 tttp -58.83 -47.59 84.31 Favored 'General case' 0 C--N 1.324 -0.531 0 CA-C-N 118.706 0.684 . . . . 0.0 109.876 -177.353 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 90.5 mt -59.75 -49.06 79.21 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.532 -0.304 . . . . 0.0 111.686 177.286 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 6.9 tt -50.62 -58.28 6.21 Favored 'General case' 0 N--CA 1.456 -0.148 0 C-N-CA 124.204 1.002 . . . . 0.0 109.327 175.545 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 42.8 mt -57.98 -52.35 65.87 Favored 'General case' 0 N--CA 1.451 -0.39 0 C-N-CA 123.86 0.864 . . . . 0.0 109.079 -176.291 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 23.6 tt0 -53.85 -51.03 64.92 Favored 'General case' 0 N--CA 1.453 -0.287 0 C-N-CA 123.639 0.776 . . . . 0.0 111.075 -178.204 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 11.4 m -75.65 -45.36 37.6 Favored 'General case' 0 N--CA 1.451 -0.381 0 CA-C-N 115.992 -0.549 . . . . 0.0 110.958 -171.583 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 74.0 mm-40 -94.57 -34.97 12.44 Favored 'General case' 0 N--CA 1.452 -0.357 0 C-N-CA 123.797 0.839 . . . . 0.0 112.406 -169.355 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 73.9 m-85 . . . . . 0 CA--C 1.541 0.606 0 C-N-CA 123.832 0.853 . . . . 0.0 113.108 -169.875 . . . . . . . . 0 0 . 1 . 014 nuclear orig core ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 57.4 tp . . . . . 0 CA--C 1.528 0.118 0 CA-C-O 120.984 0.421 . . . . 0.0 110.709 . . . . . . . . . 0 0 . 1 . 014 nuclear orig core ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 4.8 m-20 -59.59 -54.04 51.15 Favored 'General case' 0 N--CA 1.45 -0.459 0 C-N-CA 123.905 0.882 . . . . 0.0 110.932 179.252 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 37.0 mt-10 -55.13 -48.52 73.55 Favored 'General case' 0 C--N 1.332 -0.191 0 CA-C-N 116.492 -0.322 . . . . 0.0 110.547 176.262 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 54.9 tp -56.39 -49.79 73.47 Favored 'General case' 0 C--N 1.331 -0.206 0 C-N-CA 123.035 0.534 . . . . 0.0 109.863 -179.904 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 50' ' ' PHE . . . . . . . . . . . . . 59.9 t80 -51.8 -50.42 60.82 Favored 'General case' 0 N--CA 1.453 -0.305 0 C-N-CA 124.041 0.936 . . . . 0.0 110.3 177.69 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 56.9 mm-40 -59.3 -47.5 85.14 Favored 'General case' 0 CA--C 1.534 0.364 0 CA-C-N 117.923 0.329 . . . . 0.0 111.627 175.373 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 39.8 mt-10 -54.81 -36.92 65.47 Favored 'General case' 0 CA--C 1.529 0.137 0 C-N-CA 123.375 0.67 . . . . 0.0 111.688 178.689 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 53.2 mt -75.21 -57.37 3.94 Favored 'General case' 0 N--CA 1.447 -0.611 0 CA-C-N 117.905 0.32 . . . . 0.0 110.626 174.808 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 33.2 t0 . . . . . 0 CA--C 1.536 0.436 0 C-N-CA 124.612 1.165 . . . . 0.0 110.89 -178.947 . . . . . . . . 0 0 . 1 . 014 nuclear orig core ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 33.4 mt-10 . . . . . 0 N--CA 1.454 -0.231 0 N-CA-C 105.731 -1.952 . . . . 0.0 105.731 . . . . . . . . . 0 0 . 1 . 014 nuclear orig core ' A' A ' 61' ' ' VAL . . . . . . . . . . . . . 25.4 t -109.94 114.63 47.53 Favored 'Isoleucine or valine' 0 N--CA 1.461 0.092 0 N-CA-C 109.419 -0.585 . . . . 0.0 109.419 -179.91 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 2.8 m -78.83 159.21 27.94 Favored 'General case' 0 CA--C 1.535 0.387 0 C-N-CA 123.519 0.728 . . . . 0.0 110.85 176.548 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 63' ' ' PHE . . . . . . . . . . . . . 73.8 t80 -59.17 -31.39 68.95 Favored 'General case' 0 CA--C 1.534 0.329 0 O-C-N 121.036 -1.04 . . . . 0.0 113.341 -176.996 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 29.3 mp0 -68.86 -62.95 1.16 Allowed 'General case' 0 N--CA 1.451 -0.403 0 N-CA-C 108.958 -0.756 . . . . 0.0 108.958 -177.595 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 1.5 pt-20 -59.68 -32.86 70.89 Favored 'General case' 0 CA--C 1.538 0.512 0 O-C-N 121.623 -0.673 . . . . 0.0 112.037 178.0 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 18.5 t80 -48.69 -29.84 4.86 Favored 'General case' 0 CA--C 1.537 0.467 0 O-C-N 121.429 -0.795 . . . . 0.0 112.741 169.194 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 67' ' ' GLN . . . . . . . . . . . . . 69.5 mm-40 -54.63 -22.29 13.09 Favored 'General case' 0 CA--C 1.539 0.543 0 CA-C-N 119.557 1.071 . . . . 0.0 112.872 174.685 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 76.2 t -55.49 -35.54 38.22 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.516 0 CA-C-N 119.751 1.159 . . . . 0.0 110.655 171.166 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 24.6 tp -71.95 -45.47 60.97 Favored 'General case' 0 N--CA 1.454 -0.26 0 N-CA-C 107.286 -1.376 . . . . 0.0 107.286 179.129 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 70' ' ' VAL . . . . . . . . . . . . . 23.4 t . . . . . 0 CA--C 1.534 0.341 0 C-N-CA 123.036 0.535 . . . . 0.0 110.37 178.708 . . . . . . . . 0 0 . 1 . 015 nuclear orig core ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 86.7 Cg_exo . . . . . 0 N--CA 1.456 -0.68 0 CA-C-O 120.402 0.084 . . . . 0.0 111.982 . . . . . . . . . 0 0 . 1 . 015 nuclear orig core ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 48.0 mt-10 -61.5 -49.54 76.34 Favored 'General case' 0 N--CA 1.456 -0.149 0 C-N-CA 123.587 0.755 . . . . 0.0 111.114 176.501 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 37.8 mm-40 -59.59 -47.18 86.59 Favored 'General case' 0 C--O 1.225 -0.204 0 N-CA-C 109.044 -0.724 . . . . 0.0 109.044 177.638 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 47.5 mt -58.29 -39.66 79.88 Favored 'General case' 0 N--CA 1.447 -0.589 0 C-N-CA 123.462 0.705 . . . . 0.0 111.802 178.857 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 21.8 tptm -61.62 -49.26 77.3 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 118.626 0.648 . . . . 0.0 110.744 171.673 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . -53.61 -52.17 43.57 Favored Glycine 0 CA--C 1.529 0.932 0 N-CA-C 110.272 -1.131 . . . . 0.0 110.272 -179.666 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 9' ' ' ILE . . . . . . . . . . . . . 80.3 mt -53.37 -56.41 8.49 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.245 0 C-N-CA 126.464 1.906 . . . . 0.0 109.704 172.442 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 10' ' ' PHE . . . . . . . . . . . . . 42.1 t80 -49.34 -49.66 43.24 Favored 'General case' 0 N--CA 1.447 -0.586 0 O-C-N 121.82 -0.55 . . . . 0.0 109.618 -178.144 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 52.4 mt-10 -63.65 -51.45 65.12 Favored 'General case' 0 CA--C 1.532 0.25 0 C-N-CA 123.165 0.586 . . . . 0.0 110.801 179.3 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 43.9 tttp -44.79 -51.23 9.64 Favored 'General case' 0 N--CA 1.461 0.113 0 C-N-CA 125.026 1.33 . . . . 0.0 110.909 177.163 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 57.2 m-85 -78.39 -47.37 17.74 Favored 'General case' 0 N--CA 1.448 -0.525 0 CA-C-N 116.362 -0.381 . . . . 0.0 110.355 -175.664 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -54.89 -38.14 67.19 Favored 'General case' 0 C--N 1.331 -0.204 0 C-N-CA 124.21 1.004 . . . . 0.0 112.418 179.218 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.533 0.289 0 O-C-N 121.737 -0.602 . . . . 0.0 111.835 174.157 . . . . . . . . 0 0 . 1 . 015 nuclear orig core ' A' A ' 20' ' ' PRO . . . . . . . . . . . . . 32.5 Cg_endo . . . . . 0 N--CA 1.458 -0.578 0 N-CA-C 112.735 0.244 . . . . 0.0 112.735 . . . . . . . . . 0 0 . 1 . 015 nuclear orig core ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 43.2 m-80 -83.13 -4.51 58.45 Favored 'General case' 0 N--CA 1.451 -0.39 0 C-N-CA 124.35 1.06 . . . . 0.0 112.884 -177.268 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 26.3 tt0 -145.58 132.4 20.09 Favored 'General case' 0 CA--C 1.54 0.561 0 CA-C-N 119.699 1.136 . . . . 0.0 113.182 -168.771 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 84.7 mt -104.06 133.86 48.29 Favored 'General case' 0 C--N 1.342 0.257 0 C-N-CA 125.591 1.557 . . . . 0.0 110.804 176.941 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 82.4 p -79.77 175.63 10.45 Favored 'General case' 0 N--CA 1.452 -0.356 0 C-N-CA 123.76 0.824 . . . . 0.0 109.017 168.481 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 97.8 mttt -55.46 -46.3 76.82 Favored 'General case' 0 N--CA 1.455 -0.189 0 O-C-N 122.059 -0.401 . . . . 0.0 110.023 170.168 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 19.3 tp10 -64.96 -46.79 80.09 Favored 'General case' 0 N--CA 1.451 -0.422 0 CA-C-O 120.7 0.286 . . . . 0.0 110.353 -175.961 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -58.6 -44.08 89.78 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-O 118.806 -0.616 . . . . 0.0 110.45 175.822 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 14.2 mt -56.27 -44.58 79.88 Favored 'General case' 0 CA--C 1.509 -0.6 0 CA-C-N 119.273 0.942 . . . . 0.0 112.539 170.484 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 61.7 tttm -59.96 -49.66 76.81 Favored 'General case' 0 N--CA 1.449 -0.525 0 CA-C-N 118.572 0.624 . . . . 0.0 109.555 -177.849 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 9.2 mp -57.83 -49.64 75.98 Favored 'General case' 0 C--N 1.329 -0.292 0 C-N-CA 122.312 0.245 . . . . 0.0 111.376 177.591 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 7.3 tt -50.23 -57.79 7.04 Favored 'General case' 0 C--N 1.332 -0.166 0 C-N-CA 123.957 0.903 . . . . 0.0 109.552 176.051 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 38.0 mt -59.35 -49.15 78.92 Favored 'General case' 0 C--O 1.222 -0.376 0 C-N-CA 123.513 0.725 . . . . 0.0 109.622 -176.747 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 24.6 tt0 -56.96 -45.84 82.57 Favored 'General case' 0 N--CA 1.452 -0.349 0 C-N-CA 124.222 1.009 . . . . 0.0 110.885 -176.911 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 2.6 m -75.77 -52.34 10.65 Favored 'General case' 0 CA--C 1.533 0.318 0 C-N-CA 120.961 -0.296 . . . . 0.0 110.879 -177.107 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 58.4 mm-40 -90.15 -28.18 19.1 Favored 'General case' 0 N--CA 1.449 -0.483 0 N-CA-C 113.093 0.775 . . . . 0.0 113.093 -166.687 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 76.9 m-85 . . . . . 0 CA--C 1.538 0.518 0 C-N-CA 123.965 0.906 . . . . 0.0 112.949 -173.252 . . . . . . . . 0 0 . 1 . 015 nuclear orig core ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 62.9 tp . . . . . 0 N--CA 1.454 -0.247 0 CA-C-O 120.697 0.284 . . . . 0.0 111.078 . . . . . . . . . 0 0 . 1 . 015 nuclear orig core ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 6.0 m-20 -57.81 -54.75 43.41 Favored 'General case' 0 N--CA 1.451 -0.416 0 C-N-CA 123.792 0.837 . . . . 0.0 111.008 178.279 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 46.0 mt-10 -54.31 -47.77 72.07 Favored 'General case' 0 C--N 1.332 -0.158 0 CA-C-N 116.802 -0.181 . . . . 0.0 110.868 177.739 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 48.7 tp -60.4 -48.26 82.51 Favored 'General case' 0 N--CA 1.453 -0.315 0 CA-C-O 121.348 0.594 . . . . 0.0 109.632 -179.411 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 50' ' ' PHE . . . . . . . . . . . . . 59.2 t80 -53.98 -49.31 69.1 Favored 'General case' 0 N--CA 1.449 -0.483 0 C-N-CA 123.331 0.653 . . . . 0.0 110.266 178.848 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 34.7 mt-10 -60.9 -43.34 98.67 Favored 'General case' 0 N--CA 1.455 -0.209 0 C-N-CA 122.719 0.408 . . . . 0.0 110.996 177.648 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 32.7 tt0 -52.74 -42.31 64.79 Favored 'General case' 0 CA--C 1.529 0.172 0 C-N-CA 122.933 0.493 . . . . 0.0 110.708 176.456 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 82.1 mt -75.36 -63.12 1.35 Allowed 'General case' 0 N--CA 1.45 -0.471 0 C-N-CA 123.062 0.545 . . . . 0.0 111.229 179.046 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 29.4 t70 . . . . . 0 C--N 1.332 -0.181 0 C-N-CA 125.406 1.482 . . . . 0.0 108.711 -179.207 . . . . . . . . 0 0 . 1 . 015 nuclear orig core ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 45.7 mt-10 . . . . . 0 N--CA 1.454 -0.24 0 N-CA-C 106.637 -1.616 . . . . 0.0 106.637 . . . . . . . . . 0 0 . 1 . 015 nuclear orig core ' A' A ' 61' ' ' VAL . . . . . . . . . . . . . 73.0 t -111.59 106.56 21.0 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.236 0 C-N-CA 122.742 0.417 . . . . 0.0 110.161 -169.541 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 53.8 p -82.56 160.73 22.49 Favored 'General case' 0 CA--C 1.539 0.544 0 C-N-CA 123.875 0.87 . . . . 0.0 111.343 173.557 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 63' ' ' PHE . . . . . . . . . . . . . 49.7 t80 -51.16 -49.93 59.93 Favored 'General case' 0 N--CA 1.468 0.426 0 O-C-N 121.422 -0.799 . . . . 0.0 111.417 -173.921 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 12.5 pt-20 -53.26 -28.57 28.28 Favored 'General case' 0 CA--C 1.534 0.342 0 C-N-CA 124.654 1.181 . . . . 0.0 114.145 -178.373 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 14.3 pt-20 -100.15 -30.25 12.04 Favored 'General case' 0 CA--C 1.529 0.167 0 C-N-CA 123.593 0.757 . . . . 0.0 110.432 177.88 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 5.3 t80 -52.62 -32.42 41.6 Favored 'General case' 0 CA--C 1.535 0.372 0 O-C-N 121.412 -0.805 . . . . 0.0 110.121 167.687 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 67' ' ' GLN . . . . . . . . . . . . . 0.8 OUTLIER -46.44 -34.66 4.9 Favored 'General case' 0 CA--C 1.538 0.507 0 N-CA-C 113.747 1.018 . . . . 0.0 113.747 169.15 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 77.1 t -61.23 -29.54 46.04 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.541 0 CA-C-N 119.104 0.865 . . . . 0.0 110.667 175.945 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 1.4 tt -71.98 -50.69 26.65 Favored 'General case' 0 N--CA 1.455 -0.188 0 N-CA-C 106.447 -1.686 . . . . 0.0 106.447 178.14 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 70' ' ' VAL . . . . . . . . . . . . . 18.3 t . . . . . 0 CA--C 1.535 0.389 0 C-N-CA 122.819 0.448 . . . . 0.0 110.175 177.701 . . . . . . . . 0 0 . 1 . 016 nuclear orig core ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 80.0 Cg_exo . . . . . 0 N--CA 1.456 -0.702 0 N-CA-C 112.378 0.107 . . . . 0.0 112.378 . . . . . . . . . 0 0 . 1 . 016 nuclear orig core ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 2.8 mp0 -59.82 -49.35 78.07 Favored 'General case' 0 N--CA 1.456 -0.136 0 C-N-CA 123.956 0.902 . . . . 0.0 111.981 176.055 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 30.1 mt-10 -60.16 -45.44 93.06 Favored 'General case' 0 C--N 1.332 -0.188 0 N-CA-C 109.109 -0.7 . . . . 0.0 109.109 176.886 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 16.1 mt -61.52 -36.19 79.85 Favored 'General case' 0 N--CA 1.447 -0.579 0 C-N-CA 123.014 0.526 . . . . 0.0 112.28 179.17 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 55.8 tptt -61.31 -49.47 76.89 Favored 'General case' 0 C--N 1.329 -0.286 0 O-C-N 121.737 -0.602 . . . . 0.0 110.074 169.942 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . -50.65 -51.43 33.14 Favored Glycine 0 CA--C 1.531 1.067 0 N-CA-C 110.724 -0.95 . . . . 0.0 110.724 176.639 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 9' ' ' ILE . . . . . . . . . . . . . 3.4 mm -57.11 -55.53 20.0 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.197 0 C-N-CA 125.859 1.663 . . . . 0.0 109.417 176.628 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 10' ' ' PHE . . . . . . . . . . . . . 56.1 t80 -46.48 -52.22 13.66 Favored 'General case' 0 N--CA 1.45 -0.45 0 C-N-CA 123.49 0.716 . . . . 0.0 109.763 178.436 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 51.9 mt-10 -62.43 -50.87 69.78 Favored 'General case' 0 N--CA 1.454 -0.256 0 C-N-CA 123.214 0.606 . . . . 0.0 110.772 -179.614 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 18.1 ttmm -43.81 -53.76 5.73 Favored 'General case' 0 C--N 1.339 0.146 0 C-N-CA 124.657 1.183 . . . . 0.0 110.686 177.446 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 66.0 m-85 -78.24 -47.55 17.69 Favored 'General case' 0 N--CA 1.453 -0.32 0 C-N-CA 120.814 -0.355 . . . . 0.0 110.753 -175.922 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -52.84 -42.55 65.28 Favored 'General case' 0 C--N 1.329 -0.309 0 C-N-CA 123.493 0.717 . . . . 0.0 111.976 -179.116 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.332 -0.169 0 N-CA-C 113.367 0.877 . . . . 0.0 113.367 178.616 . . . . . . . . 0 0 . 1 . 016 nuclear orig core ' A' A ' 20' ' ' PRO . . . . . . . . . . . . . 19.5 Cg_endo . . . . . 0 CA--C 1.535 0.555 0 N-CA-C 114.315 0.852 . . . . 0.0 114.315 . . . . . . . . . 0 0 . 1 . 016 nuclear orig core ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 50.7 m-80 -84.9 -6.35 59.34 Favored 'General case' 0 CA--C 1.533 0.321 0 CA-C-O 118.321 -0.847 . . . . 0.0 112.833 -178.654 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 17.6 tt0 -152.11 118.69 5.68 Favored 'General case' 0 CA--C 1.537 0.444 0 CA-C-N 119.66 1.118 . . . . 0.0 113.664 -167.929 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 52.0 mt -83.72 131.34 34.93 Favored 'General case' 0 N--CA 1.453 -0.292 0 C-N-CA 123.935 0.894 . . . . 0.0 111.186 177.764 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 92.2 p -79.71 175.63 10.45 Favored 'General case' 0 CA--C 1.536 0.431 0 N-CA-C 108.339 -0.986 . . . . 0.0 108.339 167.06 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 63.4 mttp -57.14 -41.92 79.98 Favored 'General case' 0 C--N 1.34 0.161 0 O-C-N 121.772 -0.58 . . . . 0.0 110.017 170.932 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 1.7 mp0 -63.67 -52.19 61.8 Favored 'General case' 0 N--CA 1.452 -0.366 0 C-N-CA 123.142 0.577 . . . . 0.0 110.214 -177.317 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -58.44 -41.59 85.44 Favored 'General case' 0 CA--C 1.536 0.406 0 CA-C-N 115.8 -0.636 . . . . 0.0 109.642 177.881 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 12.1 mt -56.2 -43.7 78.75 Favored 'General case' 0 C--O 1.219 -0.515 0 CA-C-N 119.174 0.897 . . . . 0.0 112.859 169.286 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 59.2 tttp -61.99 -45.93 91.47 Favored 'General case' 0 C--N 1.322 -0.593 0 CA-C-N 119.075 0.852 . . . . 0.0 110.19 -177.192 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 4.4 mm? -60.17 -50.92 71.79 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.148 -0.478 . . . . 0.0 111.159 175.556 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 7.7 tt -51.17 -55.21 19.08 Favored 'General case' 0 C--N 1.333 -0.111 0 C-N-CA 123.575 0.75 . . . . 0.0 109.711 176.876 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 47.2 mt -55.7 -56.29 22.15 Favored 'General case' 0 N--CA 1.451 -0.385 0 C-N-CA 124.346 1.058 . . . . 0.0 109.67 -177.647 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 27.5 mt-30 -55.28 -51.54 66.34 Favored 'General case' 0 N--CA 1.457 -0.086 0 CA-C-N 117.943 0.338 . . . . 0.0 111.232 -177.868 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 5.7 m -72.81 -45.8 56.52 Favored 'General case' 0 N--CA 1.451 -0.402 0 CA-C-N 116.15 -0.477 . . . . 0.0 111.077 -170.016 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 69.6 mm-40 -98.99 -39.05 8.74 Favored 'General case' 0 N--CA 1.451 -0.423 0 C-N-CA 123.757 0.823 . . . . 0.0 112.886 -169.365 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 16.8 m-85 . . . . . 0 CA--C 1.531 0.235 0 C-N-CA 123.167 0.587 . . . . 0.0 111.505 -170.867 . . . . . . . . 0 0 . 1 . 016 nuclear orig core ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 19.8 mt . . . . . 0 N--CA 1.453 -0.307 0 N-CA-C 108.773 -0.825 . . . . 0.0 108.773 . . . . . . . . . 0 0 . 1 . 016 nuclear orig core ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 5.9 m-20 -60.25 -48.88 79.87 Favored 'General case' 0 N--CA 1.449 -0.523 0 CA-C-N 115.081 -0.963 . . . . 0.0 111.014 -179.448 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 7.9 tm-20 -64.79 -43.26 93.77 Favored 'General case' 0 N--CA 1.453 -0.317 0 N-CA-C 109.839 -0.43 . . . . 0.0 109.839 179.328 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 59.8 tp -57.34 -49.73 75.19 Favored 'General case' 0 C--N 1.333 -0.141 0 N-CA-C 109.657 -0.497 . . . . 0.0 109.657 176.829 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 50' ' ' PHE . . . . . . . . . . . . . 57.3 t80 -52.2 -46.24 65.54 Favored 'General case' 0 N--CA 1.452 -0.367 0 C-N-CA 124.043 0.937 . . . . 0.0 109.595 176.223 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 26.6 tt0 -56.66 -49.34 75.35 Favored 'General case' 0 N--CA 1.453 -0.299 0 CA-C-O 119.735 -0.174 . . . . 0.0 111.383 174.739 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 50.4 mt-10 -51.99 -47.92 64.65 Favored 'General case' 0 N--CA 1.465 0.3 0 CA-C-N 118.159 0.436 . . . . 0.0 111.353 177.582 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 80.8 mt -64.6 -55.51 19.86 Favored 'General case' 0 N--CA 1.452 -0.365 0 CA-C-O 121.269 0.557 . . . . 0.0 110.631 179.777 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 13.0 t70 . . . . . 0 N--CA 1.452 -0.333 0 C-N-CA 126.954 2.102 . . . . 0.0 108.992 -171.093 . . . . . . . . 0 0 . 1 . 016 nuclear orig core ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 53.6 mt-10 . . . . . 0 N--CA 1.453 -0.325 0 N-CA-C 106.764 -1.569 . . . . 0.0 106.764 . . . . . . . . . 0 0 . 1 . 016 nuclear orig core ' A' A ' 61' ' ' VAL . . . . . . . . . . . . . 90.1 t -109.54 102.12 13.55 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.273 0 N-CA-C 109.794 -0.447 . . . . 0.0 109.794 -170.634 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 98.7 p -77.99 170.73 16.11 Favored 'General case' 0 CA--C 1.539 0.556 0 C-N-CA 123.196 0.598 . . . . 0.0 110.609 173.193 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 63' ' ' PHE . . . . . . . . . . . . . 54.9 t80 -59.61 -41.56 90.64 Favored 'General case' 0 CA--C 1.531 0.227 0 O-C-N 121.661 -0.65 . . . . 0.0 112.572 -172.313 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 1.9 pp20? -59.08 -57.65 12.13 Favored 'General case' 0 CA--C 1.534 0.362 0 O-C-N 121.942 -0.474 . . . . 0.0 110.918 179.782 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 10.8 pt-20 -62.42 -35.13 78.26 Favored 'General case' 0 CA--C 1.535 0.372 0 O-C-N 121.694 -0.629 . . . . 0.0 111.599 179.296 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 14.2 t80 -49.81 -34.02 18.34 Favored 'General case' 0 CA--C 1.536 0.442 0 O-C-N 121.343 -0.848 . . . . 0.0 112.47 169.53 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 67' ' ' GLN . . . . . . . . . . . . . 98.9 mm-40 -60.39 -23.26 64.19 Favored 'General case' 0 CA--C 1.537 0.459 0 O-C-N 120.697 -1.252 . . . . 0.0 112.68 176.311 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 58.5 t -62.77 -29.43 47.03 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.502 0 O-C-N 120.918 -1.114 . . . . 0.0 110.215 170.69 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 1.8 tt -72.38 -46.3 55.92 Favored 'General case' 0 N--CA 1.457 -0.095 0 N-CA-C 106.769 -1.567 . . . . 0.0 106.769 177.571 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 70' ' ' VAL . . . . . . . . . . . . . 36.3 t . . . . . 0 CA--C 1.538 0.502 0 O-C-N 121.952 -0.468 . . . . 0.0 110.525 175.499 . . . . . . . . 0 0 . 1 . 017 nuclear orig core ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 83.4 Cg_exo . . . . . 0 N--CA 1.458 -0.572 0 N-CA-C 113.001 0.346 . . . . 0.0 113.001 . . . . . . . . . 0 0 . 1 . 017 nuclear orig core ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 3.0 mp0 -59.35 -47.87 83.78 Favored 'General case' 0 N--CA 1.455 -0.216 0 C-N-CA 123.934 0.894 . . . . 0.0 111.93 176.164 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 36.9 mt-10 -62.95 -43.97 97.35 Favored 'General case' 0 N--CA 1.453 -0.304 0 N-CA-C 109.349 -0.611 . . . . 0.0 109.349 178.41 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 47.7 mt -60.88 -39.7 90.22 Favored 'General case' 0 N--CA 1.45 -0.466 0 C-N-CA 123.386 0.674 . . . . 0.0 111.528 177.921 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 27.5 tptp -59.38 -46.17 89.43 Favored 'General case' 0 C--N 1.331 -0.215 0 O-C-N 121.806 -0.559 . . . . 0.0 110.348 170.05 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . -54.66 -53.51 38.61 Favored Glycine 0 CA--C 1.529 0.933 0 N-CA-C 110.338 -1.105 . . . . 0.0 110.338 179.129 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 9' ' ' ILE . . . . . . . . . . . . . 46.5 mt -51.33 -56.51 4.99 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.145 0 C-N-CA 125.641 1.576 . . . . 0.0 109.88 172.206 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 10' ' ' PHE . . . . . . . . . . . . . 49.1 t80 -49.24 -50.71 37.38 Favored 'General case' 0 N--CA 1.446 -0.673 0 N-CA-C 109.925 -0.398 . . . . 0.0 109.925 -178.438 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 57.3 mt-10 -61.99 -52.94 61.98 Favored 'General case' 0 CA--C 1.531 0.219 0 C-N-CA 122.444 0.298 . . . . 0.0 110.712 179.249 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 24.7 ttpt -43.32 -53.82 5.02 Favored 'General case' 0 C--N 1.339 0.126 0 C-N-CA 124.92 1.288 . . . . 0.0 110.736 178.645 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 66.6 m-85 -77.78 -47.63 18.5 Favored 'General case' 0 N--CA 1.45 -0.443 0 CA-C-N 116.578 -0.283 . . . . 0.0 110.408 -175.839 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -58.87 -37.18 75.95 Favored 'General case' 0 C--N 1.33 -0.275 0 O-C-N 121.417 -0.802 . . . . 0.0 112.743 -175.857 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.454 -0.269 0 N-CA-C 112.211 0.448 . . . . 0.0 112.211 176.464 . . . . . . . . 0 0 . 1 . 017 nuclear orig core ' A' A ' 20' ' ' PRO . . . . . . . . . . . . . 16.5 Cg_endo . . . . . 0 CA--C 1.539 0.726 0 N-CA-C 113.519 0.546 . . . . 0.0 113.519 . . . . . . . . . 0 0 . 1 . 017 nuclear orig core ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 37.0 m-80 -92.01 -4.1 54.95 Favored 'General case' 0 N--CA 1.454 -0.275 0 C-N-CA 124.694 1.197 . . . . 0.0 111.937 -178.025 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 7.4 tt0 -155.13 116.66 4.05 Favored 'General case' 0 CA--C 1.539 0.533 0 CA-C-N 118.838 0.744 . . . . 0.0 112.485 -168.392 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 26.0 mt -78.29 131.49 37.09 Favored 'General case' 0 N--CA 1.455 -0.191 0 C-N-CA 123.127 0.571 . . . . 0.0 111.352 -172.642 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -77.77 158.86 29.39 Favored 'General case' 0 CA--C 1.54 0.56 0 C-N-CA 126.377 1.871 . . . . 0.0 108.867 168.766 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 31.7 ttmt -60.28 -46.02 91.29 Favored 'General case' 0 CA--C 1.534 0.342 0 O-C-N 121.546 -0.721 . . . . 0.0 112.098 -170.471 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 57.6 mm-40 -65.61 -41.35 92.85 Favored 'General case' 0 N--CA 1.454 -0.241 0 CA-C-O 121.729 0.776 . . . . 0.0 110.199 -179.216 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 4.6 mp0 -57.79 -48.08 80.73 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-N 115.527 -0.76 . . . . 0.0 109.219 175.756 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 5.0 mt -52.91 -45.33 67.55 Favored 'General case' 0 C--O 1.219 -0.546 0 N-CA-C 113.097 0.777 . . . . 0.0 113.097 168.24 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 5.7 ttpm? -58.51 -50.96 71.85 Favored 'General case' 0 C--N 1.324 -0.505 0 CA-C-N 118.883 0.765 . . . . 0.0 110.636 -178.947 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 4.1 mm? -59.58 -46.78 87.92 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.169 -0.469 . . . . 0.0 111.212 177.766 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 6.8 tt -51.45 -58.17 6.99 Favored 'General case' 0 N--CA 1.455 -0.212 0 C-N-CA 124.031 0.933 . . . . 0.0 109.064 174.787 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 38.7 mt -54.02 -58.55 6.88 Favored 'General case' 0 C--N 1.33 -0.259 0 C-N-CA 123.708 0.803 . . . . 0.0 109.421 -178.021 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 1.1 tm0? -52.56 -53.55 44.8 Favored 'General case' 0 N--CA 1.453 -0.288 0 C-N-CA 123.514 0.726 . . . . 0.0 111.2 -177.401 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 11.1 m -73.24 -47.56 42.17 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.657 -0.247 . . . . 0.0 110.997 -171.105 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 69.3 mm-40 -90.69 -37.93 13.41 Favored 'General case' 0 N--CA 1.448 -0.548 0 C-N-CA 123.647 0.779 . . . . 0.0 112.021 -169.033 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 87.0 m-85 . . . . . 0 CA--C 1.531 0.247 0 C-N-CA 123.855 0.862 . . . . 0.0 111.784 -170.614 . . . . . . . . 0 0 . 1 . 017 nuclear orig core ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 50.5 tp . . . . . 0 N--CA 1.454 -0.265 0 N-CA-C 109.909 -0.404 . . . . 0.0 109.909 . . . . . . . . . 0 0 . 1 . 017 nuclear orig core ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 6.1 m-20 -57.28 -53.74 54.66 Favored 'General case' 0 N--CA 1.448 -0.563 0 C-N-CA 123.907 0.883 . . . . 0.0 111.08 177.28 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 14.7 tp10 -55.93 -49.17 74.24 Favored 'General case' 0 C--N 1.332 -0.193 0 N-CA-C 110.123 -0.325 . . . . 0.0 110.123 178.741 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 43.5 tp -59.41 -47.95 83.51 Favored 'General case' 0 CA--C 1.532 0.254 0 CA-C-O 121.304 0.573 . . . . 0.0 110.152 -179.882 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 50' ' ' PHE . . . . . . . . . . . . . 74.3 t80 -55.53 -49.05 73.66 Favored 'General case' 0 N--CA 1.451 -0.378 0 C-N-CA 124.165 0.986 . . . . 0.0 110.534 178.423 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 32.9 mt-10 -59.06 -49.29 78.44 Favored 'General case' 0 N--CA 1.455 -0.208 0 C-N-CA 123.217 0.607 . . . . 0.0 110.591 177.34 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 30.5 tp10 -53.92 -44.88 70.95 Favored 'General case' 0 N--CA 1.456 -0.167 0 C-N-CA 123.463 0.705 . . . . 0.0 110.977 178.544 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 95.1 mt -72.37 -47.53 48.72 Favored 'General case' 0 N--CA 1.45 -0.453 0 CA-C-O 120.802 0.334 . . . . 0.0 111.495 -179.767 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 37.7 t0 . . . . . 0 CA--C 1.533 0.303 0 C-N-CA 124.412 1.085 . . . . 0.0 110.267 -179.942 . . . . . . . . 0 0 . 1 . 017 nuclear orig core ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 51.2 mt-10 . . . . . 0 CA--C 1.534 0.348 0 N-CA-C 106.15 -1.796 . . . . 0.0 106.15 . . . . . . . . . 0 0 . 1 . 017 nuclear orig core ' A' A ' 61' ' ' VAL . . . . . . . . . . . . . 26.5 t -108.8 115.67 50.0 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.455 0 CA-C-N 118.706 0.685 . . . . 0.0 110.896 -175.833 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -78.92 150.85 32.0 Favored 'General case' 0 CA--C 1.537 0.45 0 C-N-CA 124.863 1.265 . . . . 0.0 111.362 179.411 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 63' ' ' PHE . . . . . . . . . . . . . 66.7 t80 -51.53 -44.7 62.71 Favored 'General case' 0 N--CA 1.468 0.427 0 O-C-N 121.446 -0.784 . . . . 0.0 112.586 -173.746 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 2.9 pm0 -59.77 -31.15 69.39 Favored 'General case' 0 N--CA 1.449 -0.524 0 N-CA-C 113.092 0.775 . . . . 0.0 113.092 -179.395 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 21.6 pt-20 -95.04 -27.65 15.51 Favored 'General case' 0 CA--C 1.531 0.222 0 CA-C-N 118.679 0.672 . . . . 0.0 110.797 179.001 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 9.5 t80 -53.21 -25.66 14.78 Favored 'General case' 0 CA--C 1.536 0.426 0 C-N-CA 123.6 0.76 . . . . 0.0 110.201 166.992 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 67' ' ' GLN . . . . . . . . . . . . . 66.4 mm-40 -51.58 -25.04 6.13 Favored 'General case' 0 CA--C 1.538 0.5 0 N-CA-C 113.633 0.975 . . . . 0.0 113.633 169.869 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 99.4 t -60.86 -33.06 53.9 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.556 0 CA-C-N 119.653 1.115 . . . . 0.0 110.735 172.136 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 10.5 tt -72.16 -46.16 57.53 Favored 'General case' 0 N--CA 1.457 -0.117 0 N-CA-C 107.056 -1.461 . . . . 0.0 107.056 176.694 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 70' ' ' VAL . . . . . . . . . . . . . 21.6 t . . . . . 0 CA--C 1.537 0.457 0 N-CA-C 110.272 -0.27 . . . . 0.0 110.272 176.775 . . . . . . . . 0 0 . 1 . 018 nuclear orig core ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 82.6 Cg_exo . . . . . 0 CA--C 1.536 0.625 0 CA-C-O 120.688 0.203 . . . . 0.0 112.14 . . . . . . . . . 0 0 . 1 . 018 nuclear orig core ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 42.3 tt0 -58.31 -53.84 53.74 Favored 'General case' 0 N--CA 1.455 -0.175 0 C-N-CA 123.777 0.831 . . . . 0.0 111.189 177.022 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 47.0 mm-40 -62.84 -40.95 99.01 Favored 'General case' 0 N--CA 1.452 -0.367 0 N-CA-C 109.149 -0.686 . . . . 0.0 109.149 -179.265 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 40.8 mt -59.49 -38.16 80.14 Favored 'General case' 0 N--CA 1.448 -0.558 0 C-N-CA 124.286 1.035 . . . . 0.0 111.896 176.609 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 23.2 tptm -60.66 -49.92 75.58 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-N 119.069 0.85 . . . . 0.0 110.712 169.982 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . -53.45 -52.96 37.82 Favored Glycine 0 CA--C 1.531 1.039 0 N-CA-C 110.519 -1.032 . . . . 0.0 110.519 -179.542 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 9' ' ' ILE . . . . . . . . . . . . . 78.3 mt -51.89 -57.25 3.83 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.259 0 C-N-CA 126.081 1.752 . . . . 0.0 109.935 172.044 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 10' ' ' PHE . . . . . . . . . . . . . 44.4 t80 -48.84 -50.03 36.47 Favored 'General case' 0 N--CA 1.446 -0.663 0 N-CA-C 109.239 -0.652 . . . . 0.0 109.239 -177.389 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 51.0 mt-10 -61.61 -53.25 58.67 Favored 'General case' 0 CA--C 1.532 0.268 0 C-N-CA 123.047 0.539 . . . . 0.0 110.717 178.709 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 1.4 ttpm? -45.14 -50.74 11.05 Favored 'General case' 0 C--N 1.34 0.167 0 C-N-CA 124.197 0.999 . . . . 0.0 110.979 178.075 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 54.6 m-85 -77.74 -52.87 8.26 Favored 'General case' 0 N--CA 1.448 -0.561 0 N-CA-C 110.072 -0.344 . . . . 0.0 110.072 -175.397 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -50.41 -37.67 38.99 Favored 'General case' 0 C--N 1.33 -0.253 0 C-N-CA 125.278 1.431 . . . . 0.0 112.762 -179.79 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.535 0.379 0 C-N-CA 123.309 0.644 . . . . 0.0 111.874 173.832 . . . . . . . . 0 0 . 1 . 018 nuclear orig core ' A' A ' 20' ' ' PRO . . . . . . . . . . . . . 29.4 Cg_endo . . . . . 0 N--CA 1.461 -0.437 0 N-CA-C 113.365 0.486 . . . . 0.0 113.365 . . . . . . . . . 0 0 . 1 . 018 nuclear orig core ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 42.7 m-80 -79.85 -4.92 54.29 Favored 'General case' 0 N--CA 1.45 -0.435 0 CA-C-O 117.849 -1.072 . . . . 0.0 112.74 -178.194 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 28.1 tt0 -147.57 135.08 20.83 Favored 'General case' 0 CA--C 1.539 0.536 0 CA-C-N 119.758 1.163 . . . . 0.0 113.385 -168.717 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 81.9 mt -104.17 133.12 49.63 Favored 'General case' 0 C--N 1.343 0.317 0 C-N-CA 125.171 1.389 . . . . 0.0 111.154 177.524 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 78.8 p -80.4 174.78 11.27 Favored 'General case' 0 CA--C 1.533 0.304 0 C-N-CA 123.876 0.87 . . . . 0.0 108.929 168.297 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 60.1 mttp -56.43 -40.97 75.64 Favored 'General case' 0 C--N 1.34 0.16 0 O-C-N 122.043 -0.411 . . . . 0.0 110.215 169.97 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 26.4 mt-10 -68.56 -47.1 67.7 Favored 'General case' 0 CA--C 1.517 -0.299 0 CA-C-O 120.813 0.339 . . . . 0.0 110.242 -175.764 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -56.97 -46.91 81.86 Favored 'General case' 0 N--CA 1.453 -0.312 0 CA-C-N 115.986 -0.552 . . . . 0.0 109.751 174.815 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 12.1 mt -56.27 -43.77 79.08 Favored 'General case' 0 CA--C 1.512 -0.518 0 CA-C-N 119.035 0.834 . . . . 0.0 112.988 171.827 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 65.1 tttm -61.58 -48.31 81.52 Favored 'General case' 0 C--N 1.323 -0.573 0 CA-C-N 118.672 0.669 . . . . 0.0 109.697 -176.726 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 92.0 mt -61.51 -46.7 88.86 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.232 -0.44 . . . . 0.0 111.3 177.763 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 7.1 tt -50.1 -58.16 6.13 Favored 'General case' 0 CA--C 1.521 -0.147 0 C-N-CA 124.213 1.005 . . . . 0.0 109.443 174.577 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 45.1 mt -57.68 -53.09 62.07 Favored 'General case' 0 N--CA 1.45 -0.433 0 N-CA-C 109.091 -0.707 . . . . 0.0 109.091 -178.332 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 25.5 tt0 -52.74 -47.13 67.62 Favored 'General case' 0 N--CA 1.453 -0.309 0 O-C-N 121.651 -0.656 . . . . 0.0 111.879 -177.41 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 2.5 m -75.46 -51.27 13.42 Favored 'General case' 0 CA--C 1.534 0.358 0 C-N-CA 121.058 -0.257 . . . . 0.0 111.144 -176.21 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 38.8 mm-40 -90.69 -31.25 16.67 Favored 'General case' 0 N--CA 1.451 -0.425 0 C-N-CA 123.6 0.76 . . . . 0.0 112.828 -166.724 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 82.2 m-85 . . . . . 0 CA--C 1.537 0.45 0 C-N-CA 124.863 1.265 . . . . 0.0 111.581 -172.801 . . . . . . . . 0 0 . 1 . 018 nuclear orig core ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 20.3 mt . . . . . 0 C--O 1.223 -0.309 0 N-CA-C 108.645 -0.872 . . . . 0.0 108.645 . . . . . . . . . 0 0 . 1 . 018 nuclear orig core ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 5.1 m-20 -52.28 -60.59 3.03 Favored 'General case' 0 N--CA 1.449 -0.504 0 C-N-CA 124.311 1.044 . . . . 0.0 110.32 176.161 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 34.2 tt0 -53.64 -46.54 70.56 Favored 'General case' 0 N--CA 1.455 -0.205 0 O-C-N 122.425 -0.172 . . . . 0.0 110.806 179.863 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 87.9 mt -56.38 -49.68 73.76 Favored 'General case' 0 C--O 1.224 -0.277 0 C-N-CA 121.069 -0.252 . . . . 0.0 110.384 176.632 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 50' ' ' PHE . . . . . . . . . . . . . 55.0 t80 -54.67 -51.61 64.94 Favored 'General case' 0 C--N 1.329 -0.319 0 C-N-CA 124.567 1.147 . . . . 0.0 110.45 -178.927 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 1.8 mp0 -56.13 -48.25 76.58 Favored 'General case' 0 CA--C 1.531 0.245 0 CA-C-O 120.641 0.258 . . . . 0.0 110.548 174.784 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 37.0 tt0 -55.23 -43.77 74.85 Favored 'General case' 0 N--CA 1.456 -0.155 0 C-N-CA 123.047 0.539 . . . . 0.0 111.437 -179.745 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 48.3 mt -65.64 -56.59 11.36 Favored 'General case' 0 N--CA 1.448 -0.573 0 N-CA-C 109.838 -0.43 . . . . 0.0 109.838 176.028 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 47.2 t0 . . . . . 0 CA--C 1.532 0.255 0 C-N-CA 123.856 0.862 . . . . 0.0 110.909 -174.601 . . . . . . . . 0 0 . 1 . 018 nuclear orig core ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 50.9 mt-10 . . . . . 0 CA--C 1.529 0.149 0 N-CA-C 107.99 -1.115 . . . . 0.0 107.99 . . . . . . . . . 0 0 . 1 . 018 nuclear orig core ' A' A ' 61' ' ' VAL . . . . . . . . . . . . . 5.5 t -112.18 106.13 20.15 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.295 0 CA-C-N 118.129 0.422 . . . . 0.0 111.017 -169.621 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 59.9 p -78.87 167.72 20.75 Favored 'General case' 0 CA--C 1.539 0.531 0 C-N-CA 122.995 0.518 . . . . 0.0 111.322 173.578 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 63' ' ' PHE . . . . . . . . . . . . . 57.2 t80 -60.93 -38.15 84.81 Favored 'General case' 0 CA--C 1.533 0.294 0 O-C-N 121.447 -0.783 . . . . 0.0 112.754 -172.81 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 1.9 pp20? -63.95 -56.66 13.52 Favored 'General case' 0 CA--C 1.536 0.408 0 O-C-N 121.8 -0.562 . . . . 0.0 111.061 -178.926 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 9.1 pt-20 -60.55 -36.86 79.46 Favored 'General case' 0 CA--C 1.537 0.443 0 O-C-N 121.425 -0.797 . . . . 0.0 111.408 176.805 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 21.5 t80 -52.32 -26.87 13.31 Favored 'General case' 0 CA--C 1.538 0.489 0 O-C-N 121.551 -0.718 . . . . 0.0 112.209 170.938 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 67' ' ' GLN . . . . . . . . . . . . . 58.6 mm-40 -55.04 -23.21 18.83 Favored 'General case' 0 CA--C 1.535 0.37 0 CA-C-N 119.768 1.167 . . . . 0.0 113.43 172.821 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 92.7 t -58.59 -32.95 47.19 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.555 0 CA-C-N 119.861 1.21 . . . . 0.0 110.468 171.428 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 22.1 tp -73.81 -48.43 31.42 Favored 'General case' 0 N--CA 1.453 -0.304 0 N-CA-C 107.404 -1.332 . . . . 0.0 107.404 176.976 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 70' ' ' VAL . . . . . . . . . . . . . 38.4 t . . . . . 0 CA--C 1.537 0.476 0 C-N-CA 122.543 0.337 . . . . 0.0 110.67 179.501 . . . . . . . . 0 0 . 1 . 019 nuclear orig core ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 90.3 Cg_exo . . . . . 0 N--CA 1.455 -0.765 0 N-CA-C 112.972 0.335 . . . . 0.0 112.972 . . . . . . . . . 0 0 . 1 . 019 nuclear orig core ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 19.0 mt-10 -67.58 -49.0 65.23 Favored 'General case' 0 N--CA 1.455 -0.18 0 CA-C-O 121.302 0.572 . . . . 0.0 110.273 -178.145 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 5.6 mp0 -65.51 -43.18 90.9 Favored 'General case' 0 N--CA 1.452 -0.353 0 N-CA-C 107.835 -1.172 . . . . 0.0 107.835 178.821 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 14.7 mt -57.2 -37.81 72.73 Favored 'General case' 0 N--CA 1.452 -0.341 0 N-CA-C 112.321 0.489 . . . . 0.0 112.321 177.012 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 55.7 tptt -61.83 -51.15 69.44 Favored 'General case' 0 C--N 1.332 -0.152 0 CA-C-N 118.873 0.76 . . . . 0.0 110.967 170.366 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . -52.51 -50.76 46.8 Favored Glycine 0 CA--C 1.531 1.051 0 N-CA-C 110.521 -1.032 . . . . 0.0 110.521 179.869 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 9' ' ' ILE . . . . . . . . . . . . . 88.0 mt -54.79 -54.75 20.26 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.298 0 C-N-CA 126.663 1.985 . . . . 0.0 109.923 173.745 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 10' ' ' PHE . . . . . . . . . . . . . 52.0 t80 -48.63 -52.8 21.29 Favored 'General case' 0 N--CA 1.453 -0.279 0 CA-C-N 118.29 0.495 . . . . 0.0 109.807 179.081 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 52.5 mt-10 -61.26 -52.69 63.7 Favored 'General case' 0 N--CA 1.455 -0.221 0 C-N-CA 123.075 0.55 . . . . 0.0 110.271 -177.986 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 25.9 ttpt -47.79 -57.74 5.23 Favored 'General case' 0 CA--C 1.53 0.191 0 C-N-CA 124.624 1.17 . . . . 0.0 110.838 177.409 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 38.6 m-85 -75.28 -34.62 61.35 Favored 'General case' 0 N--CA 1.45 -0.474 0 CA-C-O 119.193 -0.432 . . . . 0.0 110.522 -170.105 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -57.31 -63.95 1.05 Allowed 'General case' 0 N--CA 1.453 -0.299 0 N-CA-C 109.422 -0.585 . . . . 0.0 109.422 170.87 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.529 0.143 0 C-N-CA 125.311 1.445 . . . . 0.0 112.682 -177.154 . . . . . . . . 0 0 . 1 . 019 nuclear orig core ' A' A ' 20' ' ' PRO . . . . . . . . . . . . . 11.9 Cg_endo . . . . . 0 CA--C 1.535 0.574 0 N-CA-C 114.824 1.048 . . . . 0.0 114.824 . . . . . . . . . 0 0 . 1 . 019 nuclear orig core ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 58.0 m-80 -84.2 3.76 33.73 Favored 'General case' 0 CA--C 1.531 0.222 0 C-N-CA 124.008 0.923 . . . . 0.0 112.017 -178.021 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 0.7 OUTLIER -151.02 127.51 10.73 Favored 'General case' 0 N--CA 1.452 -0.368 0 O-C-N 121.395 -0.816 . . . . 0.0 112.629 -169.223 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 80.8 mt -93.44 129.43 39.61 Favored 'General case' 0 N--CA 1.452 -0.372 0 C-N-CA 122.883 0.473 . . . . 0.0 111.11 171.222 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 41.3 p -78.92 174.12 11.85 Favored 'General case' 0 CA--C 1.534 0.343 0 C-N-CA 124.255 1.022 . . . . 0.0 108.577 166.952 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 98.4 mttt -57.9 -44.84 87.0 Favored 'General case' 0 C--O 1.226 -0.153 0 O-C-N 121.837 -0.539 . . . . 0.0 110.483 172.408 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 24.3 mt-10 -66.73 -42.66 85.94 Favored 'General case' 0 N--CA 1.454 -0.253 0 CA-C-O 121.282 0.563 . . . . 0.0 110.168 -176.713 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 26.6 mt-10 -58.39 -49.42 77.31 Favored 'General case' 0 N--CA 1.451 -0.4 0 CA-C-N 115.738 -0.664 . . . . 0.0 109.211 176.152 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 10.7 mt -54.08 -42.73 69.65 Favored 'General case' 0 CA--C 1.512 -0.483 0 N-CA-C 113.28 0.845 . . . . 0.0 113.28 169.868 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 5.9 ttpm? -60.46 -53.04 62.33 Favored 'General case' 0 C--N 1.323 -0.554 0 CA-C-N 118.637 0.653 . . . . 0.0 109.845 -177.641 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 10.5 mp -59.16 -44.85 92.14 Favored 'General case' 0 C--O 1.235 0.301 0 CA-C-O 120.647 0.261 . . . . 0.0 111.294 178.433 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 6.5 tt -51.14 -57.89 7.56 Favored 'General case' 0 N--CA 1.456 -0.125 0 C-N-CA 123.682 0.793 . . . . 0.0 109.6 174.242 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 43.3 mt -54.86 -54.05 47.45 Favored 'General case' 0 N--CA 1.455 -0.203 0 C-N-CA 124.052 0.941 . . . . 0.0 109.956 -178.887 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 42.7 mt-30 -50.25 -53.11 30.61 Favored 'General case' 0 N--CA 1.457 -0.096 0 C-N-CA 123.098 0.559 . . . . 0.0 111.363 179.732 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 2.0 m -73.22 -49.64 26.83 Favored 'General case' 0 N--CA 1.454 -0.264 0 C-N-CA 120.28 -0.568 . . . . 0.0 111.259 -172.015 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 62.0 mm-40 -95.78 -31.02 13.39 Favored 'General case' 0 N--CA 1.449 -0.509 0 N-CA-C 113.382 0.882 . . . . 0.0 113.382 -166.644 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 67.9 m-85 . . . . . 0 CA--C 1.536 0.415 0 N-CA-C 113.198 0.814 . . . . 0.0 113.198 -171.577 . . . . . . . . 0 0 . 1 . 019 nuclear orig core ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 20.9 mt . . . . . 0 N--CA 1.452 -0.35 0 N-CA-C 107.961 -1.126 . . . . 0.0 107.961 . . . . . . . . . 0 0 . 1 . 019 nuclear orig core ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 5.3 m-20 -53.26 -57.07 11.82 Favored 'General case' 0 N--CA 1.449 -0.509 0 C-N-CA 124.812 1.245 . . . . 0.0 111.345 177.294 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 29.9 mm-40 -55.48 -45.88 76.95 Favored 'General case' 0 C--N 1.333 -0.135 0 O-C-N 122.438 -0.164 . . . . 0.0 110.924 177.447 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 1.1 tt -57.02 -50.0 74.08 Favored 'General case' 0 CA--C 1.537 0.46 0 CA-C-O 121.827 0.822 . . . . 0.0 109.854 178.306 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 50' ' ' PHE . . . . . . . . . . . . . 55.6 t80 -55.5 -50.64 69.39 Favored 'General case' 0 N--CA 1.45 -0.463 0 C-N-CA 125.078 1.351 . . . . 0.0 110.222 -179.195 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 74.6 mm-40 -59.38 -43.16 92.93 Favored 'General case' 0 N--CA 1.454 -0.229 0 CA-C-O 120.6 0.238 . . . . 0.0 111.317 176.185 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 7.7 tm-20 -54.26 -44.36 71.76 Favored 'General case' 0 CA--C 1.531 0.242 0 C-N-CA 122.374 0.27 . . . . 0.0 110.614 177.255 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 85.0 mt -69.43 -62.04 1.54 Allowed 'General case' 0 N--CA 1.453 -0.32 0 C-N-CA 122.436 0.295 . . . . 0.0 111.251 176.86 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 12.6 t0 . . . . . 0 N--CA 1.455 -0.192 0 C-N-CA 124.961 1.304 . . . . 0.0 109.39 178.999 . . . . . . . . 0 0 . 1 . 019 nuclear orig core ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 33.2 mt-10 . . . . . 0 CA--C 1.529 0.135 0 N-CA-C 106.233 -1.766 . . . . 0.0 106.233 . . . . . . . . . 0 0 . 1 . 019 nuclear orig core ' A' A ' 61' ' ' VAL . . . . . . . . . . . . . 46.6 t -112.1 108.63 25.99 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.318 0 CA-C-N 118.118 0.417 . . . . 0.0 110.591 -171.905 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 1.8 m -76.27 158.85 31.15 Favored 'General case' 0 CA--C 1.536 0.429 0 C-N-CA 125.517 1.527 . . . . 0.0 110.552 170.785 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 63' ' ' PHE . . . . . . . . . . . . . 54.7 t80 -53.12 -48.14 68.1 Favored 'General case' 0 CA--C 1.533 0.29 0 O-C-N 121.665 -0.647 . . . . 0.0 111.914 -174.47 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 2.8 pm0 -61.32 -25.46 67.15 Favored 'General case' 0 CA--C 1.537 0.458 0 N-CA-C 113.871 1.063 . . . . 0.0 113.871 -177.324 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 9.0 pt-20 -90.73 -37.81 13.45 Favored 'General case' 0 CA--C 1.532 0.279 0 CA-C-N 118.81 0.732 . . . . 0.0 109.225 174.977 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 9.5 t80 -51.5 -33.31 30.95 Favored 'General case' 0 CA--C 1.538 0.481 0 O-C-N 121.609 -0.682 . . . . 0.0 110.716 167.391 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 67' ' ' GLN . . . . . . . . . . . . . 60.5 mm-40 -54.09 -23.04 12.47 Favored 'General case' 0 CA--C 1.538 0.503 0 O-C-N 120.841 -1.162 . . . . 0.0 113.495 174.145 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 92.1 t -62.72 -34.46 65.65 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.584 0 CA-C-N 120.039 1.29 . . . . 0.0 110.304 171.454 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 9.1 tt -71.96 -42.29 66.74 Favored 'General case' 0 N--CA 1.456 -0.152 0 N-CA-C 107.402 -1.333 . . . . 0.0 107.402 177.505 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 70' ' ' VAL . . . . . . . . . . . . . 64.4 t . . . . . 0 CA--C 1.532 0.271 0 O-C-N 121.908 -0.495 . . . . 0.0 111.148 173.942 . . . . . . . . 0 0 . 1 . 020 nuclear orig core ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 53.4 Cg_exo . . . . . 0 N--CA 1.459 -0.508 0 N-CA-C 114.989 1.111 . . . . 0.0 114.989 . . . . . . . . . 0 0 . 1 . 020 nuclear orig core ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 46.3 mt-10 -60.75 -41.3 95.14 Favored 'General case' 0 CA--C 1.532 0.265 0 CA-C-O 121.323 0.582 . . . . 0.0 111.293 179.989 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 10.4 mp0 -69.41 -42.24 75.32 Favored 'General case' 0 N--CA 1.451 -0.414 0 N-CA-C 107.633 -1.247 . . . . 0.0 107.633 -178.688 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 18.7 mt -58.24 -38.71 77.39 Favored 'General case' 0 N--CA 1.448 -0.539 0 CA-C-O 119.075 -0.488 . . . . 0.0 111.674 173.004 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 2.1 tmtt? -62.88 -48.67 77.99 Favored 'General case' 0 CA--C 1.533 0.297 0 CA-C-N 119.111 0.869 . . . . 0.0 109.955 173.844 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . -54.78 -51.51 52.41 Favored Glycine 0 CA--C 1.533 1.2 0 N-CA-C 111.092 -0.803 . . . . 0.0 111.092 177.946 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 9' ' ' ILE . . . . . . . . . . . . . 3.2 mm -56.27 -50.23 72.4 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.262 0 C-N-CA 125.714 1.606 . . . . 0.0 109.359 175.549 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 10' ' ' PHE . . . . . . . . . . . . . 25.6 t80 -51.66 -49.94 61.35 Favored 'General case' 0 N--CA 1.444 -0.745 0 O-C-N 121.689 -0.632 . . . . 0.0 109.3 178.126 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 68.8 mt-10 -60.6 -50.77 72.21 Favored 'General case' 0 CA--C 1.531 0.241 0 CA-C-O 119.065 -0.493 . . . . 0.0 111.36 178.836 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 20.3 tptm -39.79 -53.98 2.17 Favored 'General case' 0 N--CA 1.464 0.238 0 C-N-CA 124.568 1.147 . . . . 0.0 110.941 175.466 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 79.0 m-85 -81.9 -46.85 13.51 Favored 'General case' 0 N--CA 1.454 -0.235 0 N-CA-C 111.655 0.242 . . . . 0.0 111.655 -176.172 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -54.25 -38.19 65.5 Favored 'General case' 0 C--N 1.329 -0.311 0 C-N-CA 124.413 1.085 . . . . 0.0 112.309 -179.333 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.534 0.362 0 C-N-CA 122.961 0.504 . . . . 0.0 111.697 174.132 . . . . . . . . 0 0 . 1 . 020 nuclear orig core ' A' A ' 20' ' ' PRO . . . . . . . . . . . . . 30.0 Cg_endo . . . . . 0 N--CA 1.458 -0.61 0 N-CA-C 112.985 0.34 . . . . 0.0 112.985 . . . . . . . . . 0 0 . 1 . 020 nuclear orig core ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 40.6 m-80 -87.36 -4.93 59.05 Favored 'General case' 0 N--CA 1.453 -0.307 0 C-N-CA 125.032 1.333 . . . . 0.0 113.27 -176.778 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 29.8 tt0 -140.75 134.11 29.78 Favored 'General case' 0 CA--C 1.541 0.61 0 CA-C-N 119.109 0.868 . . . . 0.0 112.754 -170.713 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 81.8 mt -108.8 136.36 48.49 Favored 'General case' 0 C--N 1.344 0.361 0 C-N-CA 125.339 1.455 . . . . 0.0 111.426 178.09 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 73.0 p -81.09 174.81 11.22 Favored 'General case' 0 CA--C 1.532 0.263 0 C-N-CA 124.29 1.036 . . . . 0.0 109.388 168.794 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 98.3 mttt -57.13 -46.6 82.54 Favored 'General case' 0 C--O 1.226 -0.156 0 O-C-N 122.088 -0.382 . . . . 0.0 110.129 172.143 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 45.2 tt0 -64.53 -46.2 83.93 Favored 'General case' 0 N--CA 1.452 -0.348 0 N-CA-C 110.2 -0.296 . . . . 0.0 110.2 -177.037 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -59.33 -44.63 92.58 Favored 'General case' 0 N--CA 1.45 -0.433 0 C-N-CA 120.256 -0.577 . . . . 0.0 109.872 176.97 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 11.3 mt -56.77 -43.57 80.96 Favored 'General case' 0 CA--C 1.511 -0.538 0 CA-C-N 119.168 0.894 . . . . 0.0 113.014 170.865 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 63.0 tttm -59.96 -52.3 66.0 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-N 118.754 0.706 . . . . 0.0 109.483 -178.425 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 10.3 mp -58.31 -47.83 82.45 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 116.36 -0.382 . . . . 0.0 110.92 179.237 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 7.4 tt -50.64 -58.4 5.94 Favored 'General case' 0 N--CA 1.455 -0.19 0 C-N-CA 123.531 0.732 . . . . 0.0 109.83 175.331 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 47.7 mt -54.94 -57.7 10.59 Favored 'General case' 0 C--N 1.332 -0.174 0 C-N-CA 123.654 0.782 . . . . 0.0 109.448 -177.708 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 53.0 tt0 -61.55 -45.41 94.28 Favored 'General case' 0 N--CA 1.449 -0.499 0 C-N-CA 124.729 1.212 . . . . 0.0 111.169 -170.888 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 17.9 m -76.41 -48.75 18.7 Favored 'General case' 0 N--CA 1.451 -0.377 0 CA-C-N 116.341 -0.39 . . . . 0.0 110.738 -175.191 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 71.7 mm-40 -93.26 -32.5 14.31 Favored 'General case' 0 N--CA 1.449 -0.496 0 N-CA-C 112.646 0.61 . . . . 0.0 112.646 -168.108 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 85.7 m-85 . . . . . 0 CA--C 1.53 0.203 0 C-N-CA 123.761 0.825 . . . . 0.0 110.668 -176.251 . . . . . . . . 0 0 . 1 . 020 nuclear orig core ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 59.5 tp . . . . . 0 C--O 1.223 -0.307 0 N-CA-C 110.517 -0.179 . . . . 0.0 110.517 . . . . . . . . . 0 0 . 1 . 020 nuclear orig core ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 5.4 m-20 -57.84 -56.5 21.22 Favored 'General case' 0 N--CA 1.452 -0.367 0 C-N-CA 124.16 0.984 . . . . 0.0 111.132 178.182 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 33.4 mt-10 -54.63 -45.7 73.79 Favored 'General case' 0 CA--C 1.53 0.187 0 CA-C-O 120.883 0.373 . . . . 0.0 110.93 176.614 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -57.88 -51.54 69.17 Favored 'General case' 0 CA--C 1.532 0.263 0 N-CA-C 109.17 -0.678 . . . . 0.0 109.17 179.596 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 50' ' ' PHE . . . . . . . . . . . . . 68.8 t80 -53.32 -50.41 65.03 Favored 'General case' 0 N--CA 1.453 -0.307 0 C-N-CA 125.143 1.377 . . . . 0.0 110.404 178.667 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 33.1 mt-10 -55.73 -48.91 74.41 Favored 'General case' 0 CA--C 1.531 0.222 0 C-N-CA 122.974 0.51 . . . . 0.0 110.658 176.799 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 33.4 tp10 -55.99 -45.43 78.98 Favored 'General case' 0 CA--C 1.531 0.214 0 C-N-CA 123.184 0.593 . . . . 0.0 111.375 177.284 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 32.0 mt -66.32 -45.09 81.51 Favored 'General case' 0 N--CA 1.45 -0.45 0 O-C-N 122.054 -0.404 . . . . 0.0 111.778 179.138 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 51.9 t0 . . . . . 0 CA--C 1.539 0.542 0 C-N-CA 124.961 1.305 . . . . 0.0 111.315 -174.185 . . . . . . . . 0 0 . 1 . 020 nuclear orig core ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 50.4 mt-10 . . . . . 0 N--CA 1.453 -0.287 0 N-CA-C 106.859 -1.534 . . . . 0.0 106.859 . . . . . . . . . 0 0 . 1 . 020 nuclear orig core ' A' A ' 61' ' ' VAL . . . . . . . . . . . . . 3.7 t -108.77 112.3 39.83 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.174 0 N-CA-C 109.767 -0.456 . . . . 0.0 109.767 -171.186 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 78.1 p -78.62 158.21 28.5 Favored 'General case' 0 CA--C 1.536 0.438 0 C-N-CA 122.804 0.441 . . . . 0.0 110.874 176.369 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 63' ' ' PHE . . . . . . . . . . . . . 69.6 t80 -55.21 -34.09 63.62 Favored 'General case' 0 N--CA 1.468 0.458 0 N-CA-C 113.248 0.833 . . . . 0.0 113.248 -177.81 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 45.7 mm-40 -65.2 -60.37 3.08 Favored 'General case' 0 N--CA 1.451 -0.424 0 O-C-N 121.85 -0.531 . . . . 0.0 109.822 179.735 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 12.8 pt-20 -66.1 -28.45 68.83 Favored 'General case' 0 CA--C 1.537 0.462 0 O-C-N 121.14 -0.975 . . . . 0.0 111.391 -177.421 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 15.9 t80 -51.85 -25.58 8.15 Favored 'General case' 0 CA--C 1.536 0.406 0 C-N-CA 123.8 0.84 . . . . 0.0 112.345 169.016 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 67' ' ' GLN . . . . . . . . . . . . . 59.3 mm-40 -54.09 -25.62 22.82 Favored 'General case' 0 CA--C 1.541 0.607 0 CA-C-N 119.532 1.06 . . . . 0.0 112.859 172.593 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 97.0 t -56.4 -33.93 39.62 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.543 0 O-C-N 121.369 -0.832 . . . . 0.0 110.853 171.626 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 25.1 tp -75.04 -47.65 27.93 Favored 'General case' 0 N--CA 1.457 -0.108 0 N-CA-C 107.993 -1.114 . . . . 0.0 107.993 175.159 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 70' ' ' VAL . . . . . . . . . . . . . 84.5 t . . . . . 0 CA--C 1.531 0.242 0 C-N-CA 122.46 0.304 . . . . 0.0 111.112 -179.793 . . . . . . . . 0 0 . 1 . 021 nuclear orig core ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 96.0 Cg_exo . . . . . 0 N--CA 1.458 -0.618 0 N-CA-C 113.038 0.361 . . . . 0.0 113.038 . . . . . . . . . 0 0 . 1 . 021 nuclear orig core ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 35.1 tt0 -62.67 -45.14 94.17 Favored 'General case' 0 N--CA 1.454 -0.266 0 C-N-CA 122.82 0.448 . . . . 0.0 111.464 178.839 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 6.9 mp0 -70.34 -40.86 73.85 Favored 'General case' 0 N--CA 1.451 -0.405 0 N-CA-C 108.35 -0.982 . . . . 0.0 108.35 179.532 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 7.3 mt -56.3 -38.35 71.14 Favored 'General case' 0 N--CA 1.452 -0.336 0 C-N-CA 122.786 0.434 . . . . 0.0 111.751 175.03 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 22.8 tptm -61.8 -54.31 44.07 Favored 'General case' 0 C--N 1.333 -0.144 0 CA-C-N 118.961 0.801 . . . . 0.0 111.083 170.508 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . -49.87 -48.71 37.05 Favored Glycine 0 CA--C 1.534 1.254 0 N-CA-C 111.202 -0.759 . . . . 0.0 111.202 178.846 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 9' ' ' ILE . . . . . . . . . . . . . 2.8 mm -59.59 -54.44 34.46 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.315 0 C-N-CA 127.156 2.182 . . . . 0.0 109.209 176.999 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 10' ' ' PHE . . . . . . . . . . . . . 55.8 t80 -46.96 -53.07 13.15 Favored 'General case' 0 N--CA 1.45 -0.45 0 N-CA-C 109.45 -0.574 . . . . 0.0 109.45 177.744 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 50.4 mt-10 -59.72 -52.67 64.48 Favored 'General case' 0 N--CA 1.454 -0.251 0 C-N-CA 123.015 0.526 . . . . 0.0 110.55 179.666 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 44.5 tttp -44.13 -52.82 6.97 Favored 'General case' 0 CA--C 1.528 0.12 0 C-N-CA 124.567 1.147 . . . . 0.0 111.307 178.375 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 69.9 m-85 -78.39 -46.41 20.0 Favored 'General case' 0 CA--C 1.532 0.287 0 C-N-CA 121.182 -0.207 . . . . 0.0 110.877 -175.88 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -56.59 -31.94 64.74 Favored 'General case' 0 CA--C 1.535 0.382 0 C-N-CA 125.019 1.327 . . . . 0.0 112.583 -179.778 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.452 -0.373 0 O-C-N 121.68 -0.638 . . . . 0.0 112.419 176.095 . . . . . . . . 0 0 . 1 . 021 nuclear orig core ' A' A ' 20' ' ' PRO . . . . . . . . . . . . . 18.9 Cg_endo . . . . . 0 CA--C 1.534 0.499 0 N-CA-C 113.621 0.585 . . . . 0.0 113.621 . . . . . . . . . 0 0 . 1 . 021 nuclear orig core ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 69.0 m-80 -79.83 -20.18 46.67 Favored 'General case' 0 N--CA 1.452 -0.367 0 C-N-CA 124.306 1.042 . . . . 0.0 113.075 -178.541 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 12.0 tt0 -154.13 124.32 6.9 Favored 'General case' 0 CA--C 1.538 0.481 0 CA-C-N 119.147 0.885 . . . . 0.0 112.631 -168.098 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 42.6 mt -81.65 141.2 33.87 Favored 'General case' 0 C--O 1.234 0.276 0 C-N-CA 124.083 0.953 . . . . 0.0 112.101 -177.775 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 90.5 p -86.57 173.08 9.8 Favored 'General case' 0 CA--C 1.537 0.442 0 C-N-CA 124.42 1.088 . . . . 0.0 109.373 167.312 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 92.9 mttt -55.0 -44.18 74.27 Favored 'General case' 0 C--O 1.225 -0.224 0 O-C-N 121.814 -0.554 . . . . 0.0 110.731 173.685 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 46.4 mp0 -66.02 -50.27 64.82 Favored 'General case' 0 N--CA 1.45 -0.443 0 CA-C-O 121.389 0.614 . . . . 0.0 109.769 -174.136 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 65.5 mt-10 -53.13 -48.88 67.54 Favored 'General case' 0 N--CA 1.451 -0.376 0 CA-C-N 114.874 -1.057 . . . . 0.0 109.867 174.131 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 11.5 mt -57.18 -40.67 77.81 Favored 'General case' 0 CA--C 1.514 -0.418 0 N-CA-C 113.386 0.884 . . . . 0.0 113.386 172.959 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 5.1 ttpm? -63.23 -49.72 73.05 Favored 'General case' 0 C--N 1.322 -0.601 0 CA-C-N 118.817 0.735 . . . . 0.0 109.836 -177.572 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 4.1 mm? -60.01 -48.52 81.38 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.752 177.369 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 8.6 tt -50.26 -56.81 9.59 Favored 'General case' 0 N--CA 1.456 -0.143 0 C-N-CA 123.869 0.867 . . . . 0.0 109.568 175.476 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 39.1 mt -55.73 -58.63 7.02 Favored 'General case' 0 C--N 1.331 -0.22 0 C-N-CA 123.696 0.798 . . . . 0.0 109.58 -178.809 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 23.0 tt0 -55.9 -47.48 77.38 Favored 'General case' 0 N--CA 1.452 -0.328 0 C-N-CA 123.231 0.612 . . . . 0.0 111.337 -174.171 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 12.7 m -76.98 -45.82 26.12 Favored 'General case' 0 N--CA 1.451 -0.381 0 CA-C-N 116.224 -0.444 . . . . 0.0 111.229 -172.538 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 71.3 mm-40 -97.35 -33.37 11.45 Favored 'General case' 0 N--CA 1.451 -0.42 0 N-CA-C 112.685 0.624 . . . . 0.0 112.685 -168.32 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 54.2 m-85 . . . . . 0 C--O 1.236 0.343 0 C-N-CA 123.521 0.728 . . . . 0.0 111.409 -174.408 . . . . . . . . 0 0 . 1 . 021 nuclear orig core ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 52.0 tp . . . . . 0 C--O 1.224 -0.249 0 N-CA-C 110.058 -0.349 . . . . 0.0 110.058 . . . . . . . . . 0 0 . 1 . 021 nuclear orig core ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 6.6 m-20 -53.16 -61.18 2.47 Favored 'General case' 0 N--CA 1.448 -0.563 0 C-N-CA 124.053 0.941 . . . . 0.0 110.588 175.7 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 25.5 mt-10 -51.33 -49.89 60.52 Favored 'General case' 0 C--N 1.332 -0.169 0 N-CA-C 111.308 0.114 . . . . 0.0 111.308 178.765 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 8.8 mp -55.87 -48.08 76.2 Favored 'General case' 0 C--N 1.334 -0.105 0 CA-C-O 120.747 0.308 . . . . 0.0 110.454 178.032 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 50' ' ' PHE . . . . . . . . . . . . . 63.8 t80 -58.34 -48.94 78.95 Favored 'General case' 0 N--CA 1.448 -0.533 0 C-N-CA 123.198 0.599 . . . . 0.0 110.481 -178.989 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 1.2 mp0 -56.77 -50.27 72.8 Favored 'General case' 0 N--CA 1.455 -0.224 0 N-CA-C 110.51 -0.182 . . . . 0.0 110.51 176.854 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 39.1 mt-10 -54.04 -47.18 71.86 Favored 'General case' 0 CA--C 1.529 0.166 0 CA-C-O 121.1 0.476 . . . . 0.0 110.972 178.597 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 90.8 mt -68.96 -42.38 76.71 Favored 'General case' 0 N--CA 1.451 -0.424 0 C-N-CA 123.509 0.724 . . . . 0.0 111.931 -177.05 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 52.5 t0 . . . . . 0 CA--C 1.537 0.461 0 C-N-CA 124.286 1.034 . . . . 0.0 111.31 -175.545 . . . . . . . . 0 0 . 1 . 021 nuclear orig core ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 35.3 mt-10 . . . . . 0 CA--C 1.533 0.322 0 N-CA-C 106.809 -1.552 . . . . 0.0 106.809 . . . . . . . . . 0 0 . 1 . 021 nuclear orig core ' A' A ' 61' ' ' VAL . . . . . . . . . . . . . 3.4 t -129.08 108.76 17.51 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.516 0 CA-C-N 118.469 0.577 . . . . 0.0 112.125 -172.418 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 75.7 m -77.82 163.76 25.79 Favored 'General case' 0 CA--C 1.538 0.483 0 C-N-CA 124.467 1.107 . . . . 0.0 111.512 173.813 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 63' ' ' PHE . . . . . . . . . . . . . 61.7 t80 -59.69 -38.26 81.08 Favored 'General case' 0 CA--C 1.534 0.353 0 N-CA-C 113.028 0.751 . . . . 0.0 113.028 -172.806 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 50.0 mt-10 -61.74 -59.57 4.97 Favored 'General case' 0 CA--C 1.532 0.256 0 O-C-N 121.902 -0.499 . . . . 0.0 110.167 -179.067 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 16.6 pt-20 -61.55 -35.94 79.19 Favored 'General case' 0 CA--C 1.539 0.536 0 O-C-N 121.458 -0.776 . . . . 0.0 111.644 178.561 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 18.5 t80 -52.74 -22.89 5.77 Favored 'General case' 0 CA--C 1.536 0.426 0 C-N-CA 123.703 0.801 . . . . 0.0 112.439 169.932 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 67' ' ' GLN . . . . . . . . . . . . . 34.2 mm-40 -53.69 -21.55 7.25 Favored 'General case' 0 CA--C 1.537 0.453 0 CA-C-N 119.789 1.177 . . . . 0.0 113.001 171.063 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 70.8 t -55.49 -36.7 42.49 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.651 0 CA-C-N 119.886 1.221 . . . . 0.0 110.464 169.454 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 12.4 tp -72.59 -44.22 62.31 Favored 'General case' 0 N--CA 1.457 -0.108 0 N-CA-C 108.061 -1.088 . . . . 0.0 108.061 177.662 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 70' ' ' VAL . . . . . . . . . . . . . 54.3 t . . . . . 0 CA--C 1.534 0.36 0 N-CA-C 110.157 -0.312 . . . . 0.0 110.157 175.946 . . . . . . . . 0 0 . 1 . 022 nuclear orig core ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 85.1 Cg_exo . . . . . 0 N--CA 1.46 -0.495 0 N-CA-C 113.665 0.602 . . . . 0.0 113.665 . . . . . . . . . 0 0 . 1 . 022 nuclear orig core ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 3.2 mp0 -58.13 -48.92 78.74 Favored 'General case' 0 N--CA 1.456 -0.135 0 C-N-CA 123.88 0.872 . . . . 0.0 111.531 176.893 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 58.5 mm-40 -66.38 -38.5 87.68 Favored 'General case' 0 N--CA 1.448 -0.565 0 N-CA-C 109.085 -0.709 . . . . 0.0 109.085 179.343 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 48.2 mt -62.32 -35.62 79.62 Favored 'General case' 0 N--CA 1.451 -0.415 0 C-N-CA 123.436 0.694 . . . . 0.0 112.536 174.877 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 23.4 tptm -61.07 -49.18 78.39 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 118.88 0.764 . . . . 0.0 109.599 169.045 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . -49.7 -51.57 27.94 Favored Glycine 0 CA--C 1.534 1.22 0 N-CA-C 111.092 -0.803 . . . . 0.0 111.092 176.055 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 9' ' ' ILE . . . . . . . . . . . . . 2.8 mm -58.12 -54.22 35.2 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.241 0 C-N-CA 126.28 1.832 . . . . 0.0 109.327 177.117 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 10' ' ' PHE . . . . . . . . . . . . . 50.6 t80 -47.9 -52.21 20.21 Favored 'General case' 0 N--CA 1.449 -0.476 0 C-N-CA 123.503 0.721 . . . . 0.0 109.219 178.693 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 52.0 mt-10 -61.22 -51.4 69.16 Favored 'General case' 0 CA--C 1.532 0.281 0 C-N-CA 123.063 0.545 . . . . 0.0 110.553 179.724 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 37.7 tttm -45.1 -53.26 8.19 Favored 'General case' 0 C--N 1.338 0.108 0 C-N-CA 124.42 1.088 . . . . 0.0 111.124 177.981 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 68.2 m-85 -78.6 -43.78 25.58 Favored 'General case' 0 N--CA 1.454 -0.24 0 C-N-CA 121.041 -0.264 . . . . 0.0 110.97 -175.832 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -58.55 -28.73 65.76 Favored 'General case' 0 CA--C 1.532 0.284 0 C-N-CA 124.181 0.992 . . . . 0.0 112.228 179.779 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.452 -0.342 0 C-N-CA 122.999 0.519 . . . . 0.0 112.191 174.106 . . . . . . . . 0 0 . 1 . 022 nuclear orig core ' A' A ' 20' ' ' PRO . . . . . . . . . . . . . 12.8 Cg_endo . . . . . 0 CA--C 1.537 0.656 0 N-CA-C 114.385 0.879 . . . . 0.0 114.385 . . . . . . . . . 0 0 . 1 . 022 nuclear orig core ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -80.84 -25.26 37.85 Favored 'General case' 0 N--CA 1.451 -0.42 0 C-N-CA 125.591 1.556 . . . . 0.0 111.814 -174.685 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 59.1 tt0 -153.33 121.62 6.22 Favored 'General case' 0 N--CA 1.451 -0.409 0 N-CA-C 110.013 -0.366 . . . . 0.0 110.013 -165.9 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 50.0 mt -77.65 131.81 37.93 Favored 'General case' 0 N--CA 1.449 -0.511 0 N-CA-C 109.338 -0.616 . . . . 0.0 109.338 -174.798 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 50.9 p -75.2 167.02 22.71 Favored 'General case' 0 N--CA 1.448 -0.538 0 N-CA-C 108.448 -0.945 . . . . 0.0 108.448 169.038 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 30.9 ttmt -58.06 -37.84 75.18 Favored 'General case' 0 CA--C 1.538 0.505 0 O-C-N 121.984 -0.448 . . . . 0.0 110.104 173.963 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 24.6 mt-10 -67.68 -47.2 70.15 Favored 'General case' 0 N--CA 1.455 -0.212 0 O-C-N 121.529 -0.732 . . . . 0.0 110.667 179.008 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 23.7 mt-10 -57.49 -44.7 85.16 Favored 'General case' 0 CA--C 1.534 0.364 0 N-CA-C 109.525 -0.546 . . . . 0.0 109.525 177.455 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 15.3 mt -54.0 -48.23 70.64 Favored 'General case' 0 CA--C 1.508 -0.646 0 CA-C-N 118.317 0.508 . . . . 0.0 112.192 169.205 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 52.4 tttp -60.64 -43.12 97.91 Favored 'General case' 0 C--N 1.322 -0.593 0 CA-C-N 118.602 0.637 . . . . 0.0 110.268 -176.505 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 87.7 mt -60.88 -52.01 66.88 Favored 'General case' 0 C--N 1.328 -0.355 0 O-C-N 122.18 -0.325 . . . . 0.0 111.324 175.263 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 7.1 tt -48.15 -58.22 4.81 Favored 'General case' 0 C--N 1.334 -0.108 0 C-N-CA 124.38 1.072 . . . . 0.0 109.27 175.887 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 46.6 mt -59.14 -54.16 50.15 Favored 'General case' 0 N--CA 1.449 -0.512 0 C-N-CA 123.96 0.904 . . . . 0.0 109.868 -175.6 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 25.7 mt-30 -56.55 -48.91 76.31 Favored 'General case' 0 C--O 1.227 -0.13 0 CA-C-N 118.548 0.613 . . . . 0.0 110.996 -177.515 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 11.2 m -72.36 -47.52 48.88 Favored 'General case' 0 N--CA 1.453 -0.298 0 CA-C-N 116.325 -0.398 . . . . 0.0 110.691 -171.983 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 76.3 mm-40 -91.77 -33.4 15.01 Favored 'General case' 0 N--CA 1.451 -0.425 0 C-N-CA 123.553 0.741 . . . . 0.0 112.295 -169.438 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 79.8 m-85 . . . . . 0 CA--C 1.539 0.54 0 C-N-CA 123.969 0.907 . . . . 0.0 112.857 -171.105 . . . . . . . . 0 0 . 1 . 022 nuclear orig core ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 49.3 tp . . . . . 0 N--CA 1.454 -0.27 0 CA-C-O 120.964 0.412 . . . . 0.0 111.833 . . . . . . . . . 0 0 . 1 . 022 nuclear orig core ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 13.5 m-20 -59.48 -49.41 77.91 Favored 'General case' 0 N--CA 1.45 -0.458 0 C-N-CA 123.104 0.561 . . . . 0.0 109.908 -177.627 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 47.8 mt-10 -51.94 -53.13 44.78 Favored 'General case' 0 N--CA 1.454 -0.253 0 CA-C-N 116.357 -0.383 . . . . 0.0 110.644 174.413 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 6.0 mp -53.6 -52.44 59.81 Favored 'General case' 0 CA--C 1.527 0.068 0 CA-C-O 121.256 0.551 . . . . 0.0 110.428 178.304 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 50' ' ' PHE . . . . . . . . . . . . . 39.3 t80 -55.76 -45.37 78.08 Favored 'General case' 0 N--CA 1.446 -0.647 0 O-C-N 122.015 -0.428 . . . . 0.0 110.584 -178.065 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 35.5 mt-10 -67.6 -40.76 84.74 Favored 'General case' 0 N--CA 1.456 -0.17 0 CA-C-N 118.237 0.471 . . . . 0.0 112.069 179.67 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 30.8 mt-10 -53.15 -46.95 69.09 Favored 'General case' 0 N--CA 1.456 -0.128 0 C-N-CA 122.964 0.506 . . . . 0.0 110.147 174.326 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 76.2 mt -80.85 -55.89 4.5 Favored 'General case' 0 N--CA 1.45 -0.426 0 C-N-CA 122.849 0.46 . . . . 0.0 111.462 -173.358 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 14.3 t0 . . . . . 0 N--CA 1.448 -0.538 0 C-N-CA 126.173 1.789 . . . . 0.0 107.624 -179.156 . . . . . . . . 0 0 . 1 . 022 nuclear orig core ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 7.3 mm-40 . . . . . 0 CA--C 1.535 0.376 0 N-CA-C 102.94 -2.985 . . . . 0.0 102.94 . . . . . . . . . 0 0 . 1 . 022 nuclear orig core ' A' A ' 61' ' ' VAL . . . . . . . . . . . . . 91.8 t -96.21 111.56 26.67 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.432 0 CA-C-N 120.365 1.439 . . . . 0.0 112.992 -167.791 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 60.4 p -80.41 161.46 24.94 Favored 'General case' 0 CA--C 1.541 0.606 0 O-C-N 121.428 -0.795 . . . . 0.0 112.173 175.866 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 63' ' ' PHE . . . . . . . . . . . . . 63.6 t80 -58.65 -40.29 83.0 Favored 'General case' 0 N--CA 1.464 0.246 0 C-N-CA 123.026 0.53 . . . . 0.0 112.428 -172.885 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 20.8 pm0 -61.82 -50.64 71.47 Favored 'General case' 0 N--CA 1.448 -0.535 0 O-C-N 121.865 -0.522 . . . . 0.0 111.355 -178.267 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 10.5 pt-20 -71.38 -31.55 67.43 Favored 'General case' 0 CA--C 1.53 0.195 0 O-C-N 121.398 -0.814 . . . . 0.0 110.948 178.232 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 25.0 t80 -51.83 -27.93 14.14 Favored 'General case' 0 CA--C 1.54 0.591 0 CA-C-N 118.526 0.603 . . . . 0.0 111.747 169.472 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 67' ' ' GLN . . . . . . . . . . . . . 46.7 mm-40 -54.54 -29.79 51.97 Favored 'General case' 0 N--CA 1.469 0.492 0 O-C-N 120.742 -1.224 . . . . 0.0 113.022 171.393 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 82.9 t -61.38 -32.8 54.24 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.405 0 O-C-N 121.173 -0.954 . . . . 0.0 110.028 172.575 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 1.2 tt -71.78 -48.75 44.44 Favored 'General case' 0 N--CA 1.454 -0.243 0 N-CA-C 106.206 -1.776 . . . . 0.0 106.206 177.788 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 70' ' ' VAL . . . . . . . . . . . . . 42.9 t . . . . . 0 CA--C 1.535 0.373 0 C-N-CA 122.176 0.19 . . . . 0.0 110.494 175.922 . . . . . . . . 0 0 . 1 . 023 nuclear orig core ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 79.8 Cg_exo . . . . . 0 N--CA 1.456 -0.702 0 N-CA-C 112.284 0.071 . . . . 0.0 112.284 . . . . . . . . . 0 0 . 1 . 023 nuclear orig core ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 48.2 mt-10 -63.74 -49.68 72.1 Favored 'General case' 0 CA--C 1.529 0.166 0 C-N-CA 123.59 0.756 . . . . 0.0 110.923 177.209 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 46.9 mm-40 -58.65 -45.76 88.64 Favored 'General case' 0 N--CA 1.455 -0.204 0 N-CA-C 108.959 -0.756 . . . . 0.0 108.959 176.016 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 66.9 mt -60.83 -37.96 83.83 Favored 'General case' 0 N--CA 1.447 -0.579 0 C-N-CA 124.141 0.976 . . . . 0.0 112.56 179.848 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 2.6 tppp? -57.99 -53.85 53.55 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 119.249 0.932 . . . . 0.0 109.575 168.832 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . -49.17 -52.99 20.94 Favored Glycine 0 CA--C 1.536 1.344 0 N-CA-C 111.651 -0.58 . . . . 0.0 111.651 178.005 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 9' ' ' ILE . . . . . . . . . . . . . 1.9 mm -56.83 -51.38 68.34 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.231 0 C-N-CA 127.056 2.142 . . . . 0.0 109.265 176.205 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 10' ' ' PHE . . . . . . . . . . . . . 21.7 t80 -51.62 -48.95 63.1 Favored 'General case' 0 N--CA 1.445 -0.68 0 O-C-N 121.365 -0.834 . . . . 0.0 108.955 179.659 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 49.8 mt-10 -63.77 -49.39 73.16 Favored 'General case' 0 CA--C 1.531 0.237 0 CA-C-O 118.679 -0.677 . . . . 0.0 111.281 179.344 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 48.2 tptt -39.09 -51.47 1.87 Allowed 'General case' 0 N--CA 1.467 0.41 0 C-N-CA 124.74 1.216 . . . . 0.0 110.662 174.072 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 80.8 m-85 -81.43 -57.69 3.37 Favored 'General case' 0 N--CA 1.451 -0.4 0 C-N-CA 121.074 -0.25 . . . . 0.0 111.532 -177.632 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -48.63 -43.63 36.57 Favored 'General case' 0 C--N 1.331 -0.204 0 C-N-CA 124.665 1.186 . . . . 0.0 112.374 -177.242 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.53 0.183 0 C-N-CA 124.272 1.029 . . . . 0.0 112.921 -179.821 . . . . . . . . 0 0 . 1 . 023 nuclear orig core ' A' A ' 20' ' ' PRO . . . . . . . . . . . . . 68.8 Cg_endo . . . . . 0 N--CA 1.456 -0.72 0 N-CA-C 112.855 0.29 . . . . 0.0 112.855 . . . . . . . . . 0 0 . 1 . 023 nuclear orig core ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 35.7 m120 -91.24 -5.2 55.16 Favored 'General case' 0 C--O 1.234 0.267 0 C-N-CA 125.207 1.403 . . . . 0.0 113.763 -168.716 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 49.2 tt0 -141.42 129.6 22.19 Favored 'General case' 0 CA--C 1.541 0.599 0 C-N-CA 123.674 0.79 . . . . 0.0 111.69 -169.684 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 63.0 mt -102.42 137.39 40.73 Favored 'General case' 0 C--N 1.344 0.359 0 C-N-CA 125.107 1.363 . . . . 0.0 111.958 -179.358 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 78.1 p -79.51 172.95 13.09 Favored 'General case' 0 C--O 1.234 0.25 0 C-N-CA 124.609 1.164 . . . . 0.0 109.368 168.542 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 58.7 mttm -56.66 -47.58 79.48 Favored 'General case' 0 N--CA 1.456 -0.161 0 O-C-N 122.124 -0.36 . . . . 0.0 110.031 172.007 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 41.5 tt0 -64.2 -46.39 84.14 Favored 'General case' 0 N--CA 1.45 -0.433 0 N-CA-C 110.286 -0.264 . . . . 0.0 110.286 -175.911 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 1.1 mp0 -61.6 -41.69 97.8 Favored 'General case' 0 N--CA 1.45 -0.47 0 CA-C-O 118.532 -0.746 . . . . 0.0 110.098 177.671 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 12.8 mt -57.0 -44.89 83.19 Favored 'General case' 0 CA--C 1.512 -0.519 0 CA-C-N 119.746 1.157 . . . . 0.0 112.611 169.476 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 4.8 ttpm? -61.7 -47.55 84.77 Favored 'General case' 0 C--N 1.323 -0.549 0 CA-C-N 118.495 0.589 . . . . 0.0 109.905 -176.113 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 9.8 mp -60.53 -48.23 82.68 Favored 'General case' 0 C--N 1.329 -0.289 0 C-N-CA 122.539 0.336 . . . . 0.0 111.198 176.715 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 7.4 tt -50.38 -58.25 6.12 Favored 'General case' 0 C--N 1.333 -0.138 0 C-N-CA 123.7 0.8 . . . . 0.0 109.552 175.441 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 42.0 mt -57.45 -53.46 57.85 Favored 'General case' 0 N--CA 1.452 -0.339 0 CA-C-N 115.656 -0.702 . . . . 0.0 109.295 -177.527 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 22.2 tt0 -54.6 -49.31 70.75 Favored 'General case' 0 N--CA 1.453 -0.301 0 C-N-CA 123.683 0.793 . . . . 0.0 111.659 -177.281 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 2.7 m -72.8 -50.4 24.5 Favored 'General case' 0 CA--C 1.532 0.269 0 C-N-CA 120.968 -0.293 . . . . 0.0 110.869 -175.416 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 65.5 mm-40 -92.67 -30.02 15.79 Favored 'General case' 0 N--CA 1.45 -0.453 0 N-CA-C 113.254 0.835 . . . . 0.0 113.254 -165.966 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 80.8 m-85 . . . . . 0 CA--C 1.535 0.368 0 C-N-CA 124.019 0.928 . . . . 0.0 111.413 -175.256 . . . . . . . . 0 0 . 1 . 023 nuclear orig core ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 65.6 tp . . . . . 0 C--O 1.227 -0.115 0 CA-C-O 121.063 0.458 . . . . 0.0 111.923 . . . . . . . . . 0 0 . 1 . 023 nuclear orig core ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 16.0 m-20 -60.02 -51.9 67.68 Favored 'General case' 0 N--CA 1.447 -0.624 0 CA-C-O 120.918 0.39 . . . . 0.0 111.305 -179.839 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 44.0 tt0 -56.05 -48.26 76.35 Favored 'General case' 0 N--CA 1.451 -0.419 0 CA-C-N 115.998 -0.546 . . . . 0.0 109.759 177.157 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 62.1 tp -56.02 -50.94 69.5 Favored 'General case' 0 N--CA 1.452 -0.362 0 C-N-CA 122.893 0.477 . . . . 0.0 110.216 178.943 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 50' ' ' PHE . . . . . . . . . . . . . 64.3 t80 -54.77 -50.44 68.44 Favored 'General case' 0 N--CA 1.45 -0.444 0 C-N-CA 123.649 0.78 . . . . 0.0 110.217 179.54 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 35.4 mt-10 -59.21 -47.26 86.0 Favored 'General case' 0 N--CA 1.454 -0.252 0 CA-C-O 120.677 0.275 . . . . 0.0 110.905 179.552 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 35.3 mm-40 -62.34 -37.0 83.95 Favored 'General case' 0 C--N 1.332 -0.17 0 C-N-CA 123.025 0.53 . . . . 0.0 111.75 179.962 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 79.9 mt -72.97 -44.95 60.51 Favored 'General case' 0 N--CA 1.449 -0.478 0 O-C-N 122.038 -0.414 . . . . 0.0 111.53 178.176 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 27.4 t70 . . . . . 0 C--O 1.235 0.298 0 CA-C-O 121.023 0.439 . . . . 0.0 111.795 -170.01 . . . . . . . . 0 0 . 1 . 023 nuclear orig core ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 36.4 mt-10 . . . . . 0 CA--C 1.53 0.188 0 CA-C-O 121.211 0.529 . . . . 0.0 110.062 . . . . . . . . . 0 0 . 1 . 023 nuclear orig core ' A' A ' 61' ' ' VAL . . . . . . . . . . . . . 3.6 t -80.42 117.69 26.78 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.251 0 C-N-CA 123.827 0.851 . . . . 0.0 110.955 -166.361 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 87.0 p -76.71 157.01 32.06 Favored 'General case' 0 CA--C 1.532 0.267 0 CA-C-N 118.161 0.437 . . . . 0.0 110.466 177.484 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 63' ' ' PHE . . . . . . . . . . . . . 79.3 t80 -55.22 -32.13 62.01 Favored 'General case' 0 CA--C 1.533 0.291 0 O-C-N 121.762 -0.586 . . . . 0.0 112.394 177.087 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 44.3 mt-10 -64.95 -61.63 2.05 Favored 'General case' 0 N--CA 1.451 -0.404 0 O-C-N 121.803 -0.56 . . . . 0.0 110.12 178.329 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 8.4 pt-20 -66.21 -27.53 68.05 Favored 'General case' 0 CA--C 1.538 0.508 0 O-C-N 121.143 -0.973 . . . . 0.0 111.522 -177.824 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 18.0 t80 -52.22 -25.26 8.8 Favored 'General case' 0 CA--C 1.537 0.468 0 C-N-CA 123.848 0.859 . . . . 0.0 111.931 168.449 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 67' ' ' GLN . . . . . . . . . . . . . 67.9 mm-40 -55.17 -23.95 24.26 Favored 'General case' 0 CA--C 1.538 0.482 0 CA-C-N 119.678 1.126 . . . . 0.0 113.01 171.435 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 91.6 t -60.86 -36.32 70.79 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.532 0 CA-C-N 119.575 1.08 . . . . 0.0 110.233 169.914 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 1.4 tt -72.38 -46.05 57.04 Favored 'General case' 0 N--CA 1.453 -0.283 0 N-CA-C 106.694 -1.595 . . . . 0.0 106.694 178.659 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 70' ' ' VAL . . . . . . . . . . . . . 40.3 t . . . . . 0 CA--C 1.536 0.408 0 O-C-N 122.092 -0.38 . . . . 0.0 110.743 175.193 . . . . . . . . 0 0 . 1 . 024 nuclear orig core ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 92.8 Cg_exo . . . . . 0 N--CA 1.459 -0.505 0 N-CA-C 113.037 0.36 . . . . 0.0 113.037 . . . . . . . . . 0 0 . 1 . 024 nuclear orig core ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 3.0 mp0 -57.43 -50.71 72.12 Favored 'General case' 0 N--CA 1.455 -0.191 0 C-N-CA 123.957 0.903 . . . . 0.0 111.51 177.978 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 54.0 mm-40 -60.86 -44.46 97.0 Favored 'General case' 0 N--CA 1.451 -0.389 0 N-CA-C 108.667 -0.864 . . . . 0.0 108.667 177.693 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 21.0 mt -60.46 -35.75 76.62 Favored 'General case' 0 N--CA 1.447 -0.579 0 C-N-CA 123.492 0.717 . . . . 0.0 112.212 -179.023 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 23.9 tptm -61.09 -51.9 67.18 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 118.799 0.727 . . . . 0.0 110.731 169.369 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . -53.27 -52.16 42.39 Favored Glycine 0 CA--C 1.53 1.028 0 N-CA-C 110.412 -1.075 . . . . 0.0 110.412 -179.434 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 9' ' ' ILE . . . . . . . . . . . . . 77.5 mt -53.34 -54.61 17.05 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.345 0 C-N-CA 126.466 1.906 . . . . 0.0 110.1 173.289 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 10' ' ' PHE . . . . . . . . . . . . . 53.5 t80 -49.36 -53.34 22.89 Favored 'General case' 0 N--CA 1.45 -0.475 0 N-CA-C 108.84 -0.8 . . . . 0.0 108.84 -179.075 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 51.3 mt-10 -60.81 -52.93 63.0 Favored 'General case' 0 N--CA 1.455 -0.213 0 C-N-CA 122.623 0.369 . . . . 0.0 110.333 -178.273 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 17.2 ttpp -45.88 -54.84 7.51 Favored 'General case' 0 C--O 1.23 0.074 0 C-N-CA 125.142 1.377 . . . . 0.0 111.322 178.73 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 57.9 m-85 -77.18 -48.21 18.24 Favored 'General case' 0 N--CA 1.451 -0.415 0 N-CA-C 110.009 -0.367 . . . . 0.0 110.009 -175.191 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -47.91 -50.08 27.92 Favored 'General case' 0 N--CA 1.463 0.215 0 C-N-CA 124.641 1.176 . . . . 0.0 111.413 179.461 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.453 -0.279 0 C-N-CA 123.717 0.807 . . . . 0.0 112.526 177.279 . . . . . . . . 0 0 . 1 . 024 nuclear orig core ' A' A ' 20' ' ' PRO . . . . . . . . . . . . . 4.8 Cg_endo . . . . . 0 CA--C 1.536 0.597 0 N-CA-C 116.576 1.722 . . . . 0.0 116.576 . . . . . . . . . 0 0 . 1 . 024 nuclear orig core ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 53.1 m-80 -91.49 -5.66 53.85 Favored 'General case' 0 N--CA 1.449 -0.523 0 C-N-CA 123.695 0.798 . . . . 0.0 112.023 -171.969 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -152.43 127.52 9.75 Favored 'General case' 0 CA--C 1.538 0.493 0 CA-C-N 119.671 1.123 . . . . 0.0 112.852 -167.942 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 70.2 mt -94.54 124.82 38.8 Favored 'General case' 0 C--O 1.235 0.328 0 O-C-N 121.501 -0.749 . . . . 0.0 110.555 174.761 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 4.9 p -79.02 177.67 8.62 Favored 'General case' 0 C--O 1.238 0.463 0 N-CA-C 107.841 -1.17 . . . . 0.0 107.841 166.411 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 98.7 mttt -54.94 -39.77 69.22 Favored 'General case' 0 N--CA 1.451 -0.377 0 O-C-N 122.192 -0.318 . . . . 0.0 110.338 173.304 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 28.5 mt-10 -69.94 -45.61 67.1 Favored 'General case' 0 N--CA 1.454 -0.272 0 N-CA-C 109.65 -0.5 . . . . 0.0 109.65 -173.113 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 1.6 mp0 -55.17 -50.14 70.1 Favored 'General case' 0 N--CA 1.45 -0.464 0 N-CA-C 109.24 -0.652 . . . . 0.0 109.24 173.676 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 8.0 mt -56.33 -41.59 76.31 Favored 'General case' 0 CA--C 1.513 -0.473 0 N-CA-C 113.198 0.814 . . . . 0.0 113.198 174.365 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 64.7 tttm -62.6 -51.84 65.74 Favored 'General case' 0 C--N 1.321 -0.651 0 CA-C-N 118.485 0.584 . . . . 0.0 110.026 -177.383 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 4.0 mm? -60.41 -46.15 91.03 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.115 -0.493 . . . . 0.0 111.143 178.008 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 6.6 tt -51.23 -57.49 8.68 Favored 'General case' 0 C--N 1.333 -0.152 0 C-N-CA 124.217 1.007 . . . . 0.0 109.399 174.649 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 35.1 mt -55.07 -56.78 15.95 Favored 'General case' 0 C--N 1.331 -0.22 0 C-N-CA 123.23 0.612 . . . . 0.0 109.557 -178.065 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 23.5 mt-30 -52.25 -53.48 43.27 Favored 'General case' 0 N--CA 1.456 -0.135 0 C-N-CA 123.088 0.555 . . . . 0.0 111.671 -178.67 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 13.4 m -74.07 -47.73 34.64 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 116.266 -0.424 . . . . 0.0 110.822 -169.96 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 69.8 mm-40 -85.71 -34.59 21.21 Favored 'General case' 0 N--CA 1.449 -0.513 0 C-N-CA 123.207 0.603 . . . . 0.0 111.313 -170.986 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 82.5 m-85 . . . . . 0 CA--C 1.536 0.438 0 C-N-CA 123.67 0.788 . . . . 0.0 112.278 -171.562 . . . . . . . . 0 0 . 1 . 024 nuclear orig core ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 58.2 tp . . . . . 0 C--O 1.225 -0.204 0 N-CA-C 109.739 -0.467 . . . . 0.0 109.739 . . . . . . . . . 0 0 . 1 . 024 nuclear orig core ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 5.6 m-20 -56.77 -53.51 56.96 Favored 'General case' 0 N--CA 1.45 -0.472 0 C-N-CA 124.067 0.947 . . . . 0.0 110.868 177.285 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 76.5 tt0 -54.78 -50.55 68.2 Favored 'General case' 0 C--N 1.33 -0.254 0 C-N-CA 122.942 0.497 . . . . 0.0 110.528 177.929 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 59.5 tp -57.31 -48.36 79.13 Favored 'General case' 0 N--CA 1.455 -0.18 0 CA-C-O 121.27 0.557 . . . . 0.0 109.979 178.856 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 50' ' ' PHE . . . . . . . . . . . . . 80.3 t80 -56.18 -48.12 76.99 Favored 'General case' 0 N--CA 1.45 -0.469 0 C-N-CA 123.777 0.831 . . . . 0.0 110.43 179.492 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 33.6 mt-10 -59.6 -46.77 87.98 Favored 'General case' 0 N--CA 1.455 -0.207 0 C-N-CA 122.883 0.473 . . . . 0.0 110.612 177.641 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 44.5 tt0 -54.47 -49.22 70.62 Favored 'General case' 0 CA--C 1.53 0.182 0 C-N-CA 123.065 0.546 . . . . 0.0 110.589 177.416 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 72.8 mt -70.1 -44.49 68.89 Favored 'General case' 0 N--CA 1.45 -0.449 0 C-N-CA 123.229 0.612 . . . . 0.0 111.672 -177.102 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 52.1 t0 . . . . . 0 CA--C 1.535 0.371 0 C-N-CA 125.34 1.456 . . . . 0.0 109.655 177.108 . . . . . . . . 0 0 . 1 . 024 nuclear orig core ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 37.3 mt-10 . . . . . 0 N--CA 1.455 -0.223 0 N-CA-C 107.087 -1.449 . . . . 0.0 107.087 . . . . . . . . . 0 0 . 1 . 024 nuclear orig core ' A' A ' 61' ' ' VAL . . . . . . . . . . . . . 3.0 t -108.47 115.32 48.96 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.244 0 N-CA-C 109.865 -0.42 . . . . 0.0 109.865 -177.554 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 78.1 p -79.52 161.68 25.87 Favored 'General case' 0 CA--C 1.536 0.405 0 C-N-CA 123.842 0.857 . . . . 0.0 110.086 171.272 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 63' ' ' PHE . . . . . . . . . . . . . 60.4 t80 -59.15 -38.56 79.98 Favored 'General case' 0 N--CA 1.462 0.172 0 O-C-N 121.613 -0.679 . . . . 0.0 111.732 -176.064 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 22.0 mp0 -63.38 -57.29 10.81 Favored 'General case' 0 N--CA 1.447 -0.613 0 N-CA-C 109.163 -0.68 . . . . 0.0 109.163 -175.071 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 15.5 pt-20 -66.4 -32.81 74.43 Favored 'General case' 0 CA--C 1.537 0.464 0 O-C-N 121.545 -0.722 . . . . 0.0 111.459 179.007 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 18.6 t80 -53.22 -24.85 12.12 Favored 'General case' 0 CA--C 1.538 0.502 0 O-C-N 121.467 -0.771 . . . . 0.0 111.73 169.553 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 67' ' ' GLN . . . . . . . . . . . . . 33.8 mm-40 -54.05 -22.96 11.99 Favored 'General case' 0 CA--C 1.535 0.389 0 CA-C-N 119.569 1.077 . . . . 0.0 113.291 172.218 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 69.7 t -53.25 -37.92 29.71 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.487 0 CA-C-N 119.484 1.038 . . . . 0.0 110.38 170.073 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 19.9 tp -74.6 -48.55 25.9 Favored 'General case' 0 N--CA 1.456 -0.165 0 N-CA-C 108.3 -1.0 . . . . 0.0 108.3 177.53 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 70' ' ' VAL . . . . . . . . . . . . . 56.5 t . . . . . 0 C--O 1.225 -0.233 0 C-N-CA 122.574 0.35 . . . . 0.0 110.641 -179.718 . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' A' A ' 1' ' ' LYS . . . . . . . . . . . . . 7.9 mptt . . . . . 0 N--CA 1.449 -0.48 0 N-CA-C 107.377 -1.342 . . . . 0.0 107.377 . . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 87.3 p -63.7 154.91 78.81 Favored Pre-proline 0 CA--C 1.534 0.336 0 CA-C-O 118.981 -0.533 . . . . 0.0 109.974 179.628 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 95.4 Cg_exo -44.16 -40.41 12.43 Favored 'Trans proline' 0 N--CA 1.458 -0.614 0 C-N-CA 123.082 2.521 . . . . 0.0 112.657 170.068 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 2.9 mp0 -60.38 -48.74 80.47 Favored 'General case' 0 N--CA 1.455 -0.216 0 C-N-CA 124.005 0.922 . . . . 0.0 112.04 176.114 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 32.8 mt-10 -62.18 -44.41 96.66 Favored 'General case' 0 N--CA 1.453 -0.282 0 N-CA-C 109.19 -0.67 . . . . 0.0 109.19 177.802 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 40.9 mt -60.48 -38.01 82.88 Favored 'General case' 0 N--CA 1.449 -0.504 0 C-N-CA 123.455 0.702 . . . . 0.0 111.869 177.648 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 20.8 tptm -60.62 -49.72 76.39 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 118.442 0.564 . . . . 0.0 110.221 170.635 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . -50.84 -50.1 39.1 Favored Glycine 0 CA--C 1.531 1.061 0 N-CA-C 110.63 -0.988 . . . . 0.0 110.63 177.176 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 9' ' ' ILE . . . . . . . . . . . . . 19.5 mm -58.98 -54.76 29.63 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.235 0 C-N-CA 125.826 1.65 . . . . 0.0 109.958 176.904 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 10' ' ' PHE . . . . . . . . . . . . . 32.3 t80 -47.66 -52.78 16.97 Favored 'General case' 0 N--CA 1.451 -0.419 0 O-C-N 121.605 -0.685 . . . . 0.0 109.703 177.762 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 52.9 mt-10 -60.02 -51.19 70.71 Favored 'General case' 0 N--CA 1.453 -0.318 0 C-N-CA 123.668 0.787 . . . . 0.0 110.359 -179.578 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 58.4 tttt -44.27 -59.91 2.16 Favored 'General case' 0 C--N 1.339 0.115 0 C-N-CA 124.126 0.97 . . . . 0.0 110.214 175.913 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 63.0 m-85 -75.42 -38.73 59.63 Favored 'General case' 0 N--CA 1.452 -0.345 0 C-N-CA 120.449 -0.5 . . . . 0.0 110.88 -169.124 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -57.24 -58.85 6.44 Favored 'General case' 0 C--O 1.237 0.411 0 CA-C-O 122.013 0.911 . . . . 0.0 110.015 174.939 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -54.99 -35.92 64.85 Favored 'General case' 0 N--CA 1.454 -0.267 0 C-N-CA 124.282 1.033 . . . . 0.0 111.441 178.972 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 20.0 ttmm -55.09 -36.83 66.07 Favored 'General case' 0 CA--C 1.533 0.327 0 CA-C-N 118.139 0.427 . . . . 0.0 111.48 178.348 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 34.7 tt0 -76.09 -54.48 6.77 Favored 'General case' 0 C--N 1.34 0.188 0 N-CA-C 108.737 -0.838 . . . . 0.0 108.737 169.731 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 157.07 -54.25 0.4 Allowed Glycine 0 CA--C 1.521 0.418 0 N-CA-C 110.358 -1.097 . . . . 0.0 110.358 178.565 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 13.9 t0 -58.65 119.77 39.63 Favored Pre-proline 0 CA--C 1.532 0.269 0 N-CA-C 108.221 -1.029 . . . . 0.0 108.221 177.802 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 20' ' ' PRO . . . . . . . . . . . . . 72.2 Cg_endo -80.6 -28.93 2.52 Favored 'Trans proline' 0 N--CA 1.455 -0.793 0 C-N-CA 121.951 1.767 . . . . 0.0 112.781 -175.835 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 92.9 m-20 -97.69 -15.15 20.51 Favored 'General case' 0 N--CA 1.454 -0.242 0 C-N-CA 124.464 1.106 . . . . 0.0 113.325 -166.772 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 7.1 tp60 -138.67 127.23 23.27 Favored 'General case' 0 CA--C 1.537 0.443 0 C-N-CA 123.725 0.81 . . . . 0.0 109.992 -168.307 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 74.8 mt -95.07 129.32 42.21 Favored 'General case' 0 CA--C 1.531 0.241 0 C-N-CA 124.301 1.041 . . . . 0.0 110.782 178.666 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 1.5 p -79.16 176.02 10.06 Favored 'General case' 0 C--O 1.238 0.472 0 N-CA-C 108.301 -1.0 . . . . 0.0 108.301 167.103 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 58.1 mttp -54.24 -38.77 66.14 Favored 'General case' 0 N--CA 1.451 -0.39 0 CA-C-O 119.352 -0.356 . . . . 0.0 110.902 175.162 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 31.3 mm-40 -71.42 -47.4 56.21 Favored 'General case' 0 CA--C 1.518 -0.26 0 CA-C-N 118.436 0.562 . . . . 0.0 110.557 -171.243 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 2.2 mp0 -53.97 -48.96 69.81 Favored 'General case' 0 N--CA 1.451 -0.418 0 CA-C-N 115.87 -0.605 . . . . 0.0 109.549 172.368 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 13.1 mt -56.97 -43.52 81.71 Favored 'General case' 0 C--O 1.218 -0.554 0 C-N-CA 120.023 -0.671 . . . . 0.0 112.304 174.59 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 37.6 ttpt -61.67 -47.86 83.44 Favored 'General case' 0 C--N 1.32 -0.702 0 CA-C-N 118.5 0.591 . . . . 0.0 110.121 -176.641 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 11.8 tp -65.56 -43.8 88.76 Favored 'General case' 0 CA--C 1.533 0.326 0 CA-C-O 120.609 0.242 . . . . 0.0 110.877 179.823 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 7.1 tt -50.73 -58.71 5.25 Favored 'General case' 0 CA--C 1.522 -0.119 0 C-N-CA 124.146 0.979 . . . . 0.0 109.549 173.521 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 31.0 mt -58.93 -52.73 64.52 Favored 'General case' 0 C--O 1.219 -0.501 0 N-CA-C 108.782 -0.821 . . . . 0.0 108.782 -177.882 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 22.9 tt0 -49.5 -45.62 47.28 Favored 'General case' 0 C--N 1.332 -0.194 0 O-C-N 121.37 -0.831 . . . . 0.0 111.775 179.25 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 7.9 m -74.09 -54.74 7.18 Favored 'General case' 0 CA--C 1.533 0.325 0 CA-C-O 120.61 0.243 . . . . 0.0 111.612 -177.81 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 29.5 mm-40 -91.98 -33.4 14.86 Favored 'General case' 0 N--CA 1.452 -0.339 0 C-N-CA 124.008 0.923 . . . . 0.0 113.138 -166.36 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 79.6 m-85 -147.37 64.89 9.05 Favored Pre-proline 0 CA--C 1.536 0.439 0 C-N-CA 124.98 1.312 . . . . 0.0 111.525 -171.912 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 27.5 Cg_endo -60.79 -27.29 84.58 Favored 'Trans proline' 0 N--CA 1.458 -0.594 0 C-N-CA 122.524 2.15 . . . . 0.0 112.785 -170.575 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 2.5 p -56.67 -53.16 60.88 Favored 'General case' 0 N--CA 1.449 -0.485 0 C-N-CA 124.66 1.184 . . . . 0.0 110.378 175.91 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 72.0 mt -59.16 -17.5 27.7 Favored 'General case' 0 CA--C 1.532 0.271 0 C-N-CA 125.604 1.562 . . . . 0.0 113.635 -170.815 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 93.8 mt -49.41 -36.49 22.27 Favored 'General case' 0 CA--C 1.537 0.458 0 CA-C-N 118.413 0.551 . . . . 0.0 110.932 168.305 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 56.2 mtmt -109.61 -47.32 3.38 Favored 'General case' 0 N--CA 1.45 -0.467 0 C-N-CA 126.511 1.924 . . . . 0.0 110.681 177.138 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . -57.99 137.97 49.18 Favored Glycine 0 CA--C 1.525 0.691 0 C-N-CA 125.178 1.37 . . . . 0.0 111.97 -170.655 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 43' ' ' GLY . . . . . . . . . . . . . . . 78.59 -55.1 4.12 Favored Glycine 0 CA--C 1.527 0.789 0 N-CA-C 110.347 -1.101 . . . . 0.0 110.347 -178.936 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 44' ' ' SER . . . . . . . . . . . . . 4.5 m -160.35 145.03 14.5 Favored 'General case' 0 N--CA 1.442 -0.826 0 C-N-CA 124.97 1.308 . . . . 0.0 107.59 174.055 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 6.5 p -59.69 143.0 51.9 Favored 'General case' 0 N--CA 1.451 -0.415 0 N-CA-C 108.93 -0.767 . . . . 0.0 108.93 171.446 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 48.3 tp -39.34 -49.2 1.97 Allowed 'General case' 0 CA--C 1.519 -0.242 0 C-N-CA 127.02 2.128 . . . . 0.0 112.842 -169.169 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 7.4 m-20 -64.07 -43.38 95.64 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-N 115.843 -0.617 . . . . 0.0 111.1 -174.898 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 29.7 mm-40 -71.14 -42.24 69.42 Favored 'General case' 0 N--CA 1.45 -0.45 0 N-CA-C 109.263 -0.643 . . . . 0.0 109.263 177.219 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 56.5 tp -53.96 -47.64 71.13 Favored 'General case' 0 N--CA 1.452 -0.367 0 N-CA-C 109.539 -0.541 . . . . 0.0 109.539 177.448 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 50' ' ' PHE . . . . . . . . . . . . . 82.9 t80 -51.69 -53.73 35.93 Favored 'General case' 0 N--CA 1.454 -0.266 0 C-N-CA 123.657 0.783 . . . . 0.0 110.614 177.987 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 72.2 mm-40 -56.06 -49.12 74.64 Favored 'General case' 0 CA--C 1.532 0.283 0 CA-C-O 120.605 0.24 . . . . 0.0 110.968 177.429 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 50.2 mm-40 -57.73 -40.99 80.92 Favored 'General case' 0 CA--C 1.531 0.219 0 C-N-CA 122.779 0.432 . . . . 0.0 112.138 179.801 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 62.2 mt -71.44 -41.15 69.83 Favored 'General case' 0 N--CA 1.45 -0.464 0 C-N-CA 122.857 0.463 . . . . 0.0 111.011 179.16 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 19.6 t70 -70.14 57.2 0.16 Allowed 'General case' 0 CA--C 1.541 0.621 0 C-N-CA 125.966 1.707 . . . . 0.0 112.136 -178.386 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 30.7 mmmt -56.29 -36.33 68.52 Favored 'General case' 0 CA--C 1.53 0.201 0 O-C-N 120.758 -1.214 . . . . 0.0 112.295 -179.322 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 56' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -69.79 -15.4 63.11 Favored 'General case' 0 CA--C 1.537 0.444 0 N-CA-C 112.485 0.55 . . . . 0.0 112.485 179.167 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . 75.04 14.96 81.35 Favored Glycine 0 CA--C 1.53 0.971 0 CA-C-O 118.562 -1.132 . . . . 0.0 114.908 169.635 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -77.02 -34.22 57.39 Favored 'General case' 0 C--N 1.34 0.175 0 CA-C-N 119.901 1.85 . . . . 0.0 110.078 174.607 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . 133.92 -67.78 0.55 Allowed Glycine 0 N--CA 1.448 -0.552 0 N-CA-C 107.559 -2.216 . . . . 0.0 107.559 -176.555 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 56.5 mt-10 -78.21 155.13 30.51 Favored 'General case' 0 N--CA 1.452 -0.345 0 N-CA-C 109.42 -0.585 . . . . 0.0 109.42 -174.865 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 61' ' ' VAL . . . . . . . . . . . . . 3.7 t -103.91 120.94 54.81 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.422 0 C-N-CA 123.332 0.653 . . . . 0.0 111.354 -167.183 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 95.1 p -77.45 163.7 26.11 Favored 'General case' 0 N--CA 1.463 0.195 0 C-N-CA 123.196 0.598 . . . . 0.0 110.492 174.931 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 63' ' ' PHE . . . . . . . . . . . . . 68.9 t80 -59.38 -32.99 70.65 Favored 'General case' 0 CA--C 1.528 0.133 0 O-C-N 122.032 -0.418 . . . . 0.0 111.879 176.091 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 39.2 mm-40 -66.97 -59.1 3.78 Favored 'General case' 0 N--CA 1.446 -0.639 0 N-CA-C 109.363 -0.606 . . . . 0.0 109.363 -179.437 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 8.3 pt-20 -66.91 -29.58 69.49 Favored 'General case' 0 CA--C 1.54 0.578 0 O-C-N 121.5 -0.75 . . . . 0.0 111.313 -177.656 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 13.3 t80 -50.63 -28.53 9.01 Favored 'General case' 0 CA--C 1.536 0.417 0 C-N-CA 123.825 0.85 . . . . 0.0 111.891 168.779 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 67' ' ' GLN . . . . . . . . . . . . . 80.5 mm-40 -55.32 -23.32 23.08 Favored 'General case' 0 CA--C 1.535 0.401 0 CA-C-N 119.696 1.135 . . . . 0.0 112.962 174.668 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 88.4 t -55.25 -32.38 28.42 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.526 0 CA-C-N 119.472 1.033 . . . . 0.0 110.765 171.701 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 37.2 tp -71.33 -47.72 54.81 Favored 'General case' 0 N--CA 1.454 -0.257 0 N-CA-C 107.159 -1.423 . . . . 0.0 107.159 179.47 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 70' ' ' VAL . . . . . . . . . . . . . 18.5 t -59.62 -39.57 79.87 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.348 0 C-N-CA 122.88 0.472 . . . . 0.0 110.142 -179.983 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 53.5 tptt -55.21 -56.59 18.22 Favored 'General case' 0 N--CA 1.453 -0.289 0 C-N-CA 123.277 0.631 . . . . 0.0 109.978 171.189 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 2.1 mptm? -50.43 -45.47 55.83 Favored 'General case' 0 CA--C 1.537 0.46 0 N-CA-C 112.415 0.524 . . . . 0.0 112.415 175.264 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 73' ' ' ILE . . . . . . . . . . . . . 78.8 mt -56.79 -50.57 74.4 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.248 0 N-CA-C 109.446 -0.576 . . . . 0.0 109.446 175.47 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 74' ' ' SER . . . . . 0.528 ' O ' ' OXT' ' A' ' 75' ' ' GLN . 17.9 m -56.06 -42.15 76.21 Favored 'General case' 0 CA--C 1.529 0.161 0 C-N-CA 123.398 0.679 . . . . 0.0 110.854 179.783 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 75' ' ' GLN . . . . . 0.528 ' OXT' ' O ' ' A' ' 74' ' ' SER . 40.1 mt-30 . . . . . 0 C--O 1.27 2.169 0 N-CA-C 108.629 -0.878 . . . . 0.0 108.629 169.448 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 1' ' ' LYS . . . . . . . . . . . . . 32.9 mttp . . . . . 0 N--CA 1.451 -0.393 0 N-CA-C 108.72 -0.844 . . . . 0.0 108.72 . . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 88.2 p -69.31 159.44 83.32 Favored Pre-proline 0 CA--C 1.534 0.361 0 CA-C-O 119.247 -0.406 . . . . 0.0 110.564 179.872 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 86.9 Cg_exo -47.26 -40.11 27.57 Favored 'Trans proline' 0 N--CA 1.457 -0.664 0 C-N-CA 123.091 2.527 . . . . 0.0 112.338 168.86 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 40.3 tt0 -61.11 -49.37 77.56 Favored 'General case' 0 CA--C 1.529 0.17 0 C-N-CA 123.389 0.676 . . . . 0.0 111.103 177.534 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 29.7 mt-10 -60.75 -45.63 93.54 Favored 'General case' 0 N--CA 1.454 -0.272 0 N-CA-C 109.009 -0.738 . . . . 0.0 109.009 177.943 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 19.9 mt -58.41 -40.19 81.8 Favored 'General case' 0 N--CA 1.447 -0.611 0 C-N-CA 123.755 0.822 . . . . 0.0 111.192 179.142 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 21.4 tptm -60.12 -53.05 62.36 Favored 'General case' 0 C--N 1.333 -0.131 0 CA-C-N 118.798 0.726 . . . . 0.0 110.898 171.054 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . -50.5 -52.2 29.55 Favored Glycine 0 CA--C 1.533 1.192 0 N-CA-C 111.269 -0.732 . . . . 0.0 111.269 179.15 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 9' ' ' ILE . . . . . . . . . . . . . 2.4 mm -56.04 -55.04 20.43 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.305 0 C-N-CA 126.475 1.91 . . . . 0.0 108.944 175.818 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 10' ' ' PHE . . . . . . . . . . . . . 38.6 t80 -49.1 -49.89 39.63 Favored 'General case' 0 N--CA 1.448 -0.534 0 O-C-N 121.725 -0.609 . . . . 0.0 109.846 179.797 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 51.0 mt-10 -62.05 -50.99 69.77 Favored 'General case' 0 N--CA 1.455 -0.197 0 C-N-CA 123.081 0.553 . . . . 0.0 110.567 179.417 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 68.9 tttt -44.52 -51.62 8.7 Favored 'General case' 0 CA--C 1.53 0.21 0 C-N-CA 124.341 1.057 . . . . 0.0 110.9 177.167 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 63.1 m-85 -78.4 -46.31 20.21 Favored 'General case' 0 CA--C 1.53 0.206 0 O-C-N 122.341 -0.224 . . . . 0.0 111.296 -176.403 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -57.23 -42.35 81.26 Favored 'General case' 0 C--N 1.329 -0.318 0 O-C-N 121.384 -0.823 . . . . 0.0 111.659 -178.427 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -51.62 -29.77 18.8 Favored 'General case' 0 CA--C 1.533 0.308 0 C-N-CA 123.603 0.761 . . . . 0.0 111.921 173.772 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 29.5 ttmt -67.48 -33.76 75.78 Favored 'General case' 0 CA--C 1.534 0.334 0 C-N-CA 122.843 0.457 . . . . 0.0 110.761 179.64 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 46.6 mm-40 -69.46 -48.91 59.3 Favored 'General case' 0 C--N 1.343 0.303 0 N-CA-C 107.728 -1.212 . . . . 0.0 107.728 168.224 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 147.58 -59.0 0.47 Allowed Glycine 0 N--CA 1.451 -0.33 0 N-CA-C 108.837 -1.705 . . . . 0.0 108.837 176.671 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 33.9 t0 -68.6 111.33 7.84 Favored Pre-proline 0 CA--C 1.534 0.338 0 CA-C-O 118.334 -0.841 . . . . 0.0 109.295 178.249 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 20' ' ' PRO . . . . . . . . . . . . . 36.4 Cg_endo -60.76 -20.82 67.6 Favored 'Trans proline' 0 N--CA 1.457 -0.62 0 C-N-CA 121.978 1.785 . . . . 0.0 112.63 -179.752 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 48.5 m-80 -85.06 -1.16 56.52 Favored 'General case' 0 N--CA 1.453 -0.288 0 C-N-CA 124.481 1.112 . . . . 0.0 113.137 -173.17 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 23.6 tt0 -151.27 124.99 9.05 Favored 'General case' 0 CA--C 1.542 0.637 0 CA-C-N 119.749 1.159 . . . . 0.0 113.887 -169.271 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 82.7 mt -98.82 138.11 36.44 Favored 'General case' 0 C--N 1.345 0.386 0 C-N-CA 125.296 1.438 . . . . 0.0 111.632 178.376 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 88.9 p -80.69 174.17 11.88 Favored 'General case' 0 CA--C 1.532 0.283 0 C-N-CA 123.466 0.706 . . . . 0.0 109.734 168.3 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 7.6 mtpm? -56.92 -44.28 82.26 Favored 'General case' 0 C--O 1.226 -0.173 0 N-CA-C 109.721 -0.474 . . . . 0.0 109.721 171.352 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 1.8 mp0 -63.09 -51.95 64.61 Favored 'General case' 0 N--CA 1.451 -0.424 0 C-N-CA 123.285 0.634 . . . . 0.0 110.259 -176.861 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -57.67 -41.77 82.23 Favored 'General case' 0 N--CA 1.451 -0.401 0 CA-C-O 118.564 -0.731 . . . . 0.0 110.422 176.687 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 14.3 mt -57.79 -43.66 85.74 Favored 'General case' 0 CA--C 1.513 -0.446 0 CA-C-N 119.614 1.097 . . . . 0.0 113.126 169.744 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 21.0 ttmm -61.11 -49.36 77.61 Favored 'General case' 0 N--CA 1.449 -0.497 0 CA-C-N 118.773 0.715 . . . . 0.0 109.857 -178.163 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 95.9 mt -62.02 -45.49 93.35 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.39 -0.368 . . . . 0.0 111.169 179.156 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 7.6 tt -50.84 -57.85 7.42 Favored 'General case' 0 C--O 1.232 0.132 0 C-N-CA 124.098 0.959 . . . . 0.0 109.405 173.668 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 40.7 mt -55.56 -58.01 9.53 Favored 'General case' 0 N--CA 1.455 -0.179 0 N-CA-C 109.637 -0.505 . . . . 0.0 109.637 -178.794 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 22.8 tt0 -53.07 -50.45 64.35 Favored 'General case' 0 N--CA 1.452 -0.349 0 C-N-CA 124.202 1.001 . . . . 0.0 111.674 -176.012 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 15.0 m -74.48 -49.97 20.11 Favored 'General case' 0 N--CA 1.453 -0.303 0 CA-C-N 116.34 -0.391 . . . . 0.0 110.898 -173.017 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 73.2 mm-40 -94.58 -32.5 13.41 Favored 'General case' 0 N--CA 1.448 -0.554 0 N-CA-C 112.685 0.624 . . . . 0.0 112.685 -167.06 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 81.6 m-85 -138.81 68.84 43.71 Favored Pre-proline 0 CA--C 1.538 0.494 0 C-N-CA 123.49 0.716 . . . . 0.0 112.443 -173.919 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 88.7 Cg_exo -47.51 -29.42 10.26 Favored 'Trans proline' 0 N--CA 1.459 -0.525 0 C-N-CA 123.479 2.786 . . . . 0.0 113.388 169.638 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 4.6 p -61.88 -66.84 0.48 Allowed 'General case' 0 N--CA 1.447 -0.614 0 C-N-CA 124.321 1.049 . . . . 0.0 108.695 175.034 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 95.8 mt -53.22 -35.51 60.0 Favored 'General case' 0 N--CA 1.456 -0.166 0 C-N-CA 124.48 1.112 . . . . 0.0 112.036 -178.628 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 19.5 tp -49.21 -42.04 39.0 Favored 'General case' 0 CA--C 1.534 0.359 0 C-N-CA 122.515 0.326 . . . . 0.0 111.301 174.488 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 5.7 mptp? -88.35 -36.5 16.57 Favored 'General case' 0 CA--C 1.533 0.3 0 C-N-CA 123.868 0.867 . . . . 0.0 110.882 176.841 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . -75.05 54.55 2.66 Favored Glycine 0 CA--C 1.531 1.078 0 C-N-CA 124.873 1.225 . . . . 0.0 113.631 -172.668 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 43' ' ' GLY . . . . . . . . . . . . . . . -176.48 142.41 5.93 Favored Glycine 0 CA--C 1.524 0.629 0 N-CA-C 108.266 -1.934 . . . . 0.0 108.266 174.874 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 44' ' ' SER . . . . . . . . . . . . . 3.4 m -48.47 -53.33 18.36 Favored 'General case' 0 CA--C 1.534 0.349 0 C-N-CA 124.865 1.266 . . . . 0.0 113.054 -169.943 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 45.7 p -150.93 161.27 43.04 Favored 'General case' 0 C--O 1.234 0.269 0 N-CA-C 107.003 -1.48 . . . . 0.0 107.003 169.401 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 57.3 tp -53.19 -43.4 67.14 Favored 'General case' 0 C--O 1.223 -0.305 0 N-CA-C 109.936 -0.394 . . . . 0.0 109.936 169.474 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 5.6 m-20 -58.96 -52.62 64.98 Favored 'General case' 0 N--CA 1.449 -0.524 0 C-N-CA 123.734 0.814 . . . . 0.0 111.027 179.781 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 33.8 mt-10 -59.37 -45.59 91.0 Favored 'General case' 0 N--CA 1.455 -0.18 0 CA-C-N 116.618 -0.265 . . . . 0.0 111.125 177.88 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 59.7 mt -54.9 -54.72 38.98 Favored 'General case' 0 C--O 1.224 -0.238 0 N-CA-C 109.636 -0.505 . . . . 0.0 109.636 174.802 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 50' ' ' PHE . . . . . . . . . . . . . 80.4 t80 -52.43 -49.92 63.6 Favored 'General case' 0 N--CA 1.449 -0.475 0 C-N-CA 123.965 0.906 . . . . 0.0 110.36 -177.527 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 27.7 tp10 -58.72 -48.34 81.5 Favored 'General case' 0 N--CA 1.454 -0.268 0 CA-C-O 120.755 0.312 . . . . 0.0 110.83 177.143 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 42.8 tt0 -56.68 -39.71 74.28 Favored 'General case' 0 CA--C 1.53 0.174 0 C-N-CA 123.631 0.772 . . . . 0.0 111.156 179.598 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 38.1 mt -78.71 -43.99 24.56 Favored 'General case' 0 N--CA 1.448 -0.56 0 C-N-CA 122.952 0.501 . . . . 0.0 112.114 -178.636 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 53.1 t0 -73.57 57.54 0.56 Allowed 'General case' 0 CA--C 1.538 0.493 0 C-N-CA 125.101 1.361 . . . . 0.0 111.361 -177.356 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 16.0 mmtp -61.4 -33.46 73.72 Favored 'General case' 0 C--N 1.333 -0.14 0 C-N-CA 124.083 0.953 . . . . 0.0 112.143 -177.161 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 56' ' ' ASN . . . . . . . . . . . . . 31.5 p30 -75.39 -9.53 58.65 Favored 'General case' 0 CA--C 1.536 0.434 0 N-CA-C 112.203 0.445 . . . . 0.0 112.203 176.775 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . 62.05 32.32 81.87 Favored Glycine 0 CA--C 1.53 0.999 0 CA-C-O 119.235 -0.759 . . . . 0.0 113.374 179.261 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 1.5 p30 -78.35 -6.99 56.76 Favored 'General case' 0 CA--C 1.535 0.381 0 CA-C-N 119.045 1.422 . . . . 0.0 112.634 -179.174 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . 88.02 11.51 67.4 Favored Glycine 0 CA--C 1.53 0.969 0 CA-C-N 118.399 0.545 . . . . 0.0 112.557 177.492 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 31.5 mt-10 -155.41 178.13 10.58 Favored 'General case' 0 N--CA 1.452 -0.331 0 C-N-CA 129.238 3.015 . . . . 0.0 104.944 173.726 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 61' ' ' VAL . . . . . . . . . . . . . 5.1 t -117.02 115.2 48.14 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.193 0 N-CA-C 109.685 -0.487 . . . . 0.0 109.685 -178.599 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 12.6 t -84.89 164.31 18.46 Favored 'General case' 0 CA--C 1.537 0.465 0 C-N-CA 122.65 0.38 . . . . 0.0 111.572 173.537 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 63' ' ' PHE . . . . . . . . . . . . . 64.4 t80 -62.01 -39.63 92.89 Favored 'General case' 0 N--CA 1.464 0.238 0 N-CA-C 112.65 0.611 . . . . 0.0 112.65 -170.044 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 50.9 mt-10 -62.33 -57.09 12.61 Favored 'General case' 0 N--CA 1.453 -0.292 0 N-CA-C 109.639 -0.504 . . . . 0.0 109.639 -178.471 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 20.3 pt-20 -64.28 -34.33 77.88 Favored 'General case' 0 CA--C 1.539 0.547 0 O-C-N 121.639 -0.663 . . . . 0.0 111.425 -179.692 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 17.8 t80 -52.03 -25.4 8.43 Favored 'General case' 0 CA--C 1.538 0.493 0 C-N-CA 123.828 0.851 . . . . 0.0 112.237 169.357 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 67' ' ' GLN . . . . . . . . . . . . . 45.6 mm-40 -54.64 -23.78 18.7 Favored 'General case' 0 CA--C 1.537 0.459 0 CA-C-N 119.745 1.157 . . . . 0.0 113.197 172.473 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 83.0 t -53.96 -33.16 23.55 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.485 0 CA-C-N 119.162 0.892 . . . . 0.0 110.817 170.469 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 19.3 tp -75.47 -53.11 9.2 Favored 'General case' 0 N--CA 1.452 -0.345 0 N-CA-C 108.134 -1.061 . . . . 0.0 108.134 173.163 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 70' ' ' VAL . . . . . . . . . . . . . 58.1 t -50.04 -44.75 22.34 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.352 0 CA-C-N 118.324 0.511 . . . . 0.0 111.74 -175.295 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 5.6 ptpp? -63.36 -37.37 87.01 Favored 'General case' 0 CA--C 1.529 0.169 0 O-C-N 121.573 -0.704 . . . . 0.0 112.127 179.274 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 72' ' ' LYS . . . . . . . . . . . . 0.273 0.1 OUTLIER -68.01 -44.39 76.66 Favored 'General case' 0 N--CA 1.443 -0.817 0 C-N-CA 125.558 1.543 . . . . 0.0 108.616 177.61 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 73' ' ' ILE . . . . . . . . . . . . . 65.3 mt -54.23 -45.7 67.51 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.335 0 O-C-N 121.327 -0.858 . . . . 0.0 109.007 171.503 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 11.1 m -73.03 3.1 5.8 Favored 'General case' 0 CA--C 1.538 0.498 0 N-CA-C 113.167 0.803 . . . . 0.0 113.167 177.983 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 75' ' ' GLN . . . . . . . . . . . . . 7.4 mm100 . . . . . 0 C--O 1.27 2.144 0 C-N-CA 126.848 2.059 . . . . 0.0 113.135 -177.845 . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' A' A ' 1' ' ' LYS . . . . . . . . . . . . . 73.9 mmtt . . . . . 0 N--CA 1.451 -0.394 0 N-CA-C 108.41 -0.959 . . . . 0.0 108.41 . . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 86.6 p -79.22 158.99 73.7 Favored Pre-proline 0 CA--C 1.535 0.366 0 N-CA-C 109.178 -0.675 . . . . 0.0 109.178 171.87 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 85.8 Cg_exo -46.46 -39.78 22.52 Favored 'Trans proline' 0 N--CA 1.455 -0.78 0 C-N-CA 122.921 2.414 . . . . 0.0 112.015 168.786 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 2.8 mp0 -61.3 -47.07 87.64 Favored 'General case' 0 N--CA 1.455 -0.175 0 C-N-CA 123.841 0.857 . . . . 0.0 111.942 176.607 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -62.88 -44.23 96.67 Favored 'General case' 0 C--N 1.331 -0.215 0 N-CA-C 108.974 -0.75 . . . . 0.0 108.974 178.108 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 12.8 mt -59.43 -40.58 87.2 Favored 'General case' 0 N--CA 1.449 -0.501 0 C-N-CA 122.646 0.379 . . . . 0.0 111.844 177.047 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 51.7 tptt -58.62 -47.11 85.46 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 118.414 0.552 . . . . 0.0 110.307 170.167 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . -52.89 -54.65 27.47 Favored Glycine 0 CA--C 1.53 0.989 0 N-CA-C 110.744 -0.943 . . . . 0.0 110.744 179.648 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 9' ' ' ILE . . . . . . . . . . . . . 65.9 mt -51.12 -58.14 2.25 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.13 0 C-N-CA 125.407 1.483 . . . . 0.0 109.523 171.639 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 10' ' ' PHE . . . . . . . . . . . . . 23.7 t80 -49.91 -48.11 51.84 Favored 'General case' 0 N--CA 1.442 -0.826 0 O-C-N 122.006 -0.434 . . . . 0.0 110.07 -175.883 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 55.3 mt-10 -64.88 -50.24 67.34 Favored 'General case' 0 N--CA 1.452 -0.33 0 C-N-CA 123.483 0.713 . . . . 0.0 110.636 179.118 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 21.8 ttpt -43.55 -50.37 7.22 Favored 'General case' 0 N--CA 1.461 0.114 0 C-N-CA 124.161 0.984 . . . . 0.0 110.384 175.422 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 59.6 m-85 -78.73 -44.97 22.24 Favored 'General case' 0 N--CA 1.449 -0.475 0 CA-C-N 116.47 -0.332 . . . . 0.0 111.862 -175.137 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -67.52 -35.04 78.34 Favored 'General case' 0 N--CA 1.466 0.342 0 C-N-CA 125.139 1.376 . . . . 0.0 113.24 -176.545 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -58.04 -29.36 65.29 Favored 'General case' 0 N--CA 1.452 -0.373 0 C-N-CA 123.039 0.536 . . . . 0.0 111.455 -178.956 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 9.0 mtmp? -58.69 -50.78 72.62 Favored 'General case' 0 CA--C 1.531 0.245 0 CA-C-N 117.945 0.338 . . . . 0.0 111.298 -176.097 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 31.3 tt0 -75.83 -40.46 54.81 Favored 'General case' 0 N--CA 1.457 -0.082 0 N-CA-C 110.0 -0.37 . . . . 0.0 110.0 177.667 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 163.08 -79.75 0.14 Allowed Glycine 0 C--N 1.335 0.496 0 C-N-CA 120.839 -0.696 . . . . 0.0 112.263 170.043 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 42.4 t0 -63.33 110.31 3.46 Favored Pre-proline 0 CA--C 1.533 0.315 0 CA-C-O 118.35 -0.834 . . . . 0.0 110.265 -169.947 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 20' ' ' PRO . . . . . . . . . . . . . 26.4 Cg_endo -58.1 -21.34 50.48 Favored 'Trans proline' 0 N--CA 1.456 -0.723 0 C-N-CA 122.001 1.801 . . . . 0.0 112.66 -178.72 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 38.8 m-80 -87.56 -7.18 57.87 Favored 'General case' 0 N--CA 1.453 -0.316 0 C-N-CA 124.831 1.253 . . . . 0.0 112.962 -175.521 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 9.9 tt0 -144.89 125.1 13.71 Favored 'General case' 0 CA--C 1.539 0.523 0 CA-C-N 119.294 0.952 . . . . 0.0 113.256 -171.942 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 52.1 mt -96.07 142.98 27.62 Favored 'General case' 0 C--N 1.343 0.284 0 C-N-CA 124.8 1.24 . . . . 0.0 111.423 179.349 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 93.2 p -92.35 174.61 7.2 Favored 'General case' 0 CA--C 1.538 0.512 0 C-N-CA 124.091 0.956 . . . . 0.0 108.974 167.029 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 97.6 mttt -54.6 -49.4 70.51 Favored 'General case' 0 C--N 1.339 0.135 0 O-C-N 121.895 -0.503 . . . . 0.0 111.49 -179.173 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 24.2 mt-10 -63.73 -43.51 96.31 Favored 'General case' 0 CA--C 1.519 -0.215 0 CA-C-O 121.234 0.54 . . . . 0.0 110.414 -175.105 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 57.6 mt-10 -58.22 -47.55 83.14 Favored 'General case' 0 N--CA 1.45 -0.426 0 CA-C-N 115.929 -0.578 . . . . 0.0 109.709 176.149 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 11.4 mt -56.8 -41.3 77.51 Favored 'General case' 0 CA--C 1.511 -0.545 0 N-CA-C 112.932 0.716 . . . . 0.0 112.932 171.683 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 84.8 tttt -61.5 -49.74 75.53 Favored 'General case' 0 C--N 1.324 -0.515 0 CA-C-N 118.747 0.703 . . . . 0.0 109.604 -178.37 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 10.4 mp -60.15 -46.89 88.13 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.394 -0.366 . . . . 0.0 111.101 177.847 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 7.5 tt -51.9 -57.27 9.89 Favored 'General case' 0 C--N 1.333 -0.12 0 C-N-CA 123.652 0.781 . . . . 0.0 109.682 175.366 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 43.2 mt -55.44 -53.61 54.15 Favored 'General case' 0 N--CA 1.454 -0.252 0 C-N-CA 123.994 0.918 . . . . 0.0 109.246 -178.522 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 22.7 tt0 -55.21 -46.48 75.91 Favored 'General case' 0 N--CA 1.451 -0.386 0 C-N-CA 123.665 0.786 . . . . 0.0 111.629 -177.508 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 5.3 m -73.96 -53.11 10.8 Favored 'General case' 0 CA--C 1.532 0.258 0 C-N-CA 120.916 -0.314 . . . . 0.0 111.03 -176.307 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 79.4 mm-40 -91.82 -39.05 11.98 Favored 'General case' 0 N--CA 1.45 -0.442 0 C-N-CA 123.762 0.825 . . . . 0.0 112.751 -166.953 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 17.7 m-85 -134.91 62.99 56.22 Favored Pre-proline 0 CA--C 1.539 0.541 0 N-CA-C 113.22 0.822 . . . . 0.0 113.22 -169.132 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 85.4 Cg_exo -46.84 -34.73 16.59 Favored 'Trans proline' 0 CA--C 1.535 0.551 0 C-N-CA 123.275 2.65 . . . . 0.0 112.924 169.547 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 2.6 p -52.86 -54.66 31.29 Favored 'General case' 0 N--CA 1.447 -0.605 0 C-N-CA 125.777 1.631 . . . . 0.0 109.642 176.731 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 76.5 mt -70.05 -38.36 75.77 Favored 'General case' 0 N--CA 1.451 -0.409 0 C-N-CA 123.776 0.83 . . . . 0.0 111.239 178.785 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 12.0 tp -52.16 -49.23 64.2 Favored 'General case' 0 CA--C 1.53 0.179 0 CA-C-O 121.027 0.441 . . . . 0.0 109.913 176.618 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 9.1 mtpm? -69.28 -49.44 55.99 Favored 'General case' 0 N--CA 1.451 -0.377 0 C-N-CA 123.61 0.764 . . . . 0.0 110.525 176.021 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . -75.73 62.31 2.81 Favored Glycine 0 CA--C 1.527 0.831 0 C-N-CA 124.945 1.26 . . . . 0.0 112.624 -173.876 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 43' ' ' GLY . . . . . . . . . . . . . . . -162.2 149.07 16.94 Favored Glycine 0 CA--C 1.521 0.437 0 N-CA-C 108.393 -1.883 . . . . 0.0 108.393 172.207 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 44' ' ' SER . . . . . . . . . . . . . 3.0 m -63.94 -45.06 90.86 Favored 'General case' 0 N--CA 1.453 -0.303 0 CA-C-N 117.842 0.821 . . . . 0.0 109.757 -179.119 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 41.3 p -152.81 160.95 43.11 Favored 'General case' 0 N--CA 1.452 -0.354 0 N-CA-C 107.177 -1.416 . . . . 0.0 107.177 170.816 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 52.6 tp -52.79 -44.19 66.42 Favored 'General case' 0 N--CA 1.457 -0.115 0 N-CA-C 109.375 -0.602 . . . . 0.0 109.375 168.864 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 5.0 m-20 -55.78 -52.56 63.54 Favored 'General case' 0 N--CA 1.449 -0.495 0 C-N-CA 124.575 1.15 . . . . 0.0 110.602 177.805 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 4.0 tm-20 -53.49 -52.27 60.1 Favored 'General case' 0 C--N 1.331 -0.218 0 C-N-CA 122.512 0.325 . . . . 0.0 110.784 176.22 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 95.6 mt -55.18 -49.53 71.63 Favored 'General case' 0 CA--C 1.529 0.169 0 CA-C-O 121.282 0.563 . . . . 0.0 110.305 178.671 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 50' ' ' PHE . . . . . . . . . . . . . 62.4 t80 -55.49 -50.67 69.3 Favored 'General case' 0 N--CA 1.45 -0.426 0 C-N-CA 123.827 0.851 . . . . 0.0 110.828 -179.115 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 36.0 mt-10 -59.3 -45.93 89.94 Favored 'General case' 0 N--CA 1.454 -0.234 0 C-N-CA 123.289 0.636 . . . . 0.0 110.547 177.994 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 12.5 tm-20 -56.25 -46.16 79.73 Favored 'General case' 0 N--CA 1.456 -0.172 0 C-N-CA 123.358 0.663 . . . . 0.0 110.072 178.708 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 91.6 mt -72.6 -43.34 63.44 Favored 'General case' 0 N--CA 1.45 -0.435 0 C-N-CA 123.021 0.528 . . . . 0.0 112.04 -176.58 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 47.4 t0 -73.54 66.24 1.0 Allowed 'General case' 0 CA--C 1.537 0.459 0 C-N-CA 124.206 1.002 . . . . 0.0 112.206 -172.616 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 14.2 mptt -49.95 -43.64 50.11 Favored 'General case' 0 CA--C 1.531 0.234 0 C-N-CA 124.299 1.04 . . . . 0.0 112.127 173.766 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 56' ' ' ASN . . . . . . . . . . . . . 7.5 p30 -70.71 -14.12 62.33 Favored 'General case' 0 CA--C 1.536 0.432 0 N-CA-C 112.518 0.562 . . . . 0.0 112.518 -177.349 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . 66.99 18.06 68.39 Favored Glycine 0 CA--C 1.53 1.022 0 CA-C-O 119.063 -0.854 . . . . 0.0 114.327 173.038 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 3.0 p-10 -79.64 -3.05 45.42 Favored 'General case' 0 CA--C 1.533 0.318 0 CA-C-N 119.411 1.605 . . . . 0.0 113.058 -177.635 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . 81.55 30.08 37.63 Favored Glycine 0 CA--C 1.528 0.859 0 CA-C-O 119.63 -0.539 . . . . 0.0 111.841 178.903 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 30.3 mt-10 -156.43 176.09 13.16 Favored 'General case' 0 CA--C 1.528 0.129 0 C-N-CA 128.145 2.578 . . . . 0.0 105.924 169.904 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 61' ' ' VAL . . . . . . . . . . . . . 3.5 t -123.57 115.36 45.07 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.183 0 N-CA-C 109.373 -0.603 . . . . 0.0 109.373 179.582 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 62.4 p -77.95 156.96 29.92 Favored 'General case' 0 CA--C 1.532 0.267 0 C-N-CA 123.515 0.726 . . . . 0.0 110.395 177.794 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 63' ' ' PHE . . . . . . . . . . . . . 71.4 t80 -55.11 -34.97 64.15 Favored 'General case' 0 N--CA 1.463 0.207 0 N-CA-C 112.318 0.488 . . . . 0.0 112.318 178.042 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 45.8 mt-10 -58.1 -67.56 0.33 Allowed 'General case' 0 N--CA 1.452 -0.339 0 N-CA-C 109.903 -0.406 . . . . 0.0 109.903 176.78 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 9.8 pt-20 -65.24 -28.55 69.44 Favored 'General case' 0 CA--C 1.534 0.348 0 O-C-N 121.842 -0.536 . . . . 0.0 111.669 -175.015 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 8.2 t80 -49.15 -29.88 5.98 Favored 'General case' 0 CA--C 1.532 0.276 0 C-N-CA 123.391 0.677 . . . . 0.0 112.283 169.102 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 67' ' ' GLN . . . . . . . . . . . . . 97.8 mm-40 -56.86 -19.93 20.25 Favored 'General case' 0 CA--C 1.54 0.571 0 CA-C-N 119.661 1.119 . . . . 0.0 112.933 175.993 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 69.8 t -56.97 -34.29 44.23 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.552 0 CA-C-N 119.61 1.095 . . . . 0.0 110.878 169.472 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 9.4 tt -70.9 -44.36 66.42 Favored 'General case' 0 N--CA 1.456 -0.147 0 N-CA-C 107.179 -1.415 . . . . 0.0 107.179 -179.675 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 70' ' ' VAL . . . . . . . . . . . . . 22.2 t -58.96 -43.62 89.17 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.371 0 N-CA-C 109.913 -0.403 . . . . 0.0 109.913 176.879 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 79.0 tttt -53.46 -53.59 49.24 Favored 'General case' 0 N--CA 1.455 -0.206 0 C-N-CA 122.88 0.472 . . . . 0.0 110.545 171.628 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 5.5 mptp? -50.34 -45.45 54.98 Favored 'General case' 0 CA--C 1.537 0.475 0 N-CA-C 112.073 0.397 . . . . 0.0 112.073 174.604 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 73' ' ' ILE . . . . . . . . . . . . . 52.2 mt -59.29 -53.65 45.16 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.307 0 CA-C-N 118.361 0.528 . . . . 0.0 110.216 176.302 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 2.5 m 64.06 -39.93 0.22 Allowed 'General case' 0 CA--C 1.537 0.468 0 C-N-CA 128.095 2.558 . . . . 0.0 115.274 -175.54 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 75' ' ' GLN . . . . . . . . . . . . . 38.4 mm-40 . . . . . 0 C--O 1.27 2.156 0 O-C-N 121.418 -0.801 . . . . 0.0 110.487 -174.886 . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' A' A ' 1' ' ' LYS . . . . . . . . . . . . . 29.3 mttp . . . . . 0 N--CA 1.45 -0.436 0 N-CA-C 108.469 -0.937 . . . . 0.0 108.469 . . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 90.7 p -72.44 153.12 91.99 Favored Pre-proline 0 CA--C 1.534 0.345 0 CA-C-O 118.931 -0.557 . . . . 0.0 110.053 177.639 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 99.2 Cg_exo -44.2 -42.13 13.16 Favored 'Trans proline' 0 N--CA 1.458 -0.58 0 C-N-CA 123.305 2.67 . . . . 0.0 112.463 169.571 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 2.9 mp0 -58.59 -50.33 74.2 Favored 'General case' 0 N--CA 1.454 -0.246 0 C-N-CA 123.762 0.825 . . . . 0.0 111.971 176.473 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 31.9 mt-10 -60.35 -45.57 93.02 Favored 'General case' 0 C--N 1.332 -0.183 0 N-CA-C 109.101 -0.703 . . . . 0.0 109.101 178.254 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 20.2 mt -59.45 -38.03 79.67 Favored 'General case' 0 N--CA 1.446 -0.651 0 C-N-CA 122.841 0.457 . . . . 0.0 111.998 178.116 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 78.3 tttt -64.55 -44.48 90.62 Favored 'General case' 0 N--CA 1.449 -0.504 0 CA-C-N 118.292 0.496 . . . . 0.0 110.664 172.769 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . -54.55 -51.71 50.18 Favored Glycine 0 CA--C 1.529 0.966 0 N-CA-C 109.893 -1.283 . . . . 0.0 109.893 177.709 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 9' ' ' ILE . . . . . . . . . . . . . 63.1 mt -53.84 -56.79 7.46 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.23 0 C-N-CA 125.935 1.694 . . . . 0.0 110.055 173.245 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 10' ' ' PHE . . . . . . . . . . . . . 51.9 t80 -45.97 -53.43 10.01 Favored 'General case' 0 N--CA 1.451 -0.414 0 C-N-CA 123.169 0.588 . . . . 0.0 109.843 179.019 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 44.3 mt-10 -62.8 -51.92 65.21 Favored 'General case' 0 CA--C 1.532 0.265 0 C-N-CA 122.756 0.423 . . . . 0.0 110.731 -178.591 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 26.4 ttpt -45.8 -53.72 9.16 Favored 'General case' 0 C--N 1.338 0.102 0 C-N-CA 125.15 1.38 . . . . 0.0 111.077 178.186 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 57.0 m-85 -77.28 -44.36 30.03 Favored 'General case' 0 N--CA 1.45 -0.44 0 N-CA-C 110.107 -0.331 . . . . 0.0 110.107 -175.456 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -52.99 -45.92 68.07 Favored 'General case' 0 C--O 1.225 -0.204 0 C-N-CA 123.652 0.781 . . . . 0.0 111.897 178.956 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -64.03 -19.78 65.45 Favored 'General case' 0 C--N 1.331 -0.21 0 N-CA-C 113.007 0.743 . . . . 0.0 113.007 178.075 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 36.9 ttmt -71.75 87.32 0.96 Allowed 'General case' 0 N--CA 1.448 -0.563 0 N-CA-C 107.685 -1.228 . . . . 0.0 107.685 -178.952 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 12.1 tm-20 78.57 -46.2 0.41 Allowed 'General case' 0 CA--C 1.531 0.217 0 C-N-CA 126.275 1.83 . . . . 0.0 111.206 -178.102 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . -67.26 176.74 22.29 Favored Glycine 0 CA--C 1.532 1.101 0 CA-C-O 121.833 0.685 . . . . 0.0 111.656 177.387 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 10.5 t70 -79.08 135.59 58.29 Favored Pre-proline 0 CA--C 1.532 0.268 0 N-CA-C 107.486 -1.302 . . . . 0.0 107.486 172.653 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 20' ' ' PRO . . . . . . . . . . . . . 19.2 Cg_endo -52.54 -26.9 30.44 Favored 'Trans proline' 0 CA--C 1.535 0.567 0 C-N-CA 122.919 2.413 . . . . 0.0 113.988 -179.162 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 44.8 m-80 -85.0 -7.59 59.08 Favored 'General case' 0 N--CA 1.453 -0.289 0 C-N-CA 123.779 0.832 . . . . 0.0 112.877 -178.523 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 11.4 tt0 -156.87 117.63 3.64 Favored 'General case' 0 CA--C 1.538 0.482 0 CA-C-N 119.648 1.113 . . . . 0.0 112.903 -169.017 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 19.2 mt -79.66 136.31 36.77 Favored 'General case' 0 C--O 1.234 0.278 0 C-N-CA 124.566 1.146 . . . . 0.0 110.918 179.43 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 12.4 p -97.42 -179.62 4.55 Favored 'General case' 0 CA--C 1.54 0.583 0 N-CA-C 107.322 -1.362 . . . . 0.0 107.322 164.796 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 62.4 mttp -55.14 -47.11 75.55 Favored 'General case' 0 C--O 1.226 -0.135 0 O-C-N 121.941 -0.475 . . . . 0.0 112.157 -173.097 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 34.4 tt0 -64.09 -46.3 84.88 Favored 'General case' 0 N--CA 1.456 -0.173 0 CA-C-N 118.16 0.436 . . . . 0.0 110.62 -174.54 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 2.6 mp0 -54.7 -49.93 69.52 Favored 'General case' 0 N--CA 1.451 -0.414 0 N-CA-C 109.578 -0.527 . . . . 0.0 109.578 175.214 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 9.6 mt -55.88 -43.74 77.48 Favored 'General case' 0 CA--C 1.51 -0.573 0 N-CA-C 113.266 0.839 . . . . 0.0 113.266 173.473 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 84.8 tttt -62.45 -48.54 79.21 Favored 'General case' 0 C--N 1.323 -0.567 0 CA-C-N 118.512 0.596 . . . . 0.0 109.769 -175.858 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 81.5 mt -62.44 -47.51 83.75 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.875 178.905 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 6.7 tt -49.5 -58.22 5.59 Favored 'General case' 0 CA--C 1.522 -0.12 0 C-N-CA 123.979 0.912 . . . . 0.0 109.264 174.023 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 39.9 mt -56.68 -57.99 10.01 Favored 'General case' 0 N--CA 1.451 -0.4 0 C-N-CA 123.533 0.733 . . . . 0.0 109.281 -177.404 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 7.0 tp-100 -52.2 -49.7 63.38 Favored 'General case' 0 N--CA 1.455 -0.206 0 C-N-CA 123.04 0.536 . . . . 0.0 111.161 -176.343 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 11.4 m -75.74 -49.38 18.37 Favored 'General case' 0 N--CA 1.454 -0.258 0 CA-C-N 116.223 -0.444 . . . . 0.0 111.069 -171.574 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 70.4 mm-40 -89.67 -29.25 18.92 Favored 'General case' 0 N--CA 1.45 -0.458 0 C-N-CA 123.362 0.665 . . . . 0.0 111.771 -169.465 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 94.1 m-85 -146.07 65.0 10.47 Favored Pre-proline 0 CA--C 1.537 0.443 0 C-N-CA 124.425 1.09 . . . . 0.0 111.63 -174.66 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 37.9 Cg_endo -58.86 -28.36 87.01 Favored 'Trans proline' 0 N--CA 1.457 -0.675 0 C-N-CA 122.29 1.993 . . . . 0.0 110.894 178.008 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 2.8 p -53.65 -57.1 12.02 Favored 'General case' 0 N--CA 1.447 -0.59 0 C-N-CA 125.992 1.717 . . . . 0.0 109.421 173.279 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 94.2 mt -63.64 -43.95 95.29 Favored 'General case' 0 N--CA 1.452 -0.341 0 C-N-CA 123.768 0.827 . . . . 0.0 110.908 178.754 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 3.2 tm? -52.23 -50.02 62.83 Favored 'General case' 0 CA--C 1.527 0.094 0 CA-C-O 120.954 0.407 . . . . 0.0 110.1 -179.424 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 97.9 mttt -74.35 -63.57 1.21 Allowed 'General case' 0 N--CA 1.45 -0.427 0 CA-C-O 121.757 0.789 . . . . 0.0 110.293 179.368 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . -80.45 68.04 3.4 Favored Glycine 0 CA--C 1.523 0.589 0 C-N-CA 124.59 1.09 . . . . 0.0 110.795 -177.32 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 43' ' ' GLY . . . . . . . . . . . . . . . -163.43 176.83 39.54 Favored Glycine 0 CA--C 1.524 0.594 0 N-CA-C 110.208 -1.157 . . . . 0.0 110.208 176.881 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 44' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -57.18 162.32 2.7 Favored 'General case' 0 N--CA 1.452 -0.344 0 C-N-CA 124.072 0.949 . . . . 0.0 110.123 172.859 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 68.7 p -61.96 155.74 22.88 Favored 'General case' 0 CA--C 1.532 0.286 0 N-CA-C 108.735 -0.839 . . . . 0.0 108.735 173.778 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 66.6 tp -50.27 -46.87 55.41 Favored 'General case' 0 C--O 1.224 -0.246 0 O-C-N 121.968 -0.458 . . . . 0.0 111.714 -171.395 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 5.3 m-20 -60.6 -46.11 91.46 Favored 'General case' 0 N--CA 1.451 -0.4 0 C-N-CA 123.339 0.656 . . . . 0.0 111.542 179.803 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 93.0 mt-10 -59.64 -52.12 66.91 Favored 'General case' 0 N--CA 1.455 -0.181 0 N-CA-C 109.557 -0.535 . . . . 0.0 109.557 177.383 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 46.9 tp -58.47 -46.39 86.71 Favored 'General case' 0 N--CA 1.452 -0.364 0 N-CA-C 109.416 -0.587 . . . . 0.0 109.416 -178.147 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 50' ' ' PHE . . . . . . . . . . . . . 71.2 t80 -54.6 -50.11 68.83 Favored 'General case' 0 N--CA 1.449 -0.497 0 C-N-CA 123.934 0.894 . . . . 0.0 110.249 177.281 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 41.2 tt0 -57.35 -49.84 74.88 Favored 'General case' 0 N--CA 1.453 -0.279 0 C-N-CA 122.275 0.23 . . . . 0.0 110.761 177.411 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 39.9 mt-10 -55.18 -44.57 75.36 Favored 'General case' 0 CA--C 1.53 0.196 0 C-N-CA 123.141 0.576 . . . . 0.0 111.458 178.931 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 84.7 mt -71.3 -42.66 68.38 Favored 'General case' 0 N--CA 1.451 -0.388 0 C-N-CA 122.955 0.502 . . . . 0.0 111.582 -178.879 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 21.4 t0 -70.59 72.08 0.5 Allowed 'General case' 0 CA--C 1.534 0.331 0 C-N-CA 124.289 1.036 . . . . 0.0 110.363 177.553 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 2.7 mmmp? -65.39 -33.08 75.13 Favored 'General case' 0 N--CA 1.452 -0.369 0 C-N-CA 123.071 0.548 . . . . 0.0 111.66 172.941 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 56' ' ' ASN . . . . . . . . . . . . . 1.1 p30 -64.71 -39.46 93.69 Favored 'General case' 0 CA--C 1.535 0.366 0 C-N-CA 122.561 0.344 . . . . 0.0 111.319 -175.864 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . 110.09 -11.24 31.67 Favored Glycine 0 CA--C 1.531 1.049 0 C-N-CA 124.115 0.864 . . . . 0.0 114.09 172.021 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 9.5 p-10 -78.15 11.37 2.35 Favored 'General case' 0 CA--C 1.535 0.367 0 CA-C-N 119.696 1.748 . . . . 0.0 113.84 -171.56 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . 70.33 32.66 68.4 Favored Glycine 0 CA--C 1.526 0.739 0 CA-C-O 118.894 -0.948 . . . . 0.0 112.156 177.596 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 46.9 mt-10 -157.91 171.25 20.6 Favored 'General case' 0 CA--C 1.532 0.254 0 C-N-CA 126.6 1.96 . . . . 0.0 107.466 169.929 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 61' ' ' VAL . . . . . . . . . . . . . 4.4 t -127.78 111.75 25.6 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.408 0 C-N-CA 123.006 0.522 . . . . 0.0 111.213 -169.679 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 8.6 t -83.3 177.4 8.53 Favored 'General case' 0 CA--C 1.537 0.467 0 CA-C-O 121.249 0.547 . . . . 0.0 111.991 172.572 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 63' ' ' PHE . . . . . . . . . . . . . 40.2 t80 -64.97 -47.59 77.06 Favored 'General case' 0 N--CA 1.461 0.086 0 C-N-CA 123.615 0.766 . . . . 0.0 112.723 -168.693 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 23.1 mp0 -59.87 -56.24 24.19 Favored 'General case' 0 N--CA 1.452 -0.342 0 N-CA-C 108.862 -0.792 . . . . 0.0 108.862 -175.984 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 18.0 pt-20 -62.84 -35.1 78.85 Favored 'General case' 0 CA--C 1.537 0.45 0 N-CA-C 112.102 0.408 . . . . 0.0 112.102 179.429 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 7.4 t80 -50.06 -31.73 13.81 Favored 'General case' 0 CA--C 1.535 0.397 0 O-C-N 121.172 -0.955 . . . . 0.0 112.403 169.542 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 67' ' ' GLN . . . . . . . . . . . . . 14.7 mm-40 -55.66 -20.43 14.07 Favored 'General case' 0 CA--C 1.54 0.593 0 CA-C-N 119.388 0.995 . . . . 0.0 113.372 174.265 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 76.8 t -53.63 -28.8 16.58 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.56 0 CA-C-N 119.654 1.116 . . . . 0.0 110.929 169.942 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 31.1 tp -70.69 -39.13 73.66 Favored 'General case' 0 CA--C 1.532 0.27 0 O-C-N 121.094 -1.004 . . . . 0.0 108.293 176.706 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 70' ' ' VAL . . . . . . . . . . . . . 11.5 t -66.54 -36.23 76.8 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.256 0 O-C-N 121.786 -0.571 . . . . 0.0 109.699 176.911 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 79.0 tttt -56.14 -53.35 58.11 Favored 'General case' 0 CA--C 1.532 0.265 0 O-C-N 122.004 -0.435 . . . . 0.0 110.167 168.957 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 2.7 mptm? -49.48 -45.58 47.04 Favored 'General case' 0 CA--C 1.536 0.429 0 N-CA-C 112.106 0.41 . . . . 0.0 112.106 174.601 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 73' ' ' ILE . . . . . . . . . . . . . 98.6 mt -58.75 -56.99 13.12 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.324 0 N-CA-C 109.735 -0.469 . . . . 0.0 109.735 175.542 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 12.0 t -178.18 -70.91 0.01 OUTLIER 'General case' 0 N--CA 1.454 -0.235 0 C-N-CA 126.182 1.793 . . . . 0.0 108.817 178.829 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 75' ' ' GLN . . . . . . . . . . . . . 25.4 mp0 . . . . . 0 C--O 1.27 2.182 0 CA-C-O 121.431 0.634 . . . . 0.0 109.318 -174.134 . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' A' A ' 1' ' ' LYS . . . . . . . . . . . . . 2.5 mptp? . . . . . 0 N--CA 1.45 -0.461 0 N-CA-C 108.336 -0.987 . . . . 0.0 108.336 . . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 80.7 p -68.7 160.79 75.48 Favored Pre-proline 0 CA--C 1.535 0.39 0 N-CA-C 109.301 -0.629 . . . . 0.0 109.301 169.926 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 98.0 Cg_exo -45.69 -41.91 19.24 Favored 'Trans proline' 0 N--CA 1.459 -0.501 0 C-N-CA 123.168 2.579 . . . . 0.0 112.619 169.803 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 45.0 mt-10 -61.79 -45.51 93.58 Favored 'General case' 0 N--CA 1.454 -0.256 0 C-N-CA 123.046 0.539 . . . . 0.0 111.249 178.152 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 31.7 mt-10 -65.28 -44.3 88.43 Favored 'General case' 0 N--CA 1.45 -0.436 0 N-CA-C 109.108 -0.701 . . . . 0.0 109.108 178.378 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 14.6 mt -55.02 -42.87 73.12 Favored 'General case' 0 N--CA 1.453 -0.323 0 C-N-CA 123.684 0.794 . . . . 0.0 111.075 175.843 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 23.3 tptm -61.53 -52.14 65.7 Favored 'General case' 0 C--O 1.226 -0.136 0 CA-C-N 118.483 0.583 . . . . 0.0 111.113 172.954 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . -51.06 -49.3 43.49 Favored Glycine 0 CA--C 1.533 1.18 0 N-CA-C 111.081 -0.808 . . . . 0.0 111.081 179.297 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 9' ' ' ILE . . . . . . . . . . . . . 3.0 mm -58.81 -55.48 22.9 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.257 0 C-N-CA 126.885 2.074 . . . . 0.0 109.037 176.46 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 10' ' ' PHE . . . . . . . . . . . . . 58.7 t80 -46.15 -52.24 12.61 Favored 'General case' 0 N--CA 1.451 -0.398 0 C-N-CA 123.242 0.617 . . . . 0.0 109.938 177.785 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 52.6 mt-10 -62.06 -51.56 67.49 Favored 'General case' 0 CA--C 1.532 0.287 0 C-N-CA 123.213 0.605 . . . . 0.0 110.738 -179.986 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 67.2 tttt -44.65 -51.91 8.7 Favored 'General case' 0 N--CA 1.462 0.15 0 C-N-CA 124.877 1.271 . . . . 0.0 111.128 177.7 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 58.1 m-85 -77.75 -46.24 22.3 Favored 'General case' 0 N--CA 1.454 -0.259 0 O-C-N 122.304 -0.248 . . . . 0.0 110.645 -175.532 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -56.34 -41.48 76.13 Favored 'General case' 0 C--N 1.332 -0.17 0 C-N-CA 123.491 0.716 . . . . 0.0 111.793 -179.655 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -46.58 -36.06 6.49 Favored 'General case' 0 CA--C 1.53 0.181 0 C-N-CA 124.518 1.127 . . . . 0.0 112.232 177.8 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 46.0 mtmt -59.48 -31.21 69.13 Favored 'General case' 0 CA--C 1.536 0.404 0 CA-C-N 118.464 0.575 . . . . 0.0 111.835 -179.622 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 25.3 tp10 -71.68 -22.06 61.71 Favored 'General case' 0 CA--C 1.532 0.262 0 C-N-CA 123.843 0.857 . . . . 0.0 111.208 175.821 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 108.91 -53.28 0.6 Allowed Glycine 0 CA--C 1.523 0.553 0 N-CA-C 108.694 -1.763 . . . . 0.0 108.694 -171.159 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 42.9 t0 -81.17 112.45 32.99 Favored Pre-proline 0 CA--C 1.537 0.475 0 CA-C-O 118.636 -0.697 . . . . 0.0 110.443 179.548 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 20' ' ' PRO . . . . . . . . . . . . . 41.4 Cg_endo -65.53 -21.79 59.49 Favored 'Trans proline' 0 N--CA 1.458 -0.598 0 C-N-CA 122.059 1.839 . . . . 0.0 113.201 177.143 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 51.0 m-80 -81.51 -4.12 55.04 Favored 'General case' 0 C--O 1.234 0.272 0 N-CA-C 113.58 0.955 . . . . 0.0 113.58 -169.21 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 43.5 tt0 -155.52 130.87 9.59 Favored 'General case' 0 CA--C 1.533 0.322 0 CA-C-N 119.333 0.969 . . . . 0.0 112.428 -168.311 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 40.2 mt -102.66 123.58 46.63 Favored 'General case' 0 N--CA 1.453 -0.283 0 C-N-CA 124.651 1.18 . . . . 0.0 111.85 179.13 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -84.21 170.84 13.33 Favored 'General case' 0 CA--C 1.537 0.471 0 C-N-CA 123.625 0.77 . . . . 0.0 109.591 165.202 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 98.4 mttt -51.14 -49.94 59.85 Favored 'General case' 0 C--N 1.339 0.123 0 N-CA-C 113.333 0.864 . . . . 0.0 113.333 -168.949 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 38.6 tp10 -63.2 -45.12 93.21 Favored 'General case' 0 N--CA 1.456 -0.152 0 O-C-N 121.983 -0.448 . . . . 0.0 111.045 -173.249 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 1.9 mp0 -53.66 -51.19 63.94 Favored 'General case' 0 N--CA 1.452 -0.358 0 N-CA-C 109.598 -0.519 . . . . 0.0 109.598 173.319 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 9.2 mt -55.73 -41.72 74.29 Favored 'General case' 0 CA--C 1.513 -0.472 0 N-CA-C 113.173 0.805 . . . . 0.0 113.173 173.748 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 60.0 tttm -61.82 -51.96 66.13 Favored 'General case' 0 C--N 1.325 -0.494 0 CA-C-N 118.67 0.668 . . . . 0.0 109.82 -177.249 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 10.5 mp -63.2 -44.09 96.32 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.146 -0.479 . . . . 0.0 110.606 -179.936 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 7.4 tt -50.32 -58.25 6.07 Favored 'General case' 0 C--N 1.332 -0.167 0 C-N-CA 123.789 0.835 . . . . 0.0 109.543 173.074 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 29.4 mt -54.19 -62.13 1.85 Allowed 'General case' 0 N--CA 1.455 -0.193 0 C-N-CA 123.561 0.744 . . . . 0.0 109.605 -179.103 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 25.5 tt0 -55.73 -45.08 78.05 Favored 'General case' 0 N--CA 1.452 -0.331 0 C-N-CA 123.575 0.75 . . . . 0.0 111.534 -173.096 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 19.8 m -78.44 -48.0 16.33 Favored 'General case' 0 C--N 1.33 -0.28 0 C-N-CA 122.367 0.267 . . . . 0.0 111.313 -173.376 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 66.7 mm-40 -96.42 -31.02 13.05 Favored 'General case' 0 N--CA 1.45 -0.463 0 N-CA-C 112.766 0.654 . . . . 0.0 112.766 -167.748 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 69.7 m-85 -139.41 60.31 16.5 Favored Pre-proline 0 CA--C 1.53 0.197 0 C-N-CA 123.522 0.729 . . . . 0.0 110.462 -176.205 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 21.1 Cg_endo -55.07 -30.12 68.73 Favored 'Trans proline' 0 N--CA 1.457 -0.669 0 C-N-CA 122.904 2.403 . . . . 0.0 111.956 -172.997 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 1.5 m -54.06 -44.97 71.55 Favored 'General case' 0 N--CA 1.45 -0.449 0 C-N-CA 124.875 1.27 . . . . 0.0 110.314 178.754 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 58.2 mt -65.97 -21.26 66.41 Favored 'General case' 0 N--CA 1.454 -0.241 0 C-N-CA 123.793 0.837 . . . . 0.0 111.986 -177.037 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 21.8 tp -66.38 -29.87 70.14 Favored 'General case' 0 N--CA 1.454 -0.263 0 CA-C-N 117.956 0.344 . . . . 0.0 110.252 175.323 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 2.6 mptp? -87.21 154.74 20.48 Favored 'General case' 0 N--CA 1.438 -1.031 0 N-CA-C 106.646 -1.612 . . . . 0.0 106.646 167.599 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . 77.24 -42.74 1.94 Allowed Glycine 0 CA--C 1.531 1.089 0 O-C-N 121.666 -0.647 . . . . 0.0 112.742 176.145 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 43' ' ' GLY . . . . . . . . . . . . . . . -67.96 69.02 0.32 Allowed Glycine 0 CA--C 1.532 1.145 0 C-N-CA 124.55 1.071 . . . . 0.0 112.323 177.202 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 44' ' ' SER . . . . . . . . . . . . . 80.5 p 34.07 -93.12 0.01 OUTLIER 'General case' 0 N--CA 1.451 -0.394 0 C-N-CA 128.681 2.792 . . . . 0.0 113.988 169.895 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 82.2 p -141.17 167.86 21.16 Favored 'General case' 0 N--CA 1.454 -0.238 0 N-CA-C 105.506 -2.035 . . . . 0.0 105.506 168.709 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 58.8 tp -55.79 -46.88 77.9 Favored 'General case' 0 C--O 1.226 -0.153 0 CA-C-N 118.904 0.774 . . . . 0.0 110.775 174.051 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 5.7 m-20 -61.03 -54.5 44.06 Favored 'General case' 0 N--CA 1.45 -0.431 0 C-N-CA 123.395 0.678 . . . . 0.0 110.788 -179.215 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 59.1 mm-40 -58.29 -43.67 88.17 Favored 'General case' 0 N--CA 1.455 -0.217 0 C-N-CA 120.681 -0.407 . . . . 0.0 110.535 178.676 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 46.5 tp -61.17 -47.47 86.02 Favored 'General case' 0 N--CA 1.452 -0.335 0 N-CA-C 109.746 -0.465 . . . . 0.0 109.746 179.816 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 50' ' ' PHE . . . . . . . . . . . . . 70.4 t80 -51.96 -49.61 62.87 Favored 'General case' 0 C--N 1.331 -0.209 0 C-N-CA 124.022 0.929 . . . . 0.0 110.367 176.595 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 36.0 mt-10 -62.46 -44.11 97.2 Favored 'General case' 0 CA--C 1.532 0.266 0 C-N-CA 122.45 0.3 . . . . 0.0 111.687 177.464 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 34.4 mt-10 -57.36 -40.75 78.75 Favored 'General case' 0 C--N 1.332 -0.183 0 C-N-CA 122.921 0.488 . . . . 0.0 110.962 176.097 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 94.6 mt -66.33 -67.32 0.46 Allowed 'General case' 0 N--CA 1.449 -0.499 0 C-N-CA 123.054 0.542 . . . . 0.0 109.971 176.732 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 39.8 t0 -87.69 74.97 9.07 Favored 'General case' 0 N--CA 1.454 -0.267 0 N-CA-C 108.192 -1.04 . . . . 0.0 108.192 177.368 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 46.7 tptt -81.65 -30.44 32.76 Favored 'General case' 0 N--CA 1.452 -0.342 0 CA-C-N 115.652 -0.703 . . . . 0.0 111.369 179.471 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 56' ' ' ASN . . . . . . . . . . . . . 31.7 p-10 -139.96 29.82 2.06 Favored 'General case' 0 CA--C 1.528 0.131 0 C-N-CA 123.669 0.788 . . . . 0.0 112.029 -170.533 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . -109.48 -97.89 2.49 Favored Glycine 0 C--N 1.339 0.721 0 N-CA-C 108.977 -1.649 . . . . 0.0 108.977 174.576 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 5.1 p-10 -139.81 -45.5 0.44 Allowed 'General case' 0 N--CA 1.446 -0.637 0 C-N-CA 125.625 1.57 . . . . 0.0 111.782 -170.66 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . 158.38 -64.3 0.3 Allowed Glycine 0 CA--C 1.526 0.739 0 N-CA-C 107.931 -2.068 . . . . 0.0 107.931 -173.65 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 11.3 mp0 -78.83 132.29 36.79 Favored 'General case' 0 N--CA 1.454 -0.266 0 N-CA-C 108.375 -0.972 . . . . 0.0 108.375 -177.195 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 61' ' ' VAL . . . . . . . . . . . . . 15.2 t -79.18 110.54 15.01 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.375 0 C-N-CA 123.399 0.68 . . . . 0.0 111.397 -166.42 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 8.7 t -79.36 172.91 13.14 Favored 'General case' 0 CA--C 1.537 0.465 0 CA-C-O 120.815 0.34 . . . . 0.0 111.316 169.668 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 63' ' ' PHE . . . . . . . . . . . . . 55.1 t80 -63.45 -36.83 85.04 Favored 'General case' 0 N--CA 1.464 0.265 0 N-CA-C 113.3 0.852 . . . . 0.0 113.3 -168.679 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 21.1 mp0 -67.55 -58.4 4.77 Favored 'General case' 0 N--CA 1.453 -0.321 0 N-CA-C 108.864 -0.791 . . . . 0.0 108.864 -177.857 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 17.8 pt-20 -59.58 -35.04 73.49 Favored 'General case' 0 CA--C 1.539 0.549 0 O-C-N 121.775 -0.578 . . . . 0.0 111.796 177.351 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 19.2 t80 -51.39 -28.6 13.13 Favored 'General case' 0 CA--C 1.534 0.344 0 O-C-N 121.288 -0.882 . . . . 0.0 112.489 169.89 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 67' ' ' GLN . . . . . . . . . . . . . 74.8 mm-40 -54.38 -23.73 16.85 Favored 'General case' 0 CA--C 1.538 0.497 0 CA-C-N 120.119 1.327 . . . . 0.0 113.063 174.04 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 86.5 t -55.64 -27.93 22.4 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.704 0 CA-C-N 119.44 1.018 . . . . 0.0 111.042 172.079 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 8.4 tt -71.44 -41.03 69.96 Favored 'General case' 0 CA--C 1.529 0.164 0 O-C-N 120.892 -1.13 . . . . 0.0 108.256 176.597 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 70' ' ' VAL . . . . . . . . . . . . . 15.7 t -66.28 -33.61 64.68 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.498 0 O-C-N 121.705 -0.622 . . . . 0.0 109.812 176.642 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 76.7 tttt -57.69 -54.36 47.76 Favored 'General case' 0 N--CA 1.455 -0.222 0 O-C-N 121.81 -0.557 . . . . 0.0 109.973 168.997 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 2.6 mptm? -50.97 -45.41 60.85 Favored 'General case' 0 CA--C 1.536 0.404 0 C-N-CA 122.436 0.295 . . . . 0.0 111.774 174.506 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 73' ' ' ILE . . . . . . . . . . . . . 73.5 mt -57.44 -49.1 81.32 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.23 0 CA-C-N 117.954 0.343 . . . . 0.0 110.454 176.909 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 30.0 t -159.61 -54.32 0.06 Allowed 'General case' 0 C--N 1.333 -0.122 0 N-CA-C 112.667 0.617 . . . . 0.0 112.667 -170.323 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 75' ' ' GLN . . . . . . . . . . . . . 15.8 mm100 . . . . . 0 C--O 1.27 2.146 0 O-C-N 121.85 -0.531 . . . . 0.0 111.371 -167.677 . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' A' A ' 1' ' ' LYS . . . . . . . . . . . . . 43.9 mmtm . . . . . 0 N--CA 1.451 -0.397 0 N-CA-C 108.4 -0.963 . . . . 0.0 108.4 . . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 86.8 p -70.13 157.6 89.46 Favored Pre-proline 0 CA--C 1.536 0.415 0 CA-C-O 119.012 -0.518 . . . . 0.0 109.869 175.004 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 88.8 Cg_exo -46.34 -42.72 22.25 Favored 'Trans proline' 0 N--CA 1.458 -0.592 0 C-N-CA 123.136 2.557 . . . . 0.0 112.465 169.908 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 45.7 mt-10 -59.25 -48.14 82.72 Favored 'General case' 0 C--O 1.232 0.159 0 C-N-CA 123.504 0.722 . . . . 0.0 111.083 177.687 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 31.6 mt-10 -61.42 -46.22 91.04 Favored 'General case' 0 C--O 1.221 -0.41 0 N-CA-C 108.957 -0.757 . . . . 0.0 108.957 177.263 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 14.8 mt -59.25 -40.38 85.8 Favored 'General case' 0 N--CA 1.451 -0.417 0 C-N-CA 123.596 0.759 . . . . 0.0 111.477 -178.334 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -60.18 -53.93 51.89 Favored 'General case' 0 CA--C 1.53 0.206 0 C-N-CA 123.332 0.653 . . . . 0.0 110.73 170.987 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . -51.84 -49.03 49.57 Favored Glycine 0 CA--C 1.533 1.192 0 N-CA-C 111.295 -0.722 . . . . 0.0 111.295 179.205 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 9' ' ' ILE . . . . . . . . . . . . . 3.4 mm -59.41 -52.07 65.21 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.265 0 C-N-CA 127.416 2.286 . . . . 0.0 109.254 177.339 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 10' ' ' PHE . . . . . . . . . . . . . 51.9 t80 -48.13 -53.21 17.42 Favored 'General case' 0 N--CA 1.45 -0.463 0 N-CA-C 109.306 -0.627 . . . . 0.0 109.306 177.234 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 44.5 mt-10 -60.48 -52.97 62.94 Favored 'General case' 0 CA--C 1.53 0.173 0 C-N-CA 122.438 0.295 . . . . 0.0 110.682 179.411 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 39.4 tttm -43.06 -54.82 4.13 Favored 'General case' 0 N--CA 1.455 -0.177 0 C-N-CA 125.025 1.33 . . . . 0.0 110.668 179.832 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 70.0 m-85 -78.47 -44.1 25.43 Favored 'General case' 0 N--CA 1.454 -0.238 0 CA-C-O 119.533 -0.27 . . . . 0.0 111.386 -176.254 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -52.19 -37.96 56.41 Favored 'General case' 0 N--CA 1.463 0.208 0 C-N-CA 123.351 0.66 . . . . 0.0 112.086 179.118 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -72.28 -14.11 61.68 Favored 'General case' 0 N--CA 1.451 -0.402 0 N-CA-C 113.597 0.962 . . . . 0.0 113.597 179.589 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 64.6 mttm -78.0 62.69 2.84 Favored 'General case' 0 C--N 1.343 0.301 0 CA-C-N 120.345 1.43 . . . . 0.0 109.251 -179.22 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 33.5 mt-10 60.74 116.24 0.01 OUTLIER 'General case' 0 N--CA 1.446 -0.638 0 C-N-CA 127.283 2.233 . . . . 0.0 111.453 -167.388 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 146.18 179.94 22.73 Favored Glycine 0 N--CA 1.447 -0.581 0 N-CA-C 107.616 -2.194 . . . . 0.0 107.616 -173.385 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 30.5 t0 -77.94 121.89 84.73 Favored Pre-proline 0 N--CA 1.45 -0.45 0 N-CA-C 106.06 -1.829 . . . . 0.0 106.06 169.675 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 20' ' ' PRO . . . . . . . . . . . . . 17.8 Cg_endo -53.8 -25.95 36.94 Favored 'Trans proline' 0 CA--C 1.54 0.804 0 C-N-CA 121.956 1.771 . . . . 0.0 112.351 177.844 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 31.9 m-80 -86.22 -7.62 58.4 Favored 'General case' 0 CA--C 1.533 0.314 0 C-N-CA 124.615 1.166 . . . . 0.0 112.97 -179.1 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 25.3 tt0 -155.57 115.53 3.71 Favored 'General case' 0 CA--C 1.538 0.506 0 CA-C-N 119.443 1.02 . . . . 0.0 111.81 -168.907 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 32.3 mt -80.49 128.32 33.45 Favored 'General case' 0 C--O 1.234 0.283 0 C-N-CA 123.513 0.725 . . . . 0.0 112.015 -171.421 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -86.12 175.25 8.63 Favored 'General case' 0 CA--C 1.541 0.629 0 N-CA-C 108.108 -1.071 . . . . 0.0 108.108 166.13 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 98.6 mttt -56.15 -44.83 79.63 Favored 'General case' 0 N--CA 1.456 -0.165 0 C-N-CA 123.394 0.678 . . . . 0.0 112.187 -172.209 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 24.8 mt-10 -65.46 -46.84 78.23 Favored 'General case' 0 CA--C 1.521 -0.136 0 CA-C-O 121.116 0.484 . . . . 0.0 110.551 -173.56 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 2.0 mp0 -53.36 -51.32 62.85 Favored 'General case' 0 N--CA 1.451 -0.424 0 CA-C-N 115.734 -0.666 . . . . 0.0 109.257 174.089 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 8.6 mt -55.42 -42.17 73.77 Favored 'General case' 0 CA--C 1.511 -0.551 0 N-CA-C 113.646 0.98 . . . . 0.0 113.646 173.486 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 84.1 tttt -60.63 -56.67 18.54 Favored 'General case' 0 C--N 1.324 -0.533 0 N-CA-C 108.835 -0.802 . . . . 0.0 108.835 -178.291 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 4.2 mm? -58.37 -43.65 88.54 Favored 'General case' 0 C--N 1.328 -0.341 0 C-N-CA 120.887 -0.325 . . . . 0.0 110.92 -178.348 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 9.3 tt -51.99 -57.85 8.25 Favored 'General case' 0 CA--C 1.53 0.179 0 C-N-CA 123.533 0.733 . . . . 0.0 109.906 173.769 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 38.9 mt -54.46 -58.41 7.58 Favored 'General case' 0 C--N 1.332 -0.159 0 C-N-CA 123.739 0.816 . . . . 0.0 110.309 -178.596 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 23.8 mm100 -52.32 -55.01 24.32 Favored 'General case' 0 N--CA 1.453 -0.277 0 C-N-CA 124.603 1.161 . . . . 0.0 110.846 -176.96 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 11.9 m -74.42 -43.43 56.31 Favored 'General case' 0 N--CA 1.449 -0.479 0 CA-C-N 115.602 -0.727 . . . . 0.0 111.202 -169.558 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 71.8 mm-40 -100.1 -29.36 12.55 Favored 'General case' 0 N--CA 1.448 -0.572 0 N-CA-C 113.583 0.956 . . . . 0.0 113.583 -167.734 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 50.9 m-85 -137.53 63.07 39.36 Favored Pre-proline 0 C--O 1.234 0.276 0 N-CA-C 113.157 0.799 . . . . 0.0 113.157 -171.23 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 57.8 Cg_endo -59.57 -29.41 89.82 Favored 'Trans proline' 0 CA--C 1.539 0.744 0 C-N-CA 121.798 1.665 . . . . 0.0 109.726 169.343 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 1.3 m -62.46 -23.17 66.75 Favored 'General case' 0 N--CA 1.45 -0.44 0 C-N-CA 127.14 2.176 . . . . 0.0 111.561 178.423 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 43.3 mt -90.52 -53.14 4.56 Favored 'General case' 0 N--CA 1.449 -0.518 0 N-CA-C 108.788 -0.819 . . . . 0.0 108.788 169.508 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 27.8 tp -44.25 -50.83 8.73 Favored 'General case' 0 CA--C 1.528 0.101 0 C-N-CA 124.772 1.229 . . . . 0.0 112.592 -172.868 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 32.6 mtmm 20.83 -88.18 0.0 OUTLIER 'General case' 0 N--CA 1.449 -0.522 0 C-N-CA 128.308 2.643 . . . . 0.0 115.711 -179.226 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . -76.82 2.38 59.82 Favored Glycine 0 CA--C 1.532 1.1 0 C-N-CA 124.157 0.884 . . . . 0.0 114.226 -172.042 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 43' ' ' GLY . . . . . . . . . . . . . . . 77.73 -63.42 3.44 Favored Glycine 0 CA--C 1.525 0.717 0 CA-C-N 118.511 1.156 . . . . 0.0 111.356 176.747 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 44' ' ' SER . . . . . . . . . . . . . 46.2 t 52.25 -136.08 1.4 Allowed 'General case' 0 CA--C 1.535 0.385 0 N-CA-C 107.987 -1.116 . . . . 0.0 107.987 -169.608 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 58.3 p -130.5 143.88 51.04 Favored 'General case' 0 N--CA 1.451 -0.378 0 N-CA-C 107.452 -1.314 . . . . 0.0 107.452 167.448 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 22.7 mt -54.62 -42.02 70.69 Favored 'General case' 0 C--O 1.221 -0.438 0 N-CA-C 107.913 -1.143 . . . . 0.0 107.913 173.23 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 5.4 m-20 -53.28 -53.64 47.92 Favored 'General case' 0 N--CA 1.449 -0.521 0 C-N-CA 124.633 1.173 . . . . 0.0 111.66 176.901 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 19.9 tp10 -56.89 -52.06 66.65 Favored 'General case' 0 N--CA 1.456 -0.146 0 N-CA-C 110.403 -0.221 . . . . 0.0 110.403 177.513 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 3.9 mm? -56.08 -45.43 79.35 Favored 'General case' 0 C--O 1.225 -0.213 0 CA-C-O 120.969 0.414 . . . . 0.0 110.264 179.781 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 50' ' ' PHE . . . . . . . . . . . . . 64.9 t80 -58.86 -50.89 72.3 Favored 'General case' 0 N--CA 1.448 -0.533 0 C-N-CA 124.117 0.967 . . . . 0.0 110.084 -178.287 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 24.9 tp10 -59.46 -46.42 88.83 Favored 'General case' 0 N--CA 1.453 -0.306 0 N-CA-C 109.996 -0.372 . . . . 0.0 109.996 178.555 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 13.6 tm-20 -57.44 -44.24 84.54 Favored 'General case' 0 CA--C 1.531 0.231 0 C-N-CA 123.609 0.764 . . . . 0.0 110.493 -179.824 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 84.6 mt -72.09 -45.23 61.47 Favored 'General case' 0 N--CA 1.45 -0.429 0 C-N-CA 123.5 0.72 . . . . 0.0 111.568 -178.363 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 47.1 t0 -75.15 63.86 1.35 Allowed 'General case' 0 CA--C 1.533 0.319 0 C-N-CA 123.699 0.8 . . . . 0.0 110.697 -177.786 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 37.9 mmtm -54.11 -39.42 66.4 Favored 'General case' 0 N--CA 1.455 -0.182 0 C-N-CA 123.501 0.72 . . . . 0.0 112.473 -179.1 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 56' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -78.29 -5.11 51.07 Favored 'General case' 0 CA--C 1.535 0.387 0 N-CA-C 112.943 0.72 . . . . 0.0 112.943 -179.858 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . 61.57 35.87 91.76 Favored Glycine 0 CA--C 1.529 0.926 0 CA-C-O 119.368 -0.684 . . . . 0.0 113.825 172.682 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 1.7 p30 -78.22 -16.11 58.15 Favored 'General case' 0 CA--C 1.534 0.337 0 CA-C-N 118.827 1.314 . . . . 0.0 112.306 179.282 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . 103.92 2.5 45.79 Favored Glycine 0 CA--C 1.53 1.021 0 C-N-CA 124.187 0.899 . . . . 0.0 112.647 179.902 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 59.5 mt-10 -152.77 173.01 15.83 Favored 'General case' 0 CA--C 1.532 0.272 0 C-N-CA 128.126 2.57 . . . . 0.0 106.431 173.577 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 61' ' ' VAL . . . . . . . . . . . . . 8.9 t -108.93 109.54 28.71 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.446 0 CA-C-N 118.554 0.616 . . . . 0.0 110.78 -175.911 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 3.8 m -78.76 154.03 30.31 Favored 'General case' 0 CA--C 1.537 0.45 0 C-N-CA 123.296 0.638 . . . . 0.0 111.107 173.418 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 63' ' ' PHE . . . . . . . . . . . . . 69.7 t80 -51.13 -42.37 60.7 Favored 'General case' 0 CA--C 1.534 0.358 0 C-N-CA 123.524 0.73 . . . . 0.0 112.711 -173.334 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 12.6 pt-20 -59.18 -37.09 76.52 Favored 'General case' 0 CA--C 1.534 0.349 0 N-CA-C 112.746 0.647 . . . . 0.0 112.746 -178.565 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 18.7 pt-20 -91.23 -30.52 16.59 Favored 'General case' 0 CA--C 1.531 0.239 0 C-N-CA 123.091 0.557 . . . . 0.0 110.062 -179.087 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 7.9 t80 -49.97 -27.28 5.17 Favored 'General case' 0 CA--C 1.536 0.421 0 C-N-CA 123.86 0.864 . . . . 0.0 111.071 167.815 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 67' ' ' GLN . . . . . . . . . . . . . 68.9 mm-40 -49.55 -27.61 4.63 Favored 'General case' 0 CA--C 1.537 0.47 0 CA-C-N 119.259 0.936 . . . . 0.0 113.448 171.586 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 69.2 t -53.17 -32.25 18.81 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.58 0 O-C-N 121.368 -0.833 . . . . 0.0 111.368 172.613 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 8.5 tt -71.54 -42.69 67.59 Favored 'General case' 0 N--CA 1.455 -0.192 0 N-CA-C 107.946 -1.131 . . . . 0.0 107.946 178.806 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 70' ' ' VAL . . . . . . . . . . . . . 19.0 t -62.14 -43.03 97.31 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.286 0 N-CA-C 109.721 -0.474 . . . . 0.0 109.721 177.272 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 33.2 ttpt -53.9 -51.1 64.8 Favored 'General case' 0 N--CA 1.455 -0.224 0 C-N-CA 122.748 0.419 . . . . 0.0 110.364 171.598 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 13.7 mptt -53.15 -44.95 68.18 Favored 'General case' 0 CA--C 1.535 0.37 0 N-CA-C 112.608 0.596 . . . . 0.0 112.608 174.929 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 73' ' ' ILE . . . . . . . . . . . . . 88.6 mt -56.32 -50.73 70.24 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.439 0 N-CA-C 109.161 -0.681 . . . . 0.0 109.161 173.322 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 5.7 t 73.14 -62.31 0.47 Allowed 'General case' 0 CA--C 1.53 0.197 0 C-N-CA 126.09 1.756 . . . . 0.0 111.75 175.017 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 75' ' ' GLN . . . . . 0.828 ' OE1' ' OXT' ' A' ' 75' ' ' GLN . 0.7 OUTLIER . . . . . 0 C--O 1.27 2.164 0 C-N-CA 123.884 0.874 . . . . 0.0 109.274 179.148 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 1' ' ' LYS . . . . . . . . . . . . . 33.1 mmtp . . . . . 0 N--CA 1.451 -0.377 0 N-CA-C 108.207 -1.034 . . . . 0.0 108.207 . . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 56.6 p -78.92 158.27 75.31 Favored Pre-proline 0 CA--C 1.536 0.435 0 N-CA-C 109.191 -0.67 . . . . 0.0 109.191 175.318 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 97.1 Cg_exo -45.17 -41.29 16.59 Favored 'Trans proline' 0 N--CA 1.458 -0.598 0 C-N-CA 123.271 2.647 . . . . 0.0 112.821 172.392 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 3.0 mp0 -59.06 -49.84 76.34 Favored 'General case' 0 N--CA 1.456 -0.125 0 C-N-CA 123.54 0.736 . . . . 0.0 111.757 176.751 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 46.6 mm-40 -62.63 -43.15 99.53 Favored 'General case' 0 C--N 1.331 -0.204 0 N-CA-C 109.201 -0.666 . . . . 0.0 109.201 179.165 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 12.8 mt -60.34 -36.66 78.49 Favored 'General case' 0 N--CA 1.446 -0.664 0 CA-C-O 119.266 -0.397 . . . . 0.0 111.916 175.67 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 79.3 tttt -64.64 -45.07 88.38 Favored 'General case' 0 N--CA 1.448 -0.55 0 CA-C-N 118.813 0.733 . . . . 0.0 110.526 172.294 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . -52.8 -52.36 39.26 Favored Glycine 0 CA--C 1.53 1.028 0 N-CA-C 110.169 -1.172 . . . . 0.0 110.169 177.253 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 9' ' ' ILE . . . . . . . . . . . . . 15.1 mm -54.19 -58.25 4.12 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.198 0 C-N-CA 125.631 1.572 . . . . 0.0 109.391 173.848 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 10' ' ' PHE . . . . . . . . . . . . . 28.5 t80 -46.05 -51.11 14.3 Favored 'General case' 0 N--CA 1.448 -0.566 0 C-N-CA 123.173 0.589 . . . . 0.0 109.995 179.854 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 48.0 mt-10 -63.4 -49.94 71.81 Favored 'General case' 0 CA--C 1.53 0.195 0 C-N-CA 123.657 0.783 . . . . 0.0 111.037 -179.385 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 41.1 tttp -42.57 -51.16 5.24 Favored 'General case' 0 C--N 1.341 0.212 0 C-N-CA 124.635 1.174 . . . . 0.0 110.649 176.693 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 81.2 m-85 -78.79 -51.27 9.99 Favored 'General case' 0 N--CA 1.452 -0.348 0 CA-C-N 116.521 -0.309 . . . . 0.0 110.504 -178.78 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -56.93 -25.56 57.76 Favored 'General case' 0 N--CA 1.465 0.287 0 C-N-CA 126.347 1.859 . . . . 0.0 114.436 -174.46 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -81.58 -14.5 56.73 Favored 'General case' 0 N--CA 1.453 -0.318 0 CA-C-O 118.276 -0.868 . . . . 0.0 113.278 177.3 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 99.1 mttt -62.77 -57.74 9.86 Favored 'General case' 0 CA--C 1.531 0.248 0 CA-C-N 120.031 1.287 . . . . 0.0 110.174 -174.231 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -154.75 103.28 2.43 Favored 'General case' 0 N--CA 1.449 -0.484 0 CA-C-O 123.381 1.562 . . . . 0.0 111.187 167.7 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 158.99 -151.08 21.97 Favored Glycine 0 CA--C 1.525 0.67 0 N-CA-C 105.585 -3.006 . . . . 0.0 105.585 -169.036 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 11.7 t70 -115.51 146.64 37.06 Favored Pre-proline 0 C--O 1.224 -0.27 0 N-CA-C 106.351 -1.722 . . . . 0.0 106.351 169.767 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 20' ' ' PRO . . . . . . . . . . . . . 10.4 Cg_endo -50.15 -23.64 9.91 Favored 'Trans proline' 0 CA--C 1.542 0.902 0 C-N-CA 121.978 1.785 . . . . 0.0 114.546 176.92 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 38.9 m-80 -98.88 -1.96 38.85 Favored 'General case' 0 CA--C 1.538 0.486 0 C-N-CA 125.395 1.478 . . . . 0.0 112.827 -178.955 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 4.4 tp60 -145.22 116.84 8.1 Favored 'General case' 0 CA--C 1.55 0.964 0 C-N-CA 124.684 1.194 . . . . 0.0 112.42 -168.152 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 44.3 mt -91.71 128.83 37.7 Favored 'General case' 0 C--N 1.344 0.331 0 C-N-CA 124.592 1.157 . . . . 0.0 112.578 -175.354 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 98.3 p -79.4 167.71 20.48 Favored 'General case' 0 CA--C 1.537 0.462 0 C-N-CA 123.779 0.832 . . . . 0.0 109.316 167.665 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 97.4 mttt -54.79 -47.7 73.66 Favored 'General case' 0 C--N 1.339 0.141 0 O-C-N 121.866 -0.521 . . . . 0.0 111.342 -179.421 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 42.2 tt0 -61.41 -44.06 97.79 Favored 'General case' 0 N--CA 1.454 -0.234 0 CA-C-O 120.695 0.283 . . . . 0.0 110.729 -178.138 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 69.5 mt-10 -59.58 -48.8 80.25 Favored 'General case' 0 N--CA 1.448 -0.525 0 N-CA-C 109.717 -0.475 . . . . 0.0 109.717 177.329 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 7.5 mt -54.16 -42.53 69.71 Favored 'General case' 0 CA--C 1.511 -0.549 0 N-CA-C 113.084 0.772 . . . . 0.0 113.084 170.868 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 82.5 tttt -62.46 -50.1 72.81 Favored 'General case' 0 N--CA 1.448 -0.565 0 CA-C-N 118.68 0.673 . . . . 0.0 109.593 -177.304 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 79.1 mt -59.95 -45.43 92.66 Favored 'General case' 0 C--O 1.235 0.341 0 C-N-CA 122.725 0.41 . . . . 0.0 111.506 178.272 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 7.9 tt -53.63 -56.74 14.57 Favored 'General case' 0 N--CA 1.455 -0.188 0 C-N-CA 123.77 0.828 . . . . 0.0 109.169 174.851 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 50.2 mt -55.72 -51.08 68.56 Favored 'General case' 0 N--CA 1.454 -0.267 0 C-N-CA 123.813 0.845 . . . . 0.0 109.751 -178.569 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 35.5 mt-30 -49.51 -54.6 17.01 Favored 'General case' 0 N--CA 1.458 -0.032 0 C-N-CA 123.165 0.586 . . . . 0.0 111.236 176.982 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 6.0 m -70.71 -48.66 53.47 Favored 'General case' 0 N--CA 1.454 -0.267 0 CA-C-N 116.059 -0.519 . . . . 0.0 111.095 -170.93 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 19.6 mm-40 -97.57 -37.34 9.98 Favored 'General case' 0 N--CA 1.45 -0.445 0 C-N-CA 123.759 0.824 . . . . 0.0 113.131 -167.339 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 27.0 m-85 -139.8 65.66 31.89 Favored Pre-proline 0 CA--C 1.536 0.411 0 C-N-CA 122.93 0.492 . . . . 0.0 112.155 -168.744 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 41.5 Cg_endo -61.39 -27.67 83.04 Favored 'Trans proline' 0 N--CA 1.457 -0.669 0 C-N-CA 122.728 2.285 . . . . 0.0 111.779 -178.882 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 2.7 p -55.23 -52.64 62.74 Favored 'General case' 0 N--CA 1.45 -0.451 0 C-N-CA 124.591 1.156 . . . . 0.0 109.36 172.719 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 93.5 mt -72.99 -29.36 62.99 Favored 'General case' 0 N--CA 1.449 -0.517 0 CA-C-N 115.163 -0.926 . . . . 0.0 111.434 179.667 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 15.5 tp -55.38 -50.79 68.79 Favored 'General case' 0 C--N 1.34 0.175 0 CA-C-N 118.485 0.584 . . . . 0.0 109.979 170.506 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 74.1 mmtt -59.63 -60.6 3.58 Favored 'General case' 0 N--CA 1.45 -0.464 0 N-CA-C 108.906 -0.776 . . . . 0.0 108.906 173.739 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . 70.24 -62.02 0.8 Allowed Glycine 0 CA--C 1.531 1.053 0 C-N-CA 125.272 1.415 . . . . 0.0 114.687 168.826 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 43' ' ' GLY . . . . . . . . . . . . . . . 121.21 -77.23 0.33 Allowed Glycine 0 CA--C 1.522 0.479 0 N-CA-C 105.228 -3.149 . . . . 0.0 105.228 -169.011 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 44' ' ' SER . . . . . . . . . . . . . 1.6 m -63.79 141.01 58.93 Favored 'General case' 0 N--CA 1.451 -0.399 0 N-CA-C 108.036 -1.098 . . . . 0.0 108.036 168.221 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 27.4 p -77.74 169.71 17.82 Favored 'General case' 0 C--O 1.234 0.261 0 CA-C-N 118.2 0.454 . . . . 0.0 111.008 -171.252 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 65.1 tp -42.58 -45.67 4.65 Favored 'General case' 0 C--O 1.223 -0.297 0 C-N-CA 125.331 1.452 . . . . 0.0 111.982 178.471 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 6.7 m-20 -58.09 -51.2 70.69 Favored 'General case' 0 N--CA 1.452 -0.369 0 C-N-CA 123.306 0.643 . . . . 0.0 111.392 179.276 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 3.2 mp0 -60.44 -46.93 88.28 Favored 'General case' 0 N--CA 1.457 -0.116 0 N-CA-C 109.983 -0.377 . . . . 0.0 109.983 177.955 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 94.5 mt -56.73 -46.19 81.49 Favored 'General case' 0 C--O 1.225 -0.236 0 N-CA-C 109.946 -0.39 . . . . 0.0 109.946 178.66 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 50' ' ' PHE . . . . . . . . . . . . . 68.7 t80 -57.23 -51.88 67.58 Favored 'General case' 0 N--CA 1.45 -0.446 0 C-N-CA 124.034 0.934 . . . . 0.0 110.457 179.561 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 53.5 mm-40 -57.39 -48.2 79.7 Favored 'General case' 0 CA--C 1.532 0.275 0 CA-C-O 120.594 0.235 . . . . 0.0 110.98 176.559 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 47.5 tp10 -55.3 -44.4 75.7 Favored 'General case' 0 CA--C 1.53 0.204 0 C-N-CA 123.759 0.824 . . . . 0.0 110.865 179.43 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 85.2 mt -69.32 -46.64 66.59 Favored 'General case' 0 N--CA 1.449 -0.5 0 C-N-CA 123.213 0.605 . . . . 0.0 110.923 179.902 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 55.2 t0 -75.51 62.75 1.42 Allowed 'General case' 0 CA--C 1.535 0.402 0 C-N-CA 123.548 0.739 . . . . 0.0 110.57 179.309 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 25.8 mmtm -47.06 -48.09 22.52 Favored 'General case' 0 CA--C 1.528 0.122 0 C-N-CA 124.881 1.272 . . . . 0.0 112.482 179.342 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 56' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -75.9 -6.12 49.36 Favored 'General case' 0 CA--C 1.537 0.451 0 N-CA-C 112.881 0.697 . . . . 0.0 112.881 -177.473 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . 61.33 37.77 94.59 Favored Glycine 0 CA--C 1.528 0.847 0 C-N-CA 123.905 0.764 . . . . 0.0 113.306 171.525 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 2.2 p30 -77.53 -25.29 50.07 Favored 'General case' 0 N--CA 1.455 -0.216 0 CA-C-N 118.36 1.08 . . . . 0.0 111.755 -179.992 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . 127.51 -20.01 5.87 Favored Glycine 0 CA--C 1.525 0.661 0 CA-C-O 118.626 -1.097 . . . . 0.0 112.649 179.778 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . 0.343 0.2 OUTLIER -153.13 149.63 28.25 Favored 'General case' 0 CA--C 1.537 0.469 0 CA-C-N 119.041 1.421 . . . . 0.0 110.735 175.089 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 61' ' ' VAL . . . . . . . . . . . . . 13.6 t -77.23 122.53 32.02 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.42 0 N-CA-C 113.921 1.082 . . . . 0.0 113.921 -164.096 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -77.96 152.09 33.34 Favored 'General case' 0 CA--C 1.536 0.406 0 C-N-CA 123.838 0.855 . . . . 0.0 110.942 174.053 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 63' ' ' PHE . . . . . . . . . . . . . 59.7 t80 -53.81 -31.24 48.38 Favored 'General case' 0 N--CA 1.47 0.566 0 N-CA-C 113.862 1.06 . . . . 0.0 113.862 176.771 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 28.8 mp0 -68.65 -63.52 1.04 Allowed 'General case' 0 N--CA 1.453 -0.318 0 O-C-N 121.581 -0.7 . . . . 0.0 109.112 -179.977 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 18.5 pt-20 -62.27 -28.37 69.67 Favored 'General case' 0 CA--C 1.539 0.522 0 O-C-N 121.274 -0.891 . . . . 0.0 111.828 -179.631 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 12.7 t80 -50.01 -27.54 5.64 Favored 'General case' 0 CA--C 1.534 0.342 0 C-N-CA 123.662 0.785 . . . . 0.0 112.622 169.304 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 67' ' ' GLN . . . . . . . . . . . . . 71.6 mm-40 -55.4 -22.09 18.43 Favored 'General case' 0 CA--C 1.543 0.706 0 CA-C-N 119.812 1.187 . . . . 0.0 112.901 173.925 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 72.5 t -53.23 -29.15 15.65 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.589 0 O-C-N 120.98 -1.075 . . . . 0.0 111.175 169.889 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 18.7 tp -70.91 -42.06 70.42 Favored 'General case' 0 N--CA 1.452 -0.331 0 N-CA-C 107.872 -1.158 . . . . 0.0 107.872 177.438 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 70' ' ' VAL . . . . . . . . . . . . . 24.2 t -62.54 -39.83 85.96 Favored 'Isoleucine or valine' 0 N--CA 1.456 -0.169 0 N-CA-C 109.863 -0.421 . . . . 0.0 109.863 177.077 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 69.9 tttt -53.36 -52.01 60.63 Favored 'General case' 0 CA--C 1.531 0.238 0 O-C-N 122.247 -0.283 . . . . 0.0 110.703 169.925 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 14.3 mptt -55.65 -42.49 75.11 Favored 'General case' 0 CA--C 1.535 0.395 0 N-CA-C 112.083 0.401 . . . . 0.0 112.083 175.568 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 73' ' ' ILE . . . . . . . . . . . . . 94.4 mt -59.61 -58.64 6.2 Favored 'Isoleucine or valine' 0 N--CA 1.462 0.164 0 N-CA-C 109.788 -0.449 . . . . 0.0 109.788 177.103 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 26.2 m -168.54 73.42 0.1 Allowed 'General case' 0 CA--C 1.53 0.185 0 C-N-CA 124.828 1.251 . . . . 0.0 110.097 -171.383 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 75' ' ' GLN . . . . . 0.915 ' NE2' ' OXT' ' A' ' 75' ' ' GLN . 0.0 OUTLIER . . . . . 0 C--O 1.27 2.165 0 O-C-N 121.932 -0.48 . . . . 0.0 109.998 169.14 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 1' ' ' LYS . . . . . 1.04 ' O ' ' OXT' ' A' ' 75' ' ' GLN . 29.0 mtmm . . . . . 0 N--CA 1.451 -0.398 0 N-CA-C 108.52 -0.918 . . . . 0.0 108.52 . . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 84.3 p -68.35 160.85 73.6 Favored Pre-proline 0 CA--C 1.534 0.332 0 C-N-CA 123.62 0.768 . . . . 0.0 111.116 -172.037 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 88.1 Cg_exo -47.58 -37.6 26.96 Favored 'Trans proline' 0 N--CA 1.456 -0.685 0 C-N-CA 122.935 2.424 . . . . 0.0 112.107 168.46 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 40.0 tt0 -63.62 -47.03 83.02 Favored 'General case' 0 N--CA 1.456 -0.164 0 C-N-CA 123.327 0.651 . . . . 0.0 111.293 177.129 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 25.9 mt-10 -60.46 -47.53 85.74 Favored 'General case' 0 N--CA 1.454 -0.241 0 N-CA-C 108.48 -0.933 . . . . 0.0 108.48 176.997 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 17.9 mt -57.75 -37.7 74.08 Favored 'General case' 0 N--CA 1.45 -0.462 0 C-N-CA 123.639 0.776 . . . . 0.0 111.947 178.127 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 21.1 tptm -62.4 -51.84 65.96 Favored 'General case' 0 C--N 1.332 -0.188 0 CA-C-N 118.728 0.695 . . . . 0.0 111.089 171.986 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . -53.95 -50.61 54.16 Favored Glycine 0 CA--C 1.531 1.035 0 N-CA-C 110.136 -1.186 . . . . 0.0 110.136 -179.811 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 9' ' ' ILE . . . . . . . . . . . . . 69.3 mt -55.01 -53.63 32.1 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.385 0 C-N-CA 125.772 1.629 . . . . 0.0 110.27 174.053 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 10' ' ' PHE . . . . . . . . . . . . . 41.0 t80 -49.17 -52.76 24.55 Favored 'General case' 0 N--CA 1.45 -0.457 0 N-CA-C 109.208 -0.664 . . . . 0.0 109.208 179.153 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 50.0 mt-10 -58.91 -50.9 72.3 Favored 'General case' 0 N--CA 1.453 -0.292 0 C-N-CA 122.898 0.479 . . . . 0.0 110.289 -179.468 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 41.0 tttm -48.63 -59.76 3.26 Favored 'General case' 0 CA--C 1.532 0.268 0 C-N-CA 123.462 0.705 . . . . 0.0 111.243 176.879 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 57.8 m-85 -76.57 -30.01 56.87 Favored 'General case' 0 C--O 1.224 -0.26 0 O-C-N 121.913 -0.492 . . . . 0.0 110.946 -169.955 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -66.2 -46.52 77.01 Favored 'General case' 0 N--CA 1.453 -0.275 0 O-C-N 121.932 -0.48 . . . . 0.0 110.259 173.878 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -63.78 -31.94 73.28 Favored 'General case' 0 C--N 1.333 -0.128 0 C-N-CA 123.545 0.738 . . . . 0.0 111.572 176.987 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 9.6 ttpp -61.32 91.27 0.03 OUTLIER 'General case' 0 N--CA 1.451 -0.421 0 N-CA-C 108.962 -0.755 . . . . 0.0 108.962 175.896 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 30.5 mt-10 77.53 -41.49 0.36 Allowed 'General case' 0 CA--C 1.531 0.242 0 C-N-CA 127.425 2.29 . . . . 0.0 112.303 176.715 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . -75.75 -171.93 31.71 Favored Glycine 0 CA--C 1.528 0.9 0 CA-C-O 121.779 0.655 . . . . 0.0 111.992 178.348 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 9.7 t70 -84.59 135.57 40.62 Favored Pre-proline 0 N--CA 1.454 -0.271 0 N-CA-C 107.4 -1.333 . . . . 0.0 107.4 171.412 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 20' ' ' PRO . . . . . . . . . . . . . 13.3 Cg_endo -51.52 -23.9 15.64 Favored 'Trans proline' 0 CA--C 1.535 0.525 0 C-N-CA 123.462 2.775 . . . . 0.0 114.893 -178.389 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 46.4 m-80 -90.39 -2.29 57.96 Favored 'General case' 0 N--CA 1.452 -0.358 0 C-N-CA 123.9 0.88 . . . . 0.0 112.583 -177.257 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 43.6 tt0 -155.79 122.67 5.32 Favored 'General case' 0 CA--C 1.539 0.553 0 CA-C-N 119.799 1.181 . . . . 0.0 113.432 -167.677 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 56.8 mt -89.05 133.16 34.46 Favored 'General case' 0 CA--C 1.532 0.281 0 C-N-CA 124.252 1.021 . . . . 0.0 112.055 -178.682 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 45.1 p -78.27 172.46 13.55 Favored 'General case' 0 CA--C 1.535 0.377 0 C-N-CA 123.534 0.734 . . . . 0.0 109.413 167.676 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 98.0 mttt -57.97 -45.91 85.99 Favored 'General case' 0 C--O 1.226 -0.177 0 O-C-N 121.746 -0.596 . . . . 0.0 109.752 174.34 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 2.0 mp0 -62.57 -48.29 80.12 Favored 'General case' 0 CA--C 1.516 -0.345 0 CA-C-O 121.194 0.521 . . . . 0.0 109.948 -177.311 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 34.2 mt-10 -56.29 -47.37 78.79 Favored 'General case' 0 N--CA 1.449 -0.487 0 CA-C-N 115.467 -0.788 . . . . 0.0 109.661 177.104 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 11.0 mt -55.16 -44.83 75.55 Favored 'General case' 0 CA--C 1.512 -0.496 0 N-CA-C 113.051 0.76 . . . . 0.0 113.051 170.003 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 62.5 tttm -61.73 -48.9 78.64 Favored 'General case' 0 C--N 1.324 -0.533 0 CA-C-N 118.732 0.697 . . . . 0.0 110.019 -176.093 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 4.2 mm? -61.53 -46.07 91.52 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.375 -0.375 . . . . 0.0 111.056 178.142 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 6.0 tt -49.87 -59.17 4.1 Favored 'General case' 0 C--N 1.333 -0.127 0 C-N-CA 123.648 0.779 . . . . 0.0 109.332 173.859 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 49.4 mt -55.78 -58.26 8.58 Favored 'General case' 0 N--CA 1.454 -0.265 0 C-N-CA 123.563 0.745 . . . . 0.0 109.817 -177.738 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 30.0 tt0 -50.97 -52.2 45.03 Favored 'General case' 0 N--CA 1.452 -0.349 0 C-N-CA 124.361 1.064 . . . . 0.0 111.438 -177.807 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 16.3 m -74.54 -49.31 22.4 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.235 -0.439 . . . . 0.0 110.861 -171.26 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 70.8 mm-40 -89.5 -31.99 17.4 Favored 'General case' 0 N--CA 1.449 -0.483 0 C-N-CA 122.7 0.4 . . . . 0.0 111.77 -169.4 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 76.4 m-85 -133.84 64.32 66.59 Favored Pre-proline 0 CA--C 1.535 0.366 0 C-N-CA 124.268 1.027 . . . . 0.0 110.235 -175.541 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 44.5 Cg_endo -60.31 -21.83 68.53 Favored 'Trans proline' 0 N--CA 1.457 -0.649 0 C-N-CA 122.995 2.463 . . . . 0.0 111.867 -178.434 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -63.54 -35.42 80.42 Favored 'General case' 0 N--CA 1.451 -0.406 0 C-N-CA 124.2 1.0 . . . . 0.0 110.297 174.798 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 84.3 mt -90.52 -49.29 6.58 Favored 'General case' 0 N--CA 1.451 -0.398 0 C-N-CA 124.879 1.272 . . . . 0.0 110.298 -176.619 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 59.8 tp 51.2 -73.76 0.01 OUTLIER 'General case' 0 CA--C 1.533 0.324 0 C-N-CA 127.381 2.273 . . . . 0.0 115.174 173.844 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 99.3 mttt -63.85 -40.95 97.78 Favored 'General case' 0 N--CA 1.451 -0.391 0 C-N-CA 124.36 1.064 . . . . 0.0 109.527 169.891 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . 123.21 -53.67 0.73 Allowed Glycine 0 C--N 1.336 0.55 0 C-N-CA 125.967 1.746 . . . . 0.0 108.741 -176.482 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 43' ' ' GLY . . . . . . . . . . . . . . . 174.19 -66.76 0.11 Allowed Glycine 0 C--N 1.332 0.356 0 N-CA-C 105.975 -2.85 . . . . 0.0 105.975 176.208 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 44' ' ' SER . . . . . . . . . . . . . 5.3 p -77.46 176.45 8.87 Favored 'General case' 0 N--CA 1.446 -0.664 0 N-CA-C 107.296 -1.372 . . . . 0.0 107.296 166.682 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 1.9 p -62.91 148.87 46.08 Favored 'General case' 0 N--CA 1.452 -0.337 0 N-CA-C 109.271 -0.64 . . . . 0.0 109.271 171.898 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 62.6 tp -50.49 -45.81 56.59 Favored 'General case' 0 C--O 1.227 -0.084 0 C-N-CA 124.001 0.92 . . . . 0.0 112.606 -169.935 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 5.9 m-20 -57.87 -56.62 19.66 Favored 'General case' 0 N--CA 1.451 -0.415 0 CA-C-O 121.408 0.623 . . . . 0.0 110.129 178.899 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 70.0 mm-40 -54.23 -47.35 72.28 Favored 'General case' 0 N--CA 1.453 -0.323 0 CA-C-N 115.911 -0.586 . . . . 0.0 110.222 178.555 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 6.2 tp -52.8 -53.5 47.55 Favored 'General case' 0 C--O 1.224 -0.283 0 C-N-CA 123.096 0.558 . . . . 0.0 109.921 176.172 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 50' ' ' PHE . . . . . . . . . . . . . 63.1 t80 -52.6 -51.35 60.34 Favored 'General case' 0 N--CA 1.453 -0.299 0 C-N-CA 124.232 1.013 . . . . 0.0 110.486 -179.194 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 2.2 mp0 -56.18 -50.03 72.35 Favored 'General case' 0 CA--C 1.533 0.31 0 CA-C-O 120.529 0.204 . . . . 0.0 111.18 174.89 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 34.6 mt-10 -55.62 -41.75 73.95 Favored 'General case' 0 CA--C 1.531 0.217 0 C-N-CA 123.024 0.53 . . . . 0.0 111.673 179.983 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 76.4 mt -67.04 -54.9 17.16 Favored 'General case' 0 N--CA 1.449 -0.523 0 C-N-CA 122.921 0.488 . . . . 0.0 110.339 177.689 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 11.4 t70 -75.2 79.35 2.33 Favored 'General case' 0 N--CA 1.453 -0.296 0 CA-C-O 121.627 0.727 . . . . 0.0 109.332 -179.136 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 39.9 mmtm -65.08 89.6 0.08 Allowed 'General case' 0 N--CA 1.451 -0.408 0 CA-C-O 121.982 0.896 . . . . 0.0 110.709 173.911 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 56' ' ' ASN . . . . . . . . . . . . 0.264 0.0 OUTLIER 40.83 46.4 2.32 Favored 'General case' 0 C--N 1.325 -0.48 0 C-N-CA 128.87 2.868 . . . . 0.0 114.05 178.703 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . -87.61 -90.53 1.05 Allowed Glycine 0 C--N 1.337 0.608 0 N-CA-C 107.783 -2.127 . . . . 0.0 107.783 171.575 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 6.9 p-10 -137.01 -42.51 0.58 Allowed 'General case' 0 N--CA 1.446 -0.654 0 C-N-CA 125.206 1.402 . . . . 0.0 111.577 -177.986 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . 149.0 -65.9 0.39 Allowed Glycine 0 CA--C 1.523 0.577 0 N-CA-C 108.522 -1.831 . . . . 0.0 108.522 -171.071 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 39.7 mt-10 -74.53 133.73 42.27 Favored 'General case' 0 N--CA 1.455 -0.204 0 N-CA-C 107.615 -1.254 . . . . 0.0 107.615 -174.695 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 61' ' ' VAL . . . . . . . . . . . . . 3.8 t -88.77 111.24 22.35 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.308 0 N-CA-C 112.754 0.65 . . . . 0.0 112.754 -163.913 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 34.3 m -79.45 162.36 25.51 Favored 'General case' 0 CA--C 1.533 0.326 0 C-N-CA 123.094 0.558 . . . . 0.0 111.989 169.876 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 63' ' ' PHE . . . . . . . . . . . . . 57.7 t80 -54.2 -37.89 65.05 Favored 'General case' 0 N--CA 1.464 0.257 0 N-CA-C 113.388 0.885 . . . . 0.0 113.388 -169.568 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 25.3 mp0 -65.39 -57.69 7.72 Favored 'General case' 0 N--CA 1.451 -0.404 0 N-CA-C 109.081 -0.711 . . . . 0.0 109.081 -176.565 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 17.1 pt-20 -61.43 -36.49 80.5 Favored 'General case' 0 CA--C 1.541 0.623 0 O-C-N 121.823 -0.548 . . . . 0.0 111.347 177.478 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 14.6 t80 -52.76 -26.12 13.29 Favored 'General case' 0 CA--C 1.537 0.474 0 C-N-CA 123.943 0.897 . . . . 0.0 112.335 169.922 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 67' ' ' GLN . . . . . . . . . . . . . 60.3 mm-40 -54.82 -23.17 17.06 Favored 'General case' 0 CA--C 1.534 0.337 0 CA-C-N 119.83 1.195 . . . . 0.0 113.077 173.356 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 98.6 t -55.89 -33.76 35.77 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.516 0 CA-C-N 119.341 0.973 . . . . 0.0 110.528 171.526 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 22.5 tp -74.12 -49.92 21.77 Favored 'General case' 0 N--CA 1.455 -0.203 0 N-CA-C 107.754 -1.202 . . . . 0.0 107.754 177.264 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 70' ' ' VAL . . . . . . . . . . . . . 58.9 t -50.55 -42.3 21.59 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.408 0 C-N-CA 123.642 0.777 . . . . 0.0 110.472 179.63 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -51.54 -57.75 8.2 Favored 'General case' 0 N--CA 1.455 -0.204 0 C-N-CA 123.446 0.699 . . . . 0.0 111.053 173.022 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 4.5 mptp? -55.17 -43.5 74.37 Favored 'General case' 0 CA--C 1.534 0.333 0 C-N-CA 122.568 0.347 . . . . 0.0 111.853 176.624 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 73' ' ' ILE . . . . . . . . . . . . . 57.7 mt -58.99 -37.22 66.3 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.375 0 N-CA-C 109.942 -0.392 . . . . 0.0 109.942 175.668 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 25.5 t 60.3 32.18 20.66 Favored 'General case' 0 C--O 1.235 0.313 0 C-N-CA 125.379 1.472 . . . . 0.0 110.408 -174.408 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 75' ' ' GLN . . . . . 1.04 ' OXT' ' O ' ' A' ' 1' ' ' LYS . 4.3 tp-100 . . . . . 0 C--O 1.269 2.109 0 C-N-CA 125.996 1.718 . . . . 0.0 106.612 178.04 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 1' ' ' LYS . . . . . . . . . . . . . 31.8 mtmt . . . . . 0 N--CA 1.452 -0.342 0 N-CA-C 108.561 -0.903 . . . . 0.0 108.561 . . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 81.0 p -62.67 157.1 60.63 Favored Pre-proline 0 CA--C 1.532 0.269 0 C-N-CA 122.736 0.414 . . . . 0.0 110.477 -176.287 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 76.3 Cg_exo -48.51 -36.44 31.34 Favored 'Trans proline' 0 N--CA 1.453 -0.856 0 C-N-CA 122.455 2.103 . . . . 0.0 111.821 168.968 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 44.9 mt-10 -62.46 -53.07 60.31 Favored 'General case' 0 CA--C 1.531 0.234 0 C-N-CA 123.807 0.843 . . . . 0.0 111.327 176.77 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 28.7 mt-10 -55.28 -46.85 76.18 Favored 'General case' 0 C--N 1.335 -0.057 0 CA-C-O 121.599 0.714 . . . . 0.0 109.19 176.37 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 58.9 mt -60.65 -35.75 76.98 Favored 'General case' 0 N--CA 1.446 -0.626 0 C-N-CA 124.118 0.967 . . . . 0.0 112.757 178.344 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER -62.24 -47.95 82.11 Favored 'General case' 0 N--CA 1.454 -0.254 0 CA-C-N 119.031 0.832 . . . . 0.0 109.633 170.629 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . -53.75 -52.02 45.07 Favored Glycine 0 CA--C 1.532 1.106 0 N-CA-C 110.698 -0.961 . . . . 0.0 110.698 177.316 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 9' ' ' ILE . . . . . . . . . . . . . 24.0 mm -55.45 -54.45 25.18 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.235 0 C-N-CA 125.341 1.457 . . . . 0.0 109.775 175.152 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 10' ' ' PHE . . . . . . . . . . . . . 34.4 t80 -47.56 -50.75 23.08 Favored 'General case' 0 N--CA 1.45 -0.45 0 C-N-CA 123.445 0.698 . . . . 0.0 109.878 178.872 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 57.7 mt-10 -61.97 -53.14 59.73 Favored 'General case' 0 CA--C 1.53 0.173 0 C-N-CA 122.59 0.356 . . . . 0.0 110.781 178.385 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 39.4 tttm -44.0 -49.64 8.56 Favored 'General case' 0 CA--C 1.527 0.092 0 C-N-CA 124.986 1.314 . . . . 0.0 111.022 178.624 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 57.6 m-85 -78.38 -52.41 8.62 Favored 'General case' 0 N--CA 1.45 -0.437 0 CA-C-O 119.409 -0.329 . . . . 0.0 110.613 -177.64 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -48.01 -60.65 2.45 Favored 'General case' 0 C--N 1.331 -0.199 0 C-N-CA 124.083 0.953 . . . . 0.0 111.043 -179.444 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -55.14 -20.29 9.78 Favored 'General case' 0 CA--C 1.529 0.167 0 C-N-CA 125.148 1.379 . . . . 0.0 113.051 -177.411 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 10.8 ttmm -62.54 -24.52 67.56 Favored 'General case' 0 CA--C 1.535 0.385 0 CA-C-N 118.247 0.476 . . . . 0.0 111.079 -179.657 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 12.2 tm-20 -154.62 -47.48 0.09 Allowed 'General case' 0 C--N 1.341 0.219 0 CA-C-N 118.211 0.459 . . . . 0.0 111.406 -179.877 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . -79.38 175.21 55.13 Favored Glycine 0 CA--C 1.526 0.741 0 N-CA-C 110.526 -1.03 . . . . 0.0 110.526 -179.664 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 8.1 t70 -62.43 140.86 96.6 Favored Pre-proline 0 CA--C 1.535 0.403 0 N-CA-C 107.149 -1.426 . . . . 0.0 107.149 169.216 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 20' ' ' PRO . . . . . . . . . . . . . 12.0 Cg_endo -51.13 -24.87 15.64 Favored 'Trans proline' 0 CA--C 1.536 0.583 0 C-N-CA 123.087 2.525 . . . . 0.0 114.533 -178.042 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 51.8 m-80 -88.58 2.9 52.17 Favored 'General case' 0 CA--C 1.536 0.429 0 C-N-CA 124.77 1.228 . . . . 0.0 113.105 -179.611 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -149.38 116.43 6.01 Favored 'General case' 0 CA--C 1.541 0.619 0 CA-C-N 119.187 0.903 . . . . 0.0 112.683 -169.039 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 77.9 mt -88.2 134.3 33.82 Favored 'General case' 0 CA--C 1.532 0.288 0 C-N-CA 124.563 1.145 . . . . 0.0 111.095 173.654 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 27.5 p -80.38 178.73 8.1 Favored 'General case' 0 CA--C 1.534 0.341 0 N-CA-C 108.543 -0.91 . . . . 0.0 108.543 166.389 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 64.4 mttp -57.98 -38.95 77.01 Favored 'General case' 0 N--CA 1.455 -0.218 0 N-CA-C 109.806 -0.442 . . . . 0.0 109.806 170.127 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 1.8 mp0 -67.95 -50.74 54.13 Favored 'General case' 0 N--CA 1.45 -0.433 0 C-N-CA 122.883 0.473 . . . . 0.0 110.035 -175.755 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 3.0 mp0 -55.79 -44.77 78.1 Favored 'General case' 0 N--CA 1.452 -0.361 0 C-N-CA 119.826 -0.75 . . . . 0.0 110.236 174.87 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 12.7 mt -56.85 -43.43 81.13 Favored 'General case' 0 CA--C 1.513 -0.454 0 CA-C-N 119.067 0.849 . . . . 0.0 113.153 171.798 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 64.5 tttm -60.31 -48.76 80.38 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-N 118.505 0.593 . . . . 0.0 109.679 -178.444 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 87.2 mt -60.16 -47.47 85.8 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.179 -0.464 . . . . 0.0 111.375 178.166 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 7.6 tt -51.99 -57.64 8.87 Favored 'General case' 0 N--CA 1.456 -0.143 0 C-N-CA 124.175 0.99 . . . . 0.0 109.497 175.721 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 47.6 mt -56.0 -54.24 47.21 Favored 'General case' 0 C--O 1.223 -0.298 0 N-CA-C 108.717 -0.845 . . . . 0.0 108.717 -178.54 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 28.3 tt0 -53.65 -49.77 67.21 Favored 'General case' 0 N--CA 1.451 -0.387 0 C-N-CA 123.777 0.831 . . . . 0.0 111.652 -176.296 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 2.1 m -73.75 -52.76 12.1 Favored 'General case' 0 CA--C 1.531 0.223 0 C-N-CA 120.684 -0.407 . . . . 0.0 110.984 -175.546 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 57.3 mm-40 -87.22 -31.91 20.06 Favored 'General case' 0 N--CA 1.448 -0.555 0 C-N-CA 123.183 0.593 . . . . 0.0 112.426 -166.595 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 74.5 m-85 -145.19 64.16 10.64 Favored Pre-proline 0 CA--C 1.534 0.335 0 C-N-CA 123.425 0.69 . . . . 0.0 111.604 -172.341 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 33.5 Cg_endo -58.59 -30.5 92.18 Favored 'Trans proline' 0 N--CA 1.456 -0.73 0 C-N-CA 122.346 2.031 . . . . 0.0 111.538 -177.969 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 10.4 t -65.07 -32.99 74.98 Favored 'General case' 0 N--CA 1.456 -0.152 0 O-C-N 121.7 -0.625 . . . . 0.0 109.91 177.362 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 79.1 mt -82.05 -30.05 31.59 Favored 'General case' 0 N--CA 1.451 -0.382 0 CA-C-O 118.966 -0.54 . . . . 0.0 110.543 177.051 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 13.9 tp -55.55 -51.99 65.24 Favored 'General case' 0 CA--C 1.53 0.201 0 N-CA-C 108.762 -0.829 . . . . 0.0 108.762 169.191 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 35.7 mmtp -64.71 -50.5 66.71 Favored 'General case' 0 N--CA 1.452 -0.346 0 C-N-CA 122.924 0.49 . . . . 0.0 111.365 178.419 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . -54.09 -48.12 64.41 Favored Glycine 0 CA--C 1.528 0.86 0 C-N-CA 124.257 0.932 . . . . 0.0 111.443 -179.378 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 43' ' ' GLY . . . . . . . . . . . . . . . -74.9 63.76 2.37 Favored Glycine 0 CA--C 1.526 0.766 0 N-CA-C 110.061 -1.216 . . . . 0.0 110.061 173.911 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 44' ' ' SER . . . . . . . . . . . . . 27.4 p -26.54 -59.49 0.08 Allowed 'General case' 0 C--N 1.339 0.143 0 C-N-CA 127.933 2.493 . . . . 0.0 112.996 -177.025 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 14.2 p -109.78 134.4 52.06 Favored 'General case' 0 N--CA 1.448 -0.531 0 C-N-CA 124.203 1.001 . . . . 0.0 109.515 170.062 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 19.5 mt -73.26 -46.86 47.48 Favored 'General case' 0 CA--C 1.517 -0.316 0 C-N-CA 124.181 0.992 . . . . 0.0 108.658 -173.25 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 3.4 m-20 -50.3 -44.89 54.23 Favored 'General case' 0 N--CA 1.453 -0.29 0 C-N-CA 125.261 1.425 . . . . 0.0 111.528 -176.219 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 5.9 mp0 -59.57 -48.21 82.53 Favored 'General case' 0 C--N 1.328 -0.327 0 C-N-CA 123.702 0.801 . . . . 0.0 110.468 176.907 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 1.3 tt -58.64 -50.96 71.94 Favored 'General case' 0 CA--C 1.534 0.335 0 CA-C-O 121.824 0.821 . . . . 0.0 109.264 177.573 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 50' ' ' PHE . . . . . . . . . . . . . 52.4 t80 -51.55 -50.55 59.83 Favored 'General case' 0 N--CA 1.452 -0.336 0 C-N-CA 124.778 1.231 . . . . 0.0 110.537 178.246 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 27.0 tp10 -60.81 -43.54 98.06 Favored 'General case' 0 N--CA 1.454 -0.253 0 C-N-CA 122.879 0.472 . . . . 0.0 110.587 177.528 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 12.8 tm-20 -54.61 -43.27 72.05 Favored 'General case' 0 CA--C 1.533 0.316 0 C-N-CA 122.763 0.425 . . . . 0.0 110.756 177.079 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 92.1 mt -68.28 -64.42 0.87 Allowed 'General case' 0 N--CA 1.452 -0.341 0 C-N-CA 122.698 0.399 . . . . 0.0 110.918 175.486 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 18.2 t0 -97.25 95.68 7.89 Favored 'General case' 0 N--CA 1.455 -0.202 0 C-N-CA 124.466 1.106 . . . . 0.0 109.438 178.935 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 74.1 mmtt -70.43 79.52 0.56 Allowed 'General case' 0 N--CA 1.454 -0.259 0 CA-C-O 121.794 0.807 . . . . 0.0 110.454 172.464 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 56' ' ' ASN . . . . . . . . . . . . . 16.8 p-10 28.92 48.81 0.03 OUTLIER 'General case' 0 C--N 1.327 -0.402 0 C-N-CA 130.635 3.574 . . . . 0.0 113.013 -179.543 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . -83.54 -83.0 0.93 Allowed Glycine 0 CA--C 1.524 0.622 0 N-CA-C 109.245 -1.542 . . . . 0.0 109.245 179.445 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 12.5 p-10 -91.63 -22.29 20.36 Favored 'General case' 0 N--CA 1.453 -0.279 0 C-N-CA 124.32 1.048 . . . . 0.0 111.428 179.225 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . 93.61 9.48 60.01 Favored Glycine 0 CA--C 1.53 1.021 0 CA-C-O 119.019 -0.878 . . . . 0.0 112.835 177.916 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 31.7 mt-10 -146.13 173.11 12.49 Favored 'General case' 0 N--CA 1.456 -0.14 0 C-N-CA 127.059 2.144 . . . . 0.0 106.722 172.831 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 61' ' ' VAL . . . . . . . . . . . . . 65.5 t -109.92 103.05 14.87 Favored 'Isoleucine or valine' 0 CA--C 1.529 0.137 0 CA-C-N 118.184 0.447 . . . . 0.0 110.231 -169.164 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 11.9 t -78.81 170.96 15.86 Favored 'General case' 0 CA--C 1.535 0.374 0 CA-C-O 121.16 0.505 . . . . 0.0 111.383 172.52 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 63' ' ' PHE . . . . . . . . . . . . . 57.3 t80 -63.85 -39.58 94.54 Favored 'General case' 0 C--O 1.232 0.137 0 C-N-CA 122.713 0.405 . . . . 0.0 111.332 -173.062 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 50.2 mt-10 -61.4 -58.39 8.41 Favored 'General case' 0 N--CA 1.452 -0.359 0 O-C-N 122.088 -0.383 . . . . 0.0 110.025 -178.745 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 10.8 pt-20 -61.27 -36.4 79.94 Favored 'General case' 0 CA--C 1.537 0.458 0 O-C-N 121.707 -0.621 . . . . 0.0 111.547 178.574 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 24.7 t80 -52.97 -26.68 15.98 Favored 'General case' 0 CA--C 1.54 0.562 0 O-C-N 121.313 -0.867 . . . . 0.0 112.585 169.777 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 67' ' ' GLN . . . . . . . . . . . . . 40.2 mm-40 -54.81 -25.64 29.67 Favored 'General case' 0 CA--C 1.537 0.463 0 CA-C-N 119.819 1.191 . . . . 0.0 112.926 173.051 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 96.5 t -54.58 -32.69 25.53 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.605 0 CA-C-N 118.685 0.675 . . . . 0.0 110.458 172.238 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -77.16 -50.28 13.34 Favored 'General case' 0 N--CA 1.455 -0.211 0 C-N-CA 124.684 1.193 . . . . 0.0 108.696 172.931 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 70' ' ' VAL . . . . . . . . . . . . . 98.0 t -50.64 -45.32 26.69 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.314 0 O-C-N 121.861 -0.525 . . . . 0.0 111.702 -177.674 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 16.1 pttp -60.1 -38.86 84.21 Favored 'General case' 0 CA--C 1.53 0.185 0 O-C-N 121.733 -0.604 . . . . 0.0 111.609 179.24 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 72' ' ' LYS . . . . . . . . . . . . 0.282 0.1 OUTLIER -68.21 -42.03 80.44 Favored 'General case' 0 N--CA 1.441 -0.91 0 C-N-CA 125.551 1.54 . . . . 0.0 108.703 -179.966 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 73' ' ' ILE . . . . . . . . . . . . . 49.0 mm -58.42 -47.46 87.96 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.289 0 CA-C-N 118.722 0.692 . . . . 0.0 109.913 171.635 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 74' ' ' SER . . . . . 0.451 ' C ' ' OXT' ' A' ' 75' ' ' GLN . 19.6 m -61.93 -40.44 95.51 Favored 'General case' 0 CA--C 1.53 0.197 0 C-N-CA 123.312 0.645 . . . . 0.0 111.251 -177.485 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 75' ' ' GLN . . . . . 0.451 ' OXT' ' C ' ' A' ' 74' ' ' SER . 60.6 tt0 . . . . . 0 C--O 1.271 2.204 0 C-N-CA 124.902 1.281 . . . . 0.0 110.893 178.611 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 1' ' ' LYS . . . . . . . . . . . . . 39.4 mmtm . . . . . 0 N--CA 1.45 -0.429 0 N-CA-C 107.793 -1.188 . . . . 0.0 107.793 . . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 99.5 p -77.19 158.79 79.21 Favored Pre-proline 0 CA--C 1.534 0.332 0 N-CA-C 108.739 -0.837 . . . . 0.0 108.739 171.248 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 88.6 Cg_exo -48.4 -39.73 35.99 Favored 'Trans proline' 0 N--CA 1.458 -0.587 0 C-N-CA 122.623 2.216 . . . . 0.0 112.58 169.999 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 48.4 mt-10 -60.93 -50.23 74.24 Favored 'General case' 0 C--O 1.232 0.177 0 C-N-CA 123.335 0.654 . . . . 0.0 110.841 177.357 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 45.1 mm-40 -59.58 -46.01 90.18 Favored 'General case' 0 N--CA 1.453 -0.281 0 N-CA-C 108.794 -0.817 . . . . 0.0 108.794 178.008 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 25.6 mt -57.9 -40.1 79.5 Favored 'General case' 0 N--CA 1.445 -0.703 0 CA-C-O 118.653 -0.689 . . . . 0.0 112.333 178.235 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 20.6 tptm -59.5 -52.33 66.02 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 119.506 1.048 . . . . 0.0 110.168 171.94 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . -49.89 -53.84 20.63 Favored Glycine 0 CA--C 1.536 1.372 0 N-CA-C 111.699 -0.561 . . . . 0.0 111.699 177.927 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 9' ' ' ILE . . . . . . . . . . . . . 1.6 mm -53.7 -56.4 9.08 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.163 0 C-N-CA 127.007 2.123 . . . . 0.0 108.825 175.826 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 10' ' ' PHE . . . . . . . . . . . . . 24.0 t80 -49.36 -50.53 39.56 Favored 'General case' 0 N--CA 1.444 -0.732 0 C-N-CA 123.406 0.683 . . . . 0.0 109.374 -179.27 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 53.1 mt-10 -62.41 -48.07 81.31 Favored 'General case' 0 N--CA 1.453 -0.29 0 C-N-CA 123.196 0.598 . . . . 0.0 110.833 -179.147 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 37.1 tttm -44.2 -51.45 8.18 Favored 'General case' 0 CA--C 1.529 0.163 0 C-N-CA 124.006 0.923 . . . . 0.0 111.002 177.207 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 85.1 m-85 -79.38 -49.28 12.61 Favored 'General case' 0 CA--C 1.535 0.376 0 CA-C-O 120.546 0.212 . . . . 0.0 111.12 -177.245 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -55.67 -39.02 70.39 Favored 'General case' 0 N--CA 1.464 0.243 0 C-N-CA 124.532 1.133 . . . . 0.0 112.558 -177.428 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -50.42 -31.34 14.72 Favored 'General case' 0 CA--C 1.532 0.279 0 C-N-CA 123.411 0.684 . . . . 0.0 111.807 175.794 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 7.9 mtmp? -69.58 -30.4 68.17 Favored 'General case' 0 CA--C 1.535 0.395 0 CA-C-N 118.181 0.446 . . . . 0.0 111.388 -179.805 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 49.0 mm-40 -70.4 -48.08 57.82 Favored 'General case' 0 C--N 1.342 0.263 0 N-CA-C 107.961 -1.126 . . . . 0.0 107.961 168.179 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 145.04 -62.98 0.47 Allowed Glycine 0 C--O 1.227 -0.282 0 N-CA-C 108.983 -1.647 . . . . 0.0 108.983 175.916 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 35.1 t0 -65.83 110.68 4.88 Favored Pre-proline 0 CA--C 1.534 0.358 0 CA-C-O 118.548 -0.739 . . . . 0.0 109.117 178.185 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 20' ' ' PRO . . . . . . . . . . . . . 32.8 Cg_endo -59.5 -21.54 62.22 Favored 'Trans proline' 0 N--CA 1.456 -0.725 0 C-N-CA 121.95 1.766 . . . . 0.0 112.414 -178.547 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 41.9 m-80 -85.42 -5.02 59.33 Favored 'General case' 0 N--CA 1.452 -0.331 0 C-N-CA 124.526 1.13 . . . . 0.0 113.205 -174.167 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 27.8 tt0 -142.91 126.34 16.72 Favored 'General case' 0 CA--C 1.543 0.679 0 CA-C-N 119.513 1.051 . . . . 0.0 113.823 -169.553 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 70.4 mt -103.94 138.27 40.75 Favored 'General case' 0 C--N 1.345 0.393 0 C-N-CA 125.451 1.5 . . . . 0.0 112.15 -179.413 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 77.9 p -80.56 172.76 13.34 Favored 'General case' 0 C--O 1.234 0.259 0 C-N-CA 123.966 0.906 . . . . 0.0 109.722 168.021 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 98.3 mttt -55.41 -45.07 76.71 Favored 'General case' 0 C--O 1.226 -0.172 0 N-CA-C 110.169 -0.308 . . . . 0.0 110.169 172.045 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 22.9 mt-10 -65.85 -46.99 76.45 Favored 'General case' 0 CA--C 1.516 -0.336 0 CA-C-O 120.785 0.326 . . . . 0.0 110.559 -175.96 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -61.67 -39.92 93.12 Favored 'General case' 0 C--N 1.327 -0.374 0 C-N-CA 120.062 -0.655 . . . . 0.0 110.056 177.844 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 13.5 mt -57.47 -47.59 81.45 Favored 'General case' 0 C--O 1.218 -0.593 0 CA-C-N 119.346 0.975 . . . . 0.0 111.897 168.554 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 38.4 ttpt -58.08 -47.26 83.75 Favored 'General case' 0 C--N 1.323 -0.582 0 CA-C-N 119.002 0.819 . . . . 0.0 110.077 -175.95 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 3.7 mm? -59.59 -48.04 83.2 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.351 -0.386 . . . . 0.0 111.475 175.498 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 7.9 tt -51.23 -57.49 8.67 Favored 'General case' 0 N--CA 1.456 -0.136 0 C-N-CA 123.563 0.745 . . . . 0.0 109.896 176.061 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 48.0 mt -57.93 -51.2 70.62 Favored 'General case' 0 C--O 1.223 -0.292 0 N-CA-C 109.546 -0.539 . . . . 0.0 109.546 -179.247 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 17.5 tt0 -54.67 -44.15 73.05 Favored 'General case' 0 N--CA 1.452 -0.344 0 O-C-N 121.744 -0.597 . . . . 0.0 111.755 -176.598 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 2.1 m -77.85 -49.03 15.07 Favored 'General case' 0 CA--C 1.534 0.36 0 C-N-CA 120.92 -0.312 . . . . 0.0 111.316 -177.611 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 67.1 mm-40 -96.79 -27.9 14.52 Favored 'General case' 0 N--CA 1.451 -0.383 0 N-CA-C 114.015 1.117 . . . . 0.0 114.015 -165.716 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 97.9 m-85 -145.33 70.21 14.19 Favored Pre-proline 0 CA--C 1.538 0.513 0 C-N-CA 124.559 1.144 . . . . 0.0 112.2 -176.592 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 88.9 Cg_exo -47.91 -34.7 23.03 Favored 'Trans proline' 0 N--CA 1.459 -0.544 0 C-N-CA 123.178 2.585 . . . . 0.0 112.944 171.204 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 3.0 p -54.86 -56.65 17.18 Favored 'General case' 0 N--CA 1.45 -0.467 0 C-N-CA 125.151 1.38 . . . . 0.0 109.594 176.758 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 81.4 mt -62.26 -41.1 98.15 Favored 'General case' 0 N--CA 1.449 -0.478 0 CA-C-N 115.334 -0.848 . . . . 0.0 111.04 177.588 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 12.8 tp -53.61 -48.58 69.17 Favored 'General case' 0 CA--C 1.531 0.243 0 CA-C-N 118.183 0.447 . . . . 0.0 110.32 176.268 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 95.3 mttt -74.09 -49.23 24.91 Favored 'General case' 0 N--CA 1.45 -0.427 0 C-N-CA 123.532 0.733 . . . . 0.0 112.678 -174.638 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . -121.26 0.85 11.53 Favored Glycine 0 CA--C 1.528 0.847 0 N-CA-C 115.624 1.01 . . . . 0.0 115.624 -168.283 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 43' ' ' GLY . . . . . . . . . . . . . . . -76.69 65.35 2.86 Favored Glycine 0 CA--C 1.527 0.784 0 CA-C-N 119.055 1.428 . . . . 0.0 110.337 179.46 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 44' ' ' SER . . . . . . . . . . . . . 25.8 t 55.1 -146.59 0.56 Allowed 'General case' 0 CA--C 1.535 0.367 0 C-N-CA 123.801 0.84 . . . . 0.0 108.98 -169.576 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 22.0 p -110.98 146.16 37.14 Favored 'General case' 0 N--CA 1.454 -0.267 0 N-CA-C 106.929 -1.508 . . . . 0.0 106.929 169.005 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 66.9 tp -51.88 -46.94 64.69 Favored 'General case' 0 C--O 1.225 -0.192 0 C-N-CA 123.431 0.692 . . . . 0.0 112.274 -169.509 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 6.2 m-20 -59.21 -51.51 69.66 Favored 'General case' 0 N--CA 1.45 -0.431 0 C-N-CA 123.017 0.527 . . . . 0.0 110.829 -179.54 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 38.1 mm-40 -61.41 -43.96 97.96 Favored 'General case' 0 N--CA 1.453 -0.317 0 CA-C-N 116.291 -0.413 . . . . 0.0 110.394 -179.905 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 67.0 tp -56.99 -50.65 72.05 Favored 'General case' 0 N--CA 1.451 -0.38 0 N-CA-C 109.431 -0.581 . . . . 0.0 109.431 175.724 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 50' ' ' PHE . . . . . . . . . . . . . 65.4 t80 -54.06 -50.85 65.82 Favored 'General case' 0 N--CA 1.45 -0.439 0 C-N-CA 123.806 0.842 . . . . 0.0 110.508 -178.982 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 59.0 mm-40 -58.22 -47.51 83.27 Favored 'General case' 0 CA--C 1.532 0.267 0 CA-C-O 120.629 0.252 . . . . 0.0 111.151 175.683 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 40.7 tt0 -55.28 -40.3 70.87 Favored 'General case' 0 CA--C 1.531 0.238 0 C-N-CA 123.526 0.73 . . . . 0.0 111.338 179.279 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 84.3 mt -77.18 -49.28 15.52 Favored 'General case' 0 N--CA 1.448 -0.567 0 C-N-CA 122.99 0.516 . . . . 0.0 111.492 -179.341 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 43.8 t0 -74.9 59.74 0.92 Allowed 'General case' 0 CA--C 1.536 0.409 0 C-N-CA 123.828 0.851 . . . . 0.0 111.586 -175.799 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 16.4 mmtp -62.21 -33.72 75.11 Favored 'General case' 0 N--CA 1.456 -0.162 0 C-N-CA 123.54 0.736 . . . . 0.0 111.965 -178.104 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 56' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -74.95 -8.15 55.67 Favored 'General case' 0 CA--C 1.536 0.426 0 N-CA-C 112.355 0.502 . . . . 0.0 112.355 175.868 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . 63.17 36.63 93.7 Favored Glycine 0 CA--C 1.527 0.831 0 C-N-CA 123.724 0.678 . . . . 0.0 113.458 172.01 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 1.6 p30 -78.42 -13.1 59.99 Favored 'General case' 0 CA--C 1.534 0.344 0 CA-C-N 118.697 1.248 . . . . 0.0 112.362 179.198 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . 100.27 -0.72 55.93 Favored Glycine 0 CA--C 1.53 1.016 0 C-N-CA 123.821 0.724 . . . . 0.0 112.368 179.172 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 42.0 mt-10 -147.47 170.95 16.32 Favored 'General case' 0 N--CA 1.452 -0.338 0 C-N-CA 127.626 2.371 . . . . 0.0 106.137 173.528 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 61' ' ' VAL . . . . . . . . . . . . . 16.1 t -102.32 116.22 45.61 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.149 0 N-CA-C 108.807 -0.812 . . . . 0.0 108.807 -179.028 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 78.3 p -79.99 156.67 27.08 Favored 'General case' 0 CA--C 1.537 0.458 0 C-N-CA 122.934 0.493 . . . . 0.0 111.248 174.966 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 63' ' ' PHE . . . . . . . . . . . . . 77.2 t80 -56.11 -32.88 64.59 Favored 'General case' 0 N--CA 1.467 0.383 0 N-CA-C 113.31 0.856 . . . . 0.0 113.31 -178.361 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 13.0 tp10 -65.42 -62.45 1.52 Allowed 'General case' 0 N--CA 1.453 -0.288 0 O-C-N 121.882 -0.511 . . . . 0.0 109.624 178.495 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 12.0 pt-20 -64.97 -27.15 68.64 Favored 'General case' 0 CA--C 1.54 0.578 0 O-C-N 121.182 -0.948 . . . . 0.0 111.553 -177.023 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 15.5 t80 -50.97 -27.53 7.86 Favored 'General case' 0 CA--C 1.534 0.33 0 C-N-CA 123.499 0.72 . . . . 0.0 112.176 168.828 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 67' ' ' GLN . . . . . . . . . . . . . 66.8 mm-40 -53.88 -24.29 15.45 Favored 'General case' 0 CA--C 1.54 0.559 0 CA-C-N 119.814 1.188 . . . . 0.0 113.058 173.314 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 97.2 t -57.06 -31.26 36.46 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.631 0 O-C-N 121.043 -1.036 . . . . 0.0 111.24 171.796 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 7.5 tt -71.93 -44.22 63.99 Favored 'General case' 0 N--CA 1.457 -0.094 0 N-CA-C 107.721 -1.214 . . . . 0.0 107.721 177.959 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 70' ' ' VAL . . . . . . . . . . . . . 18.2 t -60.06 -42.77 90.94 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.286 0 N-CA-C 109.804 -0.443 . . . . 0.0 109.804 178.07 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 55.0 tttm -51.59 -57.48 9.01 Favored 'General case' 0 N--CA 1.454 -0.241 0 N-CA-C 109.668 -0.493 . . . . 0.0 109.668 170.028 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 5.0 mptp? -49.4 -44.71 45.33 Favored 'General case' 0 CA--C 1.533 0.302 0 C-N-CA 123.317 0.647 . . . . 0.0 112.575 177.95 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 73' ' ' ILE . . . . . . . . . . . . . 58.0 mt -58.79 -55.53 22.56 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.226 0 N-CA-C 109.59 -0.522 . . . . 0.0 109.59 174.327 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 98.8 p -61.25 -45.24 95.34 Favored 'General case' 0 CA--C 1.53 0.189 0 N-CA-C 112.143 0.424 . . . . 0.0 112.143 -170.003 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 75' ' ' GLN . . . . . . . . . . . . . 16.3 pt20 . . . . . 0 C--O 1.27 2.154 0 O-C-N 122.148 -0.345 . . . . 0.0 110.137 -179.128 . . . . . . . . 0 0 . 1 . 011 nuclear orig full ' A' A ' 1' ' ' LYS . . . . . . . . . . . . . 74.6 mmtt . . . . . 0 N--CA 1.45 -0.434 0 N-CA-C 108.493 -0.928 . . . . 0.0 108.493 . . . . . . . . . 0 0 . 1 . 011 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 84.6 p -69.0 154.64 94.85 Favored Pre-proline 0 CA--C 1.534 0.365 0 N-CA-C 109.711 -0.477 . . . . 0.0 109.711 175.89 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 84.8 Cg_exo -47.38 -36.71 23.8 Favored 'Trans proline' 0 N--CA 1.456 -0.71 0 C-N-CA 122.761 2.307 . . . . 0.0 112.364 169.256 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 44.7 mt-10 -62.71 -48.94 77.06 Favored 'General case' 0 CA--C 1.529 0.162 0 C-N-CA 123.657 0.783 . . . . 0.0 111.395 176.652 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 29.0 mt-10 -60.11 -46.46 89.55 Favored 'General case' 0 C--N 1.332 -0.164 0 N-CA-C 109.148 -0.686 . . . . 0.0 109.148 177.18 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 27.4 mt -60.29 -39.34 86.55 Favored 'General case' 0 N--CA 1.447 -0.585 0 C-N-CA 123.031 0.532 . . . . 0.0 111.953 179.087 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 19.7 tptm -58.86 -49.12 78.92 Favored 'General case' 0 C--N 1.332 -0.175 0 O-C-N 121.678 -0.639 . . . . 0.0 110.046 170.029 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . -51.66 -50.68 41.87 Favored Glycine 0 CA--C 1.529 0.941 0 N-CA-C 110.401 -1.08 . . . . 0.0 110.401 178.686 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 9' ' ' ILE . . . . . . . . . . . . . 24.4 mm -57.6 -54.95 24.52 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.252 0 C-N-CA 125.324 1.45 . . . . 0.0 109.894 175.795 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 10' ' ' PHE . . . . . . . . . . . . . 25.6 t80 -48.36 -50.84 28.97 Favored 'General case' 0 N--CA 1.446 -0.673 0 O-C-N 121.747 -0.596 . . . . 0.0 109.673 179.815 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 43.6 mt-10 -64.4 -46.69 82.21 Favored 'General case' 0 N--CA 1.453 -0.298 0 CA-C-O 118.687 -0.673 . . . . 0.0 111.429 179.596 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 29.2 ttmt -43.37 -53.3 5.41 Favored 'General case' 0 N--CA 1.464 0.24 0 C-N-CA 124.072 0.949 . . . . 0.0 110.469 175.947 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 80.3 m-85 -78.86 -47.84 15.82 Favored 'General case' 0 N--CA 1.451 -0.392 0 CA-C-N 116.544 -0.298 . . . . 0.0 110.829 -175.346 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -56.75 -45.48 81.99 Favored 'General case' 0 CA--C 1.533 0.32 0 CA-C-O 121.654 0.74 . . . . 0.0 112.1 -177.919 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -53.33 -30.39 38.96 Favored 'General case' 0 CA--C 1.53 0.193 0 C-N-CA 123.96 0.904 . . . . 0.0 111.777 175.967 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 15.4 ttmm -63.15 -33.86 76.38 Favored 'General case' 0 CA--C 1.533 0.302 0 CA-C-N 117.835 0.289 . . . . 0.0 110.484 178.864 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 6.0 tp10 -73.94 -49.18 25.87 Favored 'General case' 0 C--N 1.341 0.209 0 N-CA-C 108.572 -0.899 . . . . 0.0 108.572 171.355 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 153.63 -63.68 0.36 Allowed Glycine 0 CA--C 1.521 0.421 0 N-CA-C 109.701 -1.36 . . . . 0.0 109.701 175.081 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 43.9 t0 -67.52 113.8 16.04 Favored Pre-proline 0 CA--C 1.533 0.306 0 CA-C-O 118.304 -0.855 . . . . 0.0 109.26 -179.9 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 20' ' ' PRO . . . . . . . . . . . . . 29.3 Cg_endo -61.52 -20.0 66.87 Favored 'Trans proline' 0 N--CA 1.456 -0.702 0 C-N-CA 121.91 1.74 . . . . 0.0 113.124 179.505 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 43.1 m-80 -89.81 -6.14 56.22 Favored 'General case' 0 CA--C 1.531 0.228 0 C-N-CA 124.539 1.136 . . . . 0.0 113.601 -170.571 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 30.0 tt0 -148.09 126.35 12.24 Favored 'General case' 0 CA--C 1.541 0.606 0 CA-C-N 119.39 0.995 . . . . 0.0 112.492 -168.138 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 51.2 mt -103.31 135.88 44.13 Favored 'General case' 0 C--N 1.344 0.361 0 C-N-CA 125.295 1.438 . . . . 0.0 111.117 -178.649 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 7.0 p -88.6 178.06 6.61 Favored 'General case' 0 C--O 1.236 0.376 0 N-CA-C 108.475 -0.935 . . . . 0.0 108.475 167.162 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 99.1 mttt -54.16 -43.65 70.77 Favored 'General case' 0 N--CA 1.454 -0.231 0 C-N-CA 122.991 0.516 . . . . 0.0 111.299 -179.754 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 34.3 tt0 -65.84 -46.38 78.73 Favored 'General case' 0 N--CA 1.456 -0.14 0 O-C-N 121.995 -0.441 . . . . 0.0 110.602 -175.636 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 4.1 mp0 -58.39 -45.31 88.57 Favored 'General case' 0 N--CA 1.453 -0.322 0 N-CA-C 109.474 -0.565 . . . . 0.0 109.474 176.609 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 18.9 mt -57.39 -42.02 81.37 Favored 'General case' 0 CA--C 1.512 -0.489 0 C-N-CA 120.288 -0.565 . . . . 0.0 112.262 173.279 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 25.3 ttpp -61.71 -50.96 70.34 Favored 'General case' 0 N--CA 1.447 -0.582 0 CA-C-N 118.725 0.693 . . . . 0.0 109.479 -178.113 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 83.3 mt -59.83 -46.02 90.56 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-O 120.847 0.356 . . . . 0.0 111.398 178.972 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 8.0 tt -53.31 -55.92 20.78 Favored 'General case' 0 C--N 1.332 -0.168 0 C-N-CA 124.002 0.921 . . . . 0.0 109.518 174.695 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 38.4 mt -54.14 -54.39 40.24 Favored 'General case' 0 C--O 1.226 -0.178 0 C-N-CA 123.517 0.727 . . . . 0.0 109.689 -179.412 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 41.2 mt-30 -51.32 -51.84 50.68 Favored 'General case' 0 N--CA 1.457 -0.087 0 C-N-CA 122.954 0.502 . . . . 0.0 111.432 179.249 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 7.0 m -70.19 -53.95 14.93 Favored 'General case' 0 N--CA 1.455 -0.205 0 CA-C-N 116.485 -0.325 . . . . 0.0 111.149 -172.483 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 42.5 mm-40 -94.05 -34.84 12.85 Favored 'General case' 0 N--CA 1.45 -0.438 0 N-CA-C 113.134 0.79 . . . . 0.0 113.134 -167.671 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 17.3 m-85 -133.05 56.41 21.77 Favored Pre-proline 0 CA--C 1.53 0.209 0 C-N-CA 122.626 0.37 . . . . 0.0 111.82 -170.571 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 56.5 Cg_endo -60.57 -27.96 85.77 Favored 'Trans proline' 0 N--CA 1.453 -0.904 0 C-N-CA 122.211 1.941 . . . . 0.0 110.619 -178.974 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -57.7 -32.4 67.34 Favored 'General case' 0 N--CA 1.451 -0.424 0 C-N-CA 125.853 1.661 . . . . 0.0 111.083 -179.202 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 49.7 mt -72.5 -27.5 62.3 Favored 'General case' 0 N--CA 1.45 -0.44 0 C-N-CA 123.016 0.526 . . . . 0.0 111.007 178.229 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 85.3 mt -81.88 69.77 8.64 Favored 'General case' 0 N--CA 1.456 -0.132 0 CA-C-O 123.85 1.786 . . . . 0.0 110.718 -179.095 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -114.94 -151.63 0.49 Allowed 'General case' 0 N--CA 1.437 -1.091 0 C-N-CA 128.848 2.859 . . . . 0.0 105.946 169.592 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . -75.18 52.45 2.57 Favored Glycine 0 CA--C 1.531 1.077 0 O-C-N 121.037 -1.039 . . . . 0.0 111.166 171.633 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 43' ' ' GLY . . . . . . . . . . . . . . . -78.65 60.57 4.06 Favored Glycine 0 CA--C 1.525 0.689 0 N-CA-C 109.999 -1.24 . . . . 0.0 109.999 -177.077 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 44' ' ' SER . . . . . . . . . . . . . 54.3 p 52.22 -102.46 0.13 Allowed 'General case' 0 N--CA 1.442 -0.85 0 C-N-CA 125.8 1.64 . . . . 0.0 110.84 -170.227 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 76.3 p -143.59 159.85 41.71 Favored 'General case' 0 N--CA 1.453 -0.277 0 N-CA-C 106.941 -1.503 . . . . 0.0 106.941 168.836 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 56.8 tp -51.89 -43.83 63.51 Favored 'General case' 0 C--O 1.224 -0.265 0 CA-C-O 120.781 0.324 . . . . 0.0 110.254 170.056 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 5.5 m-20 -56.88 -55.48 33.92 Favored 'General case' 0 N--CA 1.452 -0.325 0 C-N-CA 124.271 1.028 . . . . 0.0 111.313 177.571 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 31.1 mm-40 -59.08 -42.83 91.38 Favored 'General case' 0 C--N 1.331 -0.213 0 O-C-N 122.222 -0.299 . . . . 0.0 111.119 178.692 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 59.1 tp -59.19 -47.42 85.37 Favored 'General case' 0 CA--C 1.531 0.233 0 CA-C-O 121.207 0.527 . . . . 0.0 110.055 176.485 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 50' ' ' PHE . . . . . . . . . . . . . 59.7 t80 -55.03 -49.35 71.78 Favored 'General case' 0 N--CA 1.452 -0.371 0 C-N-CA 123.914 0.885 . . . . 0.0 109.888 178.989 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 78.3 mm-40 -59.2 -46.07 89.4 Favored 'General case' 0 N--CA 1.455 -0.209 0 CA-C-O 120.443 0.163 . . . . 0.0 111.42 175.11 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 36.8 tt0 -52.14 -45.08 64.87 Favored 'General case' 0 CA--C 1.531 0.224 0 C-N-CA 122.735 0.414 . . . . 0.0 111.016 177.651 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 96.4 mt -68.68 -59.58 3.01 Favored 'General case' 0 N--CA 1.451 -0.393 0 C-N-CA 122.982 0.513 . . . . 0.0 110.846 177.655 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 12.0 t0 -113.34 100.14 8.33 Favored 'General case' 0 N--CA 1.455 -0.202 0 C-N-CA 125.648 1.579 . . . . 0.0 110.136 178.209 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 30.6 mmmt -73.67 78.32 1.52 Allowed 'General case' 0 N--CA 1.455 -0.191 0 CA-C-O 122.462 1.125 . . . . 0.0 110.499 174.699 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 56' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER 39.85 38.28 0.44 Allowed 'General case' 0 C--N 1.323 -0.579 0 C-N-CA 130.135 3.374 . . . . 0.0 114.532 179.661 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . -78.97 -80.72 0.74 Allowed Glycine 0 CA--C 1.525 0.677 0 N-CA-C 109.933 -1.267 . . . . 0.0 109.933 -179.8 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 14.2 p-10 -88.61 -8.24 55.03 Favored 'General case' 0 CA--C 1.535 0.369 0 C-N-CA 124.256 1.023 . . . . 0.0 111.644 177.514 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . 69.22 26.54 74.54 Favored Glycine 0 CA--C 1.528 0.875 0 N-CA-C 111.484 -0.647 . . . . 0.0 111.484 -179.315 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 25.6 mt-10 -160.54 175.09 13.11 Favored 'General case' 0 N--CA 1.453 -0.299 0 C-N-CA 128.203 2.601 . . . . 0.0 105.829 -179.826 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 61' ' ' VAL . . . . . . . . . . . . . 98.7 t -113.68 110.2 31.27 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.248 0 N-CA-C 108.924 -0.769 . . . . 0.0 108.924 -179.248 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 4.6 m -79.23 163.21 25.16 Favored 'General case' 0 CA--C 1.535 0.39 0 C-N-CA 124.699 1.2 . . . . 0.0 110.648 174.126 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 63' ' ' PHE . . . . . . . . . . . . . 64.9 t80 -58.48 -34.63 71.1 Favored 'General case' 0 N--CA 1.466 0.33 0 N-CA-C 113.084 0.772 . . . . 0.0 113.084 -177.563 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 12.7 tp10 -65.17 -60.63 2.79 Favored 'General case' 0 CA--C 1.533 0.32 0 O-C-N 121.931 -0.481 . . . . 0.0 109.896 178.255 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 9.9 pt-20 -61.83 -30.9 71.14 Favored 'General case' 0 CA--C 1.539 0.52 0 O-C-N 121.376 -0.827 . . . . 0.0 111.679 -178.506 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 20.6 t80 -51.35 -30.53 18.97 Favored 'General case' 0 CA--C 1.535 0.396 0 O-C-N 121.462 -0.774 . . . . 0.0 112.476 169.019 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 67' ' ' GLN . . . . . . . . . . . . . 77.9 mm-40 -55.52 -23.52 26.77 Favored 'General case' 0 CA--C 1.537 0.461 0 CA-C-N 119.723 1.147 . . . . 0.0 112.769 174.224 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 90.7 t -60.35 -33.09 52.67 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.563 0 CA-C-N 119.512 1.051 . . . . 0.0 110.789 172.068 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 3.2 tm? -72.71 -49.69 29.57 Favored 'General case' 0 N--CA 1.457 -0.085 0 N-CA-C 106.997 -1.483 . . . . 0.0 106.997 -179.35 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 70' ' ' VAL . . . . . . . . . . . . . 22.0 t -55.24 -45.26 77.5 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.406 0 C-N-CA 122.845 0.458 . . . . 0.0 109.982 176.705 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 5.1 ttpm? -54.65 -54.41 42.03 Favored 'General case' 0 N--CA 1.452 -0.327 0 C-N-CA 122.911 0.484 . . . . 0.0 110.328 173.961 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 12.6 mptt -48.7 -46.06 40.03 Favored 'General case' 0 CA--C 1.535 0.391 0 N-CA-C 112.457 0.54 . . . . 0.0 112.457 176.124 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 73' ' ' ILE . . . . . . . . . . . . . 71.2 mt -50.25 -38.06 14.89 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.532 0 CA-C-O 119.157 -0.449 . . . . 0.0 110.857 176.941 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 74' ' ' SER . . . . . 0.555 ' O ' ' OXT' ' A' ' 75' ' ' GLN . 61.0 p 45.27 -94.6 0.02 OUTLIER 'General case' 0 CA--C 1.532 0.287 0 C-N-CA 126.224 1.81 . . . . 0.0 113.145 170.437 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 75' ' ' GLN . . . . . 0.555 ' OXT' ' O ' ' A' ' 74' ' ' SER . 17.7 tt0 . . . . . 0 C--O 1.27 2.181 0 C-N-CA 125.251 1.421 . . . . 0.0 111.015 178.266 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 1' ' ' LYS . . . . . . . . . . . . . 30.2 mmtp . . . . . 0 N--CA 1.45 -0.474 0 N-CA-C 108.31 -0.996 . . . . 0.0 108.31 . . . . . . . . . 0 0 . 1 . 012 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 99.6 p -79.72 157.24 74.64 Favored Pre-proline 0 CA--C 1.533 0.291 0 N-CA-C 109.032 -0.729 . . . . 0.0 109.032 174.988 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 86.2 Cg_exo -48.05 -39.76 33.33 Favored 'Trans proline' 0 N--CA 1.458 -0.616 0 C-N-CA 122.958 2.438 . . . . 0.0 112.015 169.498 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 48.9 mt-10 -62.2 -49.43 75.81 Favored 'General case' 0 N--CA 1.455 -0.191 0 C-N-CA 123.534 0.734 . . . . 0.0 111.105 177.578 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 2.4 tm-20 -62.4 -43.33 99.08 Favored 'General case' 0 CA--C 1.531 0.215 0 N-CA-C 108.414 -0.958 . . . . 0.0 108.414 -179.483 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 31.7 mt -59.99 -39.85 87.15 Favored 'General case' 0 N--CA 1.45 -0.475 0 C-N-CA 124.245 1.018 . . . . 0.0 111.732 176.827 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 54.8 tptt -59.35 -50.46 73.87 Favored 'General case' 0 C--N 1.333 -0.14 0 CA-C-N 118.986 0.812 . . . . 0.0 110.157 170.575 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . -49.22 -53.65 18.57 Favored Glycine 0 CA--C 1.532 1.127 0 N-CA-C 111.246 -0.742 . . . . 0.0 111.246 177.346 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 9' ' ' ILE . . . . . . . . . . . . . 1.6 mm -56.52 -54.49 27.93 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.226 0 C-N-CA 125.81 1.644 . . . . 0.0 109.209 176.565 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 10' ' ' PHE . . . . . . . . . . . . . 19.6 t80 -48.03 -51.35 24.47 Favored 'General case' 0 N--CA 1.447 -0.607 0 C-N-CA 123.304 0.642 . . . . 0.0 109.562 179.574 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 52.8 mt-10 -62.41 -49.89 73.67 Favored 'General case' 0 N--CA 1.455 -0.196 0 C-N-CA 123.374 0.67 . . . . 0.0 110.727 -179.749 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 45.4 tttp -43.78 -50.9 7.63 Favored 'General case' 0 CA--C 1.528 0.098 0 C-N-CA 124.094 0.958 . . . . 0.0 110.87 177.606 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 75.4 m-85 -79.56 -47.92 14.7 Favored 'General case' 0 CA--C 1.528 0.13 0 N-CA-C 111.836 0.31 . . . . 0.0 111.836 -177.937 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -57.07 -31.21 64.98 Favored 'General case' 0 N--CA 1.466 0.354 0 C-N-CA 124.902 1.281 . . . . 0.0 112.859 -178.628 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -58.77 -30.38 67.51 Favored 'General case' 0 N--CA 1.451 -0.421 0 O-C-N 121.872 -0.517 . . . . 0.0 111.472 174.767 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 57.6 mttm -79.1 44.9 0.59 Allowed 'General case' 0 CA--C 1.537 0.46 0 C-N-CA 123.87 0.868 . . . . 0.0 111.929 -172.517 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 33.2 tt0 -170.72 -51.17 0.02 OUTLIER 'General case' 0 N--CA 1.456 -0.171 0 C-N-CA 125.759 1.624 . . . . 0.0 108.076 178.001 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 176.24 -90.49 0.08 OUTLIER Glycine 0 CA--C 1.523 0.535 0 N-CA-C 111.451 -0.659 . . . . 0.0 111.451 173.722 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 26.5 t0 -66.13 112.72 9.78 Favored Pre-proline 0 CA--C 1.535 0.403 0 CA-C-O 118.485 -0.769 . . . . 0.0 110.71 -170.33 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 20' ' ' PRO . . . . . . . . . . . . . 22.9 Cg_endo -58.83 -16.49 31.81 Favored 'Trans proline' 0 CA--C 1.536 0.593 0 C-N-CA 122.472 2.115 . . . . 0.0 113.35 179.869 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 41.9 m-80 -94.05 3.28 55.55 Favored 'General case' 0 CA--C 1.533 0.315 0 C-N-CA 125.303 1.441 . . . . 0.0 113.205 -178.487 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 51.0 tt0 -139.59 124.12 18.25 Favored 'General case' 0 CA--C 1.539 0.555 0 CA-C-N 119.109 0.868 . . . . 0.0 112.134 -176.891 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 60.4 mt -100.16 136.55 39.89 Favored 'General case' 0 C--N 1.343 0.311 0 C-N-CA 123.908 0.883 . . . . 0.0 110.667 175.768 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 99.0 p -88.07 175.44 7.74 Favored 'General case' 0 CA--C 1.535 0.371 0 C-N-CA 123.75 0.82 . . . . 0.0 108.956 167.107 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 98.7 mttt -56.28 -46.17 79.85 Favored 'General case' 0 C--O 1.226 -0.148 0 O-C-N 121.968 -0.457 . . . . 0.0 111.288 179.556 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 29.0 tp10 -64.74 -45.14 87.76 Favored 'General case' 0 N--CA 1.455 -0.177 0 CA-C-O 121.034 0.445 . . . . 0.0 110.719 -177.312 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 58.8 mt-10 -56.88 -47.59 80.12 Favored 'General case' 0 N--CA 1.451 -0.42 0 N-CA-C 109.725 -0.472 . . . . 0.0 109.725 176.069 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 16.1 mt -55.86 -43.85 77.51 Favored 'General case' 0 CA--C 1.513 -0.474 0 N-CA-C 112.783 0.66 . . . . 0.0 112.783 170.994 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 63.3 tttp -59.09 -52.27 66.45 Favored 'General case' 0 C--N 1.323 -0.563 0 CA-C-N 118.839 0.745 . . . . 0.0 109.624 -177.145 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 81.2 mt -58.72 -48.97 79.32 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 115.816 -0.629 . . . . 0.0 110.748 178.866 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 9.6 tt -50.64 -55.12 17.86 Favored 'General case' 0 C--O 1.233 0.216 0 C-N-CA 124.007 0.923 . . . . 0.0 110.17 175.914 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 38.3 mt -56.81 -56.85 16.3 Favored 'General case' 0 N--CA 1.456 -0.174 0 C-N-CA 124.061 0.944 . . . . 0.0 110.086 -178.601 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -57.93 -50.37 73.59 Favored 'General case' 0 N--CA 1.455 -0.217 0 C-N-CA 122.552 0.341 . . . . 0.0 110.635 -175.568 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 9.1 m -65.11 -52.49 55.09 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.477 -0.329 . . . . 0.0 111.232 -175.036 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 76.1 mm-40 -103.58 -24.44 13.4 Favored 'General case' 0 N--CA 1.452 -0.348 0 N-CA-C 114.906 1.447 . . . . 0.0 114.906 -165.361 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 46.5 m-85 -135.77 67.29 64.49 Favored Pre-proline 0 C--O 1.235 0.332 0 CA-C-N 119.263 0.938 . . . . 0.0 112.624 -171.795 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 65.5 Cg_endo -62.67 -21.41 72.92 Favored 'Trans proline' 0 N--CA 1.453 -0.866 0 C-N-CA 122.174 1.916 . . . . 0.0 110.243 169.123 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 4.5 p -55.79 -67.74 0.26 Allowed 'General case' 0 N--CA 1.447 -0.587 0 C-N-CA 125.371 1.468 . . . . 0.0 109.134 169.908 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 65.3 mt -47.59 -45.69 27.57 Favored 'General case' 0 C--O 1.231 0.131 0 C-N-CA 123.512 0.725 . . . . 0.0 110.939 176.579 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 23.7 tp -53.48 -26.28 19.87 Favored 'General case' 0 CA--C 1.536 0.423 0 N-CA-C 113.142 0.793 . . . . 0.0 113.142 -177.409 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 62.8 mtpt -49.33 -36.58 21.67 Favored 'General case' 0 CA--C 1.531 0.228 0 CA-C-N 119.004 0.82 . . . . 0.0 112.299 173.129 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . -48.57 -31.73 9.85 Favored Glycine 0 CA--C 1.533 1.157 0 C-N-CA 124.347 0.975 . . . . 0.0 112.73 175.033 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 43' ' ' GLY . . . . . . . . . . . . . . . 61.3 -91.41 0.06 OUTLIER Glycine 0 CA--C 1.525 0.666 0 C-N-CA 124.376 0.988 . . . . 0.0 111.552 172.479 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 44' ' ' SER . . . . . . . . . . . . . 23.5 m 35.51 -111.22 0.06 Allowed 'General case' 0 N--CA 1.45 -0.446 0 C-N-CA 126.632 1.973 . . . . 0.0 110.51 -179.801 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 69.5 p -145.98 152.16 38.94 Favored 'General case' 0 N--CA 1.45 -0.456 0 N-CA-C 106.051 -1.833 . . . . 0.0 106.051 166.381 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 18.5 mt -55.62 -41.16 73.08 Favored 'General case' 0 N--CA 1.451 -0.394 0 N-CA-C 108.152 -1.055 . . . . 0.0 108.152 171.141 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 5.5 m-20 -54.99 -56.38 20.4 Favored 'General case' 0 N--CA 1.451 -0.424 0 C-N-CA 124.527 1.131 . . . . 0.0 111.633 177.425 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 32.5 mt-10 -55.15 -48.1 74.2 Favored 'General case' 0 C--N 1.334 -0.089 0 C-N-CA 122.097 0.159 . . . . 0.0 110.706 176.377 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 55.9 tp -57.66 -47.6 81.83 Favored 'General case' 0 CA--C 1.532 0.263 0 CA-C-O 121.385 0.612 . . . . 0.0 110.47 179.649 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 50' ' ' PHE . . . . . . . . . . . . . 50.0 t80 -57.04 -48.93 77.34 Favored 'General case' 0 N--CA 1.452 -0.368 0 C-N-CA 124.467 1.107 . . . . 0.0 109.864 -179.874 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 33.9 tt0 -61.76 -40.44 95.17 Favored 'General case' 0 N--CA 1.453 -0.284 0 C-N-CA 122.788 0.435 . . . . 0.0 111.16 177.93 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 70.2 tt0 -59.0 -46.51 87.98 Favored 'General case' 0 C--N 1.331 -0.203 0 C-N-CA 123.092 0.557 . . . . 0.0 110.422 176.384 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 84.4 mt -66.38 -56.29 11.77 Favored 'General case' 0 N--CA 1.452 -0.345 0 C-N-CA 123.465 0.706 . . . . 0.0 111.133 -179.52 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 14.2 t0 -103.68 101.25 11.09 Favored 'General case' 0 N--CA 1.453 -0.307 0 C-N-CA 124.376 1.07 . . . . 0.0 108.985 -176.367 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 25.2 mmmt -74.52 75.24 1.96 Allowed 'General case' 0 N--CA 1.453 -0.325 0 CA-C-O 122.38 1.086 . . . . 0.0 111.26 178.643 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 56' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER 37.91 41.19 0.33 Allowed 'General case' 0 C--N 1.323 -0.585 0 C-N-CA 129.56 3.144 . . . . 0.0 114.109 -176.622 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . -79.48 -80.63 0.77 Allowed Glycine 0 CA--C 1.526 0.719 0 N-CA-C 110.418 -1.073 . . . . 0.0 110.418 -177.003 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 35.2 p-10 -97.22 -30.57 12.91 Favored 'General case' 0 CA--C 1.533 0.326 0 C-N-CA 124.688 1.195 . . . . 0.0 111.448 -178.757 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . 93.94 25.29 17.71 Favored Glycine 0 CA--C 1.53 0.977 0 C-N-CA 124.146 0.879 . . . . 0.0 111.242 -174.267 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 42.6 mp0 -149.83 179.18 8.24 Favored 'General case' 0 N--CA 1.457 -0.098 0 C-N-CA 127.024 2.13 . . . . 0.0 105.94 175.569 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 61' ' ' VAL . . . . . . . . . . . . . 39.9 t -118.28 103.79 15.19 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.241 0 N-CA-C 109.136 -0.69 . . . . 0.0 109.136 176.678 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 18.6 t -79.2 167.37 21.07 Favored 'General case' 0 CA--C 1.532 0.282 0 C-N-CA 123.01 0.524 . . . . 0.0 111.345 172.335 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 63' ' ' PHE . . . . . . . . . . . . . 63.1 t80 -60.41 -34.8 74.47 Favored 'General case' 0 CA--C 1.53 0.211 0 C-N-CA 123.204 0.602 . . . . 0.0 112.518 -172.733 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 7.6 tm-20 -64.17 -61.77 2.05 Favored 'General case' 0 CA--C 1.533 0.327 0 N-CA-C 109.476 -0.565 . . . . 0.0 109.476 178.11 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 14.7 pt-20 -59.86 -33.44 71.81 Favored 'General case' 0 CA--C 1.537 0.463 0 O-C-N 121.62 -0.675 . . . . 0.0 111.741 -179.472 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 19.6 t80 -53.03 -25.76 13.48 Favored 'General case' 0 CA--C 1.536 0.415 0 C-N-CA 123.902 0.881 . . . . 0.0 112.897 169.668 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 67' ' ' GLN . . . . . . . . . . . . . 73.2 mm-40 -55.81 -24.75 37.92 Favored 'General case' 0 CA--C 1.538 0.492 0 O-C-N 120.785 -1.197 . . . . 0.0 112.435 171.795 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 74.0 t -61.01 -33.98 58.02 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.547 0 O-C-N 121.086 -1.009 . . . . 0.0 110.339 170.467 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 14.1 tp -73.07 -39.82 65.55 Favored 'General case' 0 C--O 1.225 -0.223 0 O-C-N 120.885 -1.134 . . . . 0.0 108.15 176.494 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 70' ' ' VAL . . . . . . . . . . . . . 40.9 t -58.15 -39.6 73.75 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.544 0 O-C-N 121.939 -0.475 . . . . 0.0 110.54 173.159 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 75.1 tttt -55.75 -51.09 68.57 Favored 'General case' 0 N--CA 1.455 -0.184 0 O-C-N 121.601 -0.687 . . . . 0.0 110.67 170.734 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 4.8 mptp? -52.65 -48.29 66.54 Favored 'General case' 0 CA--C 1.536 0.436 0 CA-C-N 118.281 0.491 . . . . 0.0 112.141 173.316 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 73' ' ' ILE . . . . . . . . . . . . . 95.9 mt -53.74 -40.99 45.66 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.563 0 N-CA-C 109.271 -0.64 . . . . 0.0 109.271 175.852 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 74' ' ' SER . . . . . 0.646 ' O ' ' OXT' ' A' ' 75' ' ' GLN . 4.9 m -86.97 20.35 2.68 Favored 'General case' 0 CA--C 1.537 0.468 0 C-N-CA 124.741 1.216 . . . . 0.0 112.184 177.613 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 75' ' ' GLN . . . . . 0.646 ' OXT' ' O ' ' A' ' 74' ' ' SER . 3.5 mp0 . . . . . 0 C--O 1.27 2.158 0 C-N-CA 125.637 1.575 . . . . 0.0 110.861 -175.598 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 1' ' ' LYS . . . . . . . . . . . . . 74.5 mmtt . . . . . 0 N--CA 1.454 -0.251 0 N-CA-C 108.986 -0.746 . . . . 0.0 108.986 . . . . . . . . . 0 0 . 1 . 013 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 81.2 p -67.51 153.9 94.1 Favored Pre-proline 0 N--CA 1.452 -0.33 0 O-C-N 121.849 -0.532 . . . . 0.0 109.754 -177.261 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 82.2 Cg_exo -46.39 -41.81 22.77 Favored 'Trans proline' 0 N--CA 1.456 -0.726 0 C-N-CA 122.665 2.244 . . . . 0.0 111.621 169.146 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 3.1 mp0 -59.39 -50.83 72.43 Favored 'General case' 0 N--CA 1.454 -0.229 0 C-N-CA 123.817 0.847 . . . . 0.0 112.154 176.236 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 15.3 tp10 -57.96 -46.89 84.4 Favored 'General case' 0 N--CA 1.454 -0.239 0 N-CA-C 108.211 -1.033 . . . . 0.0 108.211 178.502 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 25.8 mt -59.59 -37.83 79.6 Favored 'General case' 0 N--CA 1.445 -0.712 0 C-N-CA 124.216 1.007 . . . . 0.0 111.831 179.266 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 1.2 tmtm? -61.86 -48.0 82.51 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 118.843 0.747 . . . . 0.0 109.949 171.94 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . -54.77 -54.67 31.76 Favored Glycine 0 CA--C 1.528 0.867 0 N-CA-C 110.49 -1.044 . . . . 0.0 110.49 178.758 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 9' ' ' ILE . . . . . . . . . . . . . 72.9 mt -50.98 -54.26 11.1 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.184 0 C-N-CA 125.278 1.431 . . . . 0.0 109.967 172.781 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 10' ' ' PHE . . . . . . . . . . . . . 29.5 t80 -51.97 -49.79 62.54 Favored 'General case' 0 N--CA 1.447 -0.609 0 O-C-N 121.715 -0.616 . . . . 0.0 109.719 -176.863 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 54.8 mt-10 -61.85 -53.05 61.18 Favored 'General case' 0 N--CA 1.457 -0.082 0 N-CA-C 110.292 -0.262 . . . . 0.0 110.292 178.847 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 48.9 tttp -44.24 -53.71 6.36 Favored 'General case' 0 C--O 1.227 -0.124 0 C-N-CA 124.52 1.128 . . . . 0.0 110.586 178.064 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 41.8 m-85 -77.4 -41.28 40.63 Favored 'General case' 0 N--CA 1.454 -0.273 0 CA-C-O 119.629 -0.224 . . . . 0.0 111.491 -173.909 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -58.7 -58.73 7.29 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-O 120.848 0.356 . . . . 0.0 110.847 179.036 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -51.06 -32.1 20.92 Favored 'General case' 0 CA--C 1.531 0.222 0 C-N-CA 125.121 1.368 . . . . 0.0 113.111 -169.941 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 94.1 mttt -56.85 -31.69 65.04 Favored 'General case' 0 CA--C 1.533 0.312 0 C-N-CA 123.218 0.607 . . . . 0.0 112.6 -179.604 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 31.0 tt0 -139.94 -42.44 0.43 Allowed 'General case' 0 CA--C 1.532 0.271 0 N-CA-C 112.453 0.538 . . . . 0.0 112.453 -168.68 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . -111.32 179.32 19.83 Favored Glycine 0 CA--C 1.523 0.593 0 C-N-CA 124.585 1.088 . . . . 0.0 111.131 -173.027 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 9.8 t70 -61.03 134.03 92.77 Favored Pre-proline 0 CA--C 1.533 0.324 0 N-CA-C 108.09 -1.078 . . . . 0.0 108.09 173.506 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 20' ' ' PRO . . . . . . . . . . . . . 12.9 Cg_endo -52.77 -24.61 24.09 Favored 'Trans proline' 0 CA--C 1.537 0.657 0 C-N-CA 122.931 2.421 . . . . 0.0 114.145 -175.809 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 44.1 m-80 -88.38 -5.67 58.16 Favored 'General case' 0 CA--C 1.535 0.381 0 C-N-CA 124.912 1.285 . . . . 0.0 113.186 -177.214 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 37.4 tt0 -148.64 119.57 7.64 Favored 'General case' 0 CA--C 1.539 0.556 0 CA-C-N 118.797 0.726 . . . . 0.0 112.82 -169.446 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 69.5 mt -88.98 133.91 34.16 Favored 'General case' 0 C--N 1.343 0.312 0 C-N-CA 124.139 0.976 . . . . 0.0 112.544 -175.529 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 27.9 p -77.83 171.71 14.56 Favored 'General case' 0 C--O 1.235 0.29 0 C-N-CA 123.626 0.77 . . . . 0.0 109.457 168.268 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 97.8 mttt -57.99 -46.76 84.67 Favored 'General case' 0 N--CA 1.454 -0.237 0 N-CA-C 110.156 -0.313 . . . . 0.0 110.156 174.245 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 27.4 tp10 -65.08 -44.45 88.86 Favored 'General case' 0 N--CA 1.453 -0.283 0 CA-C-O 120.89 0.376 . . . . 0.0 110.34 -176.895 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 21.1 mt-10 -56.1 -49.51 73.64 Favored 'General case' 0 CA--C 1.536 0.433 0 N-CA-C 109.443 -0.577 . . . . 0.0 109.443 175.289 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 10.2 mt -55.75 -41.88 74.62 Favored 'General case' 0 CA--C 1.514 -0.405 0 N-CA-C 113.324 0.861 . . . . 0.0 113.324 171.661 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 89.1 tttt -59.81 -53.29 59.65 Favored 'General case' 0 C--N 1.323 -0.566 0 CA-C-N 118.737 0.699 . . . . 0.0 109.8 -178.637 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 82.9 mt -58.27 -46.78 85.39 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.968 178.875 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 6.4 tt -51.15 -57.65 8.19 Favored 'General case' 0 C--N 1.332 -0.156 0 C-N-CA 123.836 0.854 . . . . 0.0 109.9 175.415 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 40.0 mt -54.73 -55.13 33.21 Favored 'General case' 0 C--N 1.331 -0.196 0 C-N-CA 124.27 1.028 . . . . 0.0 109.724 -178.433 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 24.2 mt-30 -53.13 -50.95 63.46 Favored 'General case' 0 N--CA 1.454 -0.245 0 C-N-CA 123.484 0.714 . . . . 0.0 111.343 -177.556 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 1.6 m -73.54 -51.15 17.99 Favored 'General case' 0 CA--C 1.532 0.264 0 C-N-CA 120.174 -0.61 . . . . 0.0 111.322 -173.898 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 45.0 mm-40 -94.4 -29.62 14.89 Favored 'General case' 0 N--CA 1.449 -0.5 0 N-CA-C 113.622 0.971 . . . . 0.0 113.622 -166.123 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 75.4 m-85 -136.84 66.51 55.69 Favored Pre-proline 0 CA--C 1.534 0.365 0 N-CA-C 113.053 0.76 . . . . 0.0 113.053 -173.249 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 87.7 Cg_exo -49.19 -31.39 21.72 Favored 'Trans proline' 0 N--CA 1.458 -0.582 0 C-N-CA 122.955 2.437 . . . . 0.0 112.492 168.238 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 3.3 p -56.0 -60.54 3.33 Favored 'General case' 0 N--CA 1.45 -0.434 0 C-N-CA 125.166 1.386 . . . . 0.0 109.457 175.836 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 85.4 mt -57.34 -41.19 79.56 Favored 'General case' 0 N--CA 1.453 -0.323 0 CA-C-N 115.477 -0.783 . . . . 0.0 110.914 176.391 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 11.8 tp -57.07 -47.2 81.59 Favored 'General case' 0 CA--C 1.533 0.308 0 CA-C-O 120.825 0.345 . . . . 0.0 111.199 178.769 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 93.7 mttt -66.76 -38.68 87.08 Favored 'General case' 0 N--CA 1.455 -0.196 0 C-N-CA 124.052 0.941 . . . . 0.0 110.983 176.426 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . -36.79 118.4 0.49 Allowed Glycine 0 CA--C 1.53 0.986 0 C-N-CA 125.789 1.661 . . . . 0.0 111.998 175.324 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 43' ' ' GLY . . . . . . . . . . . . . . . -68.03 73.91 0.27 Allowed Glycine 0 CA--C 1.529 0.952 0 C-N-CA 124.274 0.94 . . . . 0.0 113.46 -170.718 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 44' ' ' SER . . . . . . . . . . . . . 17.2 m -158.64 142.57 15.41 Favored 'General case' 0 N--CA 1.443 -0.799 0 C-N-CA 126.654 1.982 . . . . 0.0 106.063 169.954 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 47.5 p -70.44 160.89 31.53 Favored 'General case' 0 N--CA 1.453 -0.282 0 CA-C-O 121.436 0.636 . . . . 0.0 109.7 -179.553 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 18.8 mt -55.35 -43.97 75.52 Favored 'General case' 0 N--CA 1.451 -0.375 0 N-CA-C 108.275 -1.009 . . . . 0.0 108.275 172.72 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 5.7 m-20 -58.38 -49.07 78.57 Favored 'General case' 0 N--CA 1.447 -0.595 0 CA-C-N 115.006 -0.997 . . . . 0.0 111.39 178.503 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 51.0 mt-10 -57.9 -50.64 72.65 Favored 'General case' 0 C--N 1.333 -0.125 0 CA-C-N 117.379 0.081 . . . . 0.0 110.931 175.962 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 81.6 mt -57.64 -48.34 79.73 Favored 'General case' 0 CA--C 1.531 0.22 0 CA-C-O 121.376 0.608 . . . . 0.0 109.926 -179.936 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 50' ' ' PHE . . . . . . . . . . . . . 54.6 t80 -55.03 -53.29 57.75 Favored 'General case' 0 N--CA 1.45 -0.466 0 C-N-CA 123.882 0.873 . . . . 0.0 109.879 178.965 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 42.8 tt0 -57.51 -45.74 84.62 Favored 'General case' 0 N--CA 1.454 -0.264 0 C-N-CA 122.895 0.478 . . . . 0.0 110.771 179.503 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 8.5 tm-20 -55.99 -45.97 78.83 Favored 'General case' 0 N--CA 1.454 -0.264 0 C-N-CA 122.998 0.519 . . . . 0.0 110.308 179.433 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 95.8 mt -78.25 -38.21 43.38 Favored 'General case' 0 CA--C 1.533 0.299 0 N-CA-C 112.592 0.59 . . . . 0.0 112.592 -175.364 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 27.5 t0 -67.41 72.83 0.13 Allowed 'General case' 0 C--N 1.33 -0.274 0 C-N-CA 126.876 2.07 . . . . 0.0 109.674 177.607 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 28.4 mmmt -57.3 99.77 0.04 OUTLIER 'General case' 0 N--CA 1.454 -0.268 0 CA-C-O 121.282 0.563 . . . . 0.0 112.292 -169.072 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 56' ' ' ASN . . . . . . . . . . . . 0.25 0.0 OUTLIER 95.75 5.32 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.304 0 C-N-CA 128.83 2.852 . . . . 0.0 112.609 171.556 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . 79.09 53.08 4.61 Favored Glycine 0 CA--C 1.525 0.705 0 N-CA-C 110.94 -0.864 . . . . 0.0 110.94 177.706 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 3.2 p30 -77.16 -48.28 18.08 Favored 'General case' 0 N--CA 1.451 -0.385 0 N-CA-C 108.139 -1.059 . . . . 0.0 108.139 170.947 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . 159.35 -86.65 0.12 Allowed Glycine 0 C--O 1.223 -0.591 0 N-CA-C 108.57 -1.812 . . . . 0.0 108.57 168.061 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 62.4 mt-10 -97.8 150.03 21.7 Favored 'General case' 0 C--N 1.326 -0.45 0 C-N-CA 123.767 0.827 . . . . 0.0 108.906 -172.022 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 61' ' ' VAL . . . . . . . . . . . . . 2.8 t -83.87 109.77 17.76 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.203 0 O-C-N 122.221 -0.3 . . . . 0.0 111.585 -165.814 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 1.7 m -77.78 153.47 32.82 Favored 'General case' 0 CA--C 1.534 0.352 0 C-N-CA 124.123 0.969 . . . . 0.0 110.741 -177.586 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 63' ' ' PHE . . . . . . . . . . . . . 69.1 t80 -55.31 -38.69 69.0 Favored 'General case' 0 N--CA 1.468 0.472 0 N-CA-C 113.072 0.767 . . . . 0.0 113.072 -174.336 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 12.5 tp10 -61.92 -59.92 4.4 Favored 'General case' 0 CA--C 1.534 0.33 0 O-C-N 121.994 -0.441 . . . . 0.0 110.012 179.865 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 16.6 pt-20 -59.35 -36.19 75.25 Favored 'General case' 0 CA--C 1.535 0.388 0 O-C-N 121.394 -0.816 . . . . 0.0 111.798 179.739 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 23.7 t80 -51.94 -26.24 9.97 Favored 'General case' 0 CA--C 1.54 0.578 0 C-N-CA 123.788 0.835 . . . . 0.0 112.408 171.682 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 67' ' ' GLN . . . . . . . . . . . . . 36.2 mm-40 -53.23 -27.84 24.12 Favored 'General case' 0 CA--C 1.54 0.567 0 O-C-N 120.985 -1.072 . . . . 0.0 113.117 172.625 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 85.8 t -56.22 -30.58 30.21 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.436 0 C-N-CA 122.966 0.506 . . . . 0.0 110.967 173.206 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 16.8 tp -78.17 -51.32 10.4 Favored 'General case' 0 N--CA 1.455 -0.178 0 N-CA-C 109.221 -0.659 . . . . 0.0 109.221 170.664 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 70' ' ' VAL . . . . . . . . . . . . . 84.4 t -47.91 -43.92 10.91 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.22 0 C-N-CA 122.88 0.472 . . . . 0.0 111.591 -175.695 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 54.0 pttt -59.91 -41.35 91.51 Favored 'General case' 0 CA--C 1.533 0.317 0 C-N-CA 120.281 -0.567 . . . . 0.0 112.388 179.732 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 5.6 mptp? -60.55 -45.42 93.95 Favored 'General case' 0 CA--C 1.529 0.172 0 N-CA-C 110.309 -0.256 . . . . 0.0 110.309 172.56 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 73' ' ' ILE . . . . . . . . . . . . . 55.4 mt -61.04 -54.2 38.63 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.216 0 CA-C-O 120.751 0.31 . . . . 0.0 110.889 -177.781 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 55.5 m -160.76 57.05 0.32 Allowed 'General case' 0 CA--C 1.532 0.269 0 C-N-CA 123.758 0.823 . . . . 0.0 110.898 -172.431 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 75' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.27 2.141 0 C-N-CA 125.977 1.711 . . . . 0.0 113.82 170.999 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 1' ' ' LYS . . . . . . . . . . . . . 72.3 mmtt . . . . . 0 N--CA 1.45 -0.457 0 N-CA-C 108.44 -0.948 . . . . 0.0 108.44 . . . . . . . . . 0 0 . 1 . 014 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 90.5 p -80.24 152.64 73.81 Favored Pre-proline 0 N--CA 1.453 -0.3 0 N-CA-C 108.821 -0.807 . . . . 0.0 108.821 174.283 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 83.9 Cg_exo -47.14 -38.01 24.33 Favored 'Trans proline' 0 N--CA 1.456 -0.692 0 C-N-CA 122.72 2.28 . . . . 0.0 112.322 169.782 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 3.1 mp0 -62.54 -48.66 78.52 Favored 'General case' 0 CA--C 1.53 0.202 0 C-N-CA 123.793 0.837 . . . . 0.0 111.917 175.966 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 9.6 tm-20 -60.33 -44.47 95.46 Favored 'General case' 0 CA--C 1.53 0.206 0 N-CA-C 108.739 -0.837 . . . . 0.0 108.739 178.074 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 14.5 mt -60.98 -37.18 81.56 Favored 'General case' 0 N--CA 1.447 -0.6 0 C-N-CA 123.614 0.766 . . . . 0.0 112.568 175.803 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 54.5 tptt -59.24 -47.45 85.29 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 119.232 0.924 . . . . 0.0 109.724 169.752 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . -51.18 -54.21 24.27 Favored Glycine 0 CA--C 1.531 1.072 0 N-CA-C 110.696 -0.962 . . . . 0.0 110.696 176.793 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 9' ' ' ILE . . . . . . . . . . . . . 4.2 mm -54.56 -56.12 11.85 Favored 'Isoleucine or valine' 0 CA--C 1.529 0.166 0 C-N-CA 125.063 1.345 . . . . 0.0 109.321 175.99 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 10' ' ' PHE . . . . . . . . . . . . . 23.2 t80 -49.56 -49.33 46.75 Favored 'General case' 0 N--CA 1.444 -0.753 0 C-N-CA 123.612 0.765 . . . . 0.0 109.772 -178.65 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 52.1 mt-10 -63.35 -48.77 76.55 Favored 'General case' 0 N--CA 1.453 -0.288 0 C-N-CA 123.504 0.722 . . . . 0.0 110.613 179.638 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 64.6 tttt -44.39 -51.84 8.25 Favored 'General case' 0 CA--C 1.53 0.21 0 C-N-CA 123.893 0.877 . . . . 0.0 110.756 176.592 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 83.0 m-85 -80.68 -38.54 28.81 Favored 'General case' 0 CA--C 1.533 0.295 0 N-CA-C 112.379 0.511 . . . . 0.0 112.379 -176.723 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -69.05 -52.63 26.52 Favored 'General case' 0 C--N 1.333 -0.147 0 C-N-CA 123.552 0.741 . . . . 0.0 111.757 -176.908 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -55.46 -20.52 12.86 Favored 'General case' 0 C--N 1.332 -0.188 0 C-N-CA 124.124 0.97 . . . . 0.0 112.255 -178.57 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 38.8 ttmt -56.57 -30.29 62.98 Favored 'General case' 0 N--CA 1.449 -0.52 0 C-N-CA 123.713 0.805 . . . . 0.0 111.372 179.349 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 9.8 tp10 -155.29 -45.76 0.08 Allowed 'General case' 0 C--N 1.341 0.229 0 CA-C-N 118.201 0.455 . . . . 0.0 111.501 177.575 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . -74.35 175.88 48.29 Favored Glycine 0 CA--C 1.527 0.84 0 CA-C-O 121.787 0.66 . . . . 0.0 111.522 179.315 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 10.1 t70 -63.31 139.92 97.64 Favored Pre-proline 0 CA--C 1.533 0.299 0 N-CA-C 107.289 -1.375 . . . . 0.0 107.289 169.519 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 20' ' ' PRO . . . . . . . . . . . . . 11.1 Cg_endo -50.68 -23.67 11.6 Favored 'Trans proline' 0 CA--C 1.537 0.649 0 C-N-CA 122.859 2.373 . . . . 0.0 114.538 -179.143 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 49.2 m-80 -96.56 -1.17 47.6 Favored 'General case' 0 CA--C 1.533 0.3 0 C-N-CA 124.956 1.302 . . . . 0.0 113.314 -177.743 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 30.7 tt0 -141.51 116.98 10.21 Favored 'General case' 0 CA--C 1.538 0.514 0 C-N-CA 123.869 0.868 . . . . 0.0 112.579 -176.712 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 46.9 mt -90.56 136.74 32.87 Favored 'General case' 0 C--N 1.342 0.26 0 C-N-CA 124.564 1.145 . . . . 0.0 110.857 179.875 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 98.0 p -78.5 168.05 20.37 Favored 'General case' 0 CA--C 1.532 0.273 0 N-CA-C 108.572 -0.899 . . . . 0.0 108.572 167.133 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 1.1 ttmp? -59.11 -38.12 78.8 Favored 'General case' 0 CA--C 1.535 0.395 0 O-C-N 122.017 -0.427 . . . . 0.0 110.739 177.985 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 26.9 mt-10 -68.24 -47.49 67.64 Favored 'General case' 0 N--CA 1.454 -0.23 0 CA-C-O 121.162 0.506 . . . . 0.0 110.516 -179.576 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 60.2 mt-10 -58.06 -43.94 87.22 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.027 -0.533 . . . . 0.0 109.814 176.183 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 12.3 mt -54.59 -47.37 73.42 Favored 'General case' 0 CA--C 1.507 -0.676 0 CA-C-N 118.387 0.54 . . . . 0.0 112.233 169.608 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 61.9 tttp -58.83 -47.59 84.31 Favored 'General case' 0 C--N 1.324 -0.531 0 CA-C-N 118.706 0.684 . . . . 0.0 109.876 -177.353 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 90.5 mt -59.75 -49.06 79.21 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.532 -0.304 . . . . 0.0 111.686 177.286 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 6.9 tt -50.62 -58.28 6.21 Favored 'General case' 0 N--CA 1.456 -0.148 0 C-N-CA 124.204 1.002 . . . . 0.0 109.327 175.545 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 42.8 mt -57.98 -52.35 65.87 Favored 'General case' 0 N--CA 1.451 -0.39 0 C-N-CA 123.86 0.864 . . . . 0.0 109.079 -176.291 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 23.6 tt0 -53.85 -51.03 64.92 Favored 'General case' 0 N--CA 1.453 -0.287 0 C-N-CA 123.639 0.776 . . . . 0.0 111.075 -178.204 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 11.4 m -75.65 -45.36 37.6 Favored 'General case' 0 N--CA 1.451 -0.381 0 CA-C-N 115.992 -0.549 . . . . 0.0 110.958 -171.583 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 74.0 mm-40 -94.57 -34.97 12.44 Favored 'General case' 0 N--CA 1.452 -0.357 0 C-N-CA 123.797 0.839 . . . . 0.0 112.406 -169.355 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 73.9 m-85 -144.88 68.27 14.14 Favored Pre-proline 0 CA--C 1.541 0.606 0 C-N-CA 123.832 0.853 . . . . 0.0 113.108 -169.875 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 85.6 Cg_exo -44.7 -36.48 10.5 Favored 'Trans proline' 0 CA--C 1.536 0.618 0 C-N-CA 123.431 2.754 . . . . 0.0 113.359 172.143 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -55.52 -43.1 75.4 Favored 'General case' 0 N--CA 1.45 -0.463 0 C-N-CA 125.568 1.547 . . . . 0.0 109.83 179.813 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 96.2 mt -84.72 -32.28 23.6 Favored 'General case' 0 N--CA 1.446 -0.671 0 C-N-CA 125.053 1.341 . . . . 0.0 110.498 -177.074 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 15.9 tp -54.04 -50.09 67.49 Favored 'General case' 0 N--CA 1.462 0.162 0 N-CA-C 109.387 -0.598 . . . . 0.0 109.387 171.364 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 8.2 mtmp? -64.68 -61.22 2.33 Favored 'General case' 0 N--CA 1.449 -0.499 0 N-CA-C 109.348 -0.612 . . . . 0.0 109.348 172.697 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . 70.51 -67.47 0.75 Allowed Glycine 0 CA--C 1.529 0.914 0 C-N-CA 125.02 1.295 . . . . 0.0 113.762 169.406 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 43' ' ' GLY . . . . . . . . . . . . . . . 135.29 -66.39 0.56 Allowed Glycine 0 CA--C 1.522 0.503 0 N-CA-C 106.164 -2.775 . . . . 0.0 106.164 -169.656 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 44' ' ' SER . . . . . . . . . . . . . 19.7 m -59.66 145.58 44.25 Favored 'General case' 0 N--CA 1.45 -0.442 0 N-CA-C 108.716 -0.846 . . . . 0.0 108.716 167.884 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 75.3 p -60.13 161.26 7.12 Favored 'General case' 0 CA--C 1.531 0.236 0 N-CA-C 109.209 -0.663 . . . . 0.0 109.209 169.406 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 57.4 tp -51.01 -44.39 60.97 Favored 'General case' 0 CA--C 1.528 0.118 0 CA-C-O 120.984 0.421 . . . . 0.0 110.709 172.08 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 4.8 m-20 -59.59 -54.04 51.15 Favored 'General case' 0 N--CA 1.45 -0.459 0 C-N-CA 123.905 0.882 . . . . 0.0 110.932 179.252 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 37.0 mt-10 -55.13 -48.52 73.55 Favored 'General case' 0 C--N 1.332 -0.191 0 CA-C-N 116.492 -0.322 . . . . 0.0 110.547 176.262 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 54.9 tp -56.39 -49.79 73.47 Favored 'General case' 0 C--N 1.331 -0.206 0 C-N-CA 123.035 0.534 . . . . 0.0 109.863 -179.904 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 50' ' ' PHE . . . . . . . . . . . . . 59.9 t80 -51.8 -50.42 60.82 Favored 'General case' 0 N--CA 1.453 -0.305 0 C-N-CA 124.041 0.936 . . . . 0.0 110.3 177.69 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 56.9 mm-40 -59.3 -47.5 85.14 Favored 'General case' 0 CA--C 1.534 0.364 0 CA-C-N 117.923 0.329 . . . . 0.0 111.627 175.373 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 39.8 mt-10 -54.81 -36.92 65.47 Favored 'General case' 0 CA--C 1.529 0.137 0 C-N-CA 123.375 0.67 . . . . 0.0 111.688 178.689 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 53.2 mt -75.21 -57.37 3.94 Favored 'General case' 0 N--CA 1.447 -0.611 0 CA-C-N 117.905 0.32 . . . . 0.0 110.626 174.808 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 33.2 t0 -75.55 59.32 1.11 Allowed 'General case' 0 CA--C 1.536 0.436 0 C-N-CA 124.612 1.165 . . . . 0.0 110.89 -178.947 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 13.5 mmmm -57.57 -37.83 73.82 Favored 'General case' 0 CA--C 1.53 0.199 0 C-N-CA 123.841 0.856 . . . . 0.0 111.465 178.643 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 56' ' ' ASN . . . . . . . . . . . . . 16.4 p-10 -66.12 -16.27 63.81 Favored 'General case' 0 CA--C 1.534 0.329 0 C-N-CA 125.383 1.473 . . . . 0.0 112.565 175.096 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . 64.16 40.86 98.43 Favored Glycine 0 CA--C 1.528 0.876 0 CA-C-N 118.704 0.684 . . . . 0.0 113.138 173.232 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 1.6 p30 -78.41 -15.88 58.2 Favored 'General case' 0 CA--C 1.534 0.363 0 CA-C-N 118.422 1.111 . . . . 0.0 112.249 177.629 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . 99.01 7.45 55.19 Favored Glycine 0 CA--C 1.53 0.994 0 C-N-CA 123.717 0.675 . . . . 0.0 112.805 177.645 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 33.4 mt-10 -154.65 173.99 15.6 Favored 'General case' 0 N--CA 1.454 -0.231 0 C-N-CA 128.311 2.644 . . . . 0.0 105.731 172.264 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 61' ' ' VAL . . . . . . . . . . . . . 25.4 t -109.94 114.63 47.53 Favored 'Isoleucine or valine' 0 N--CA 1.461 0.092 0 N-CA-C 109.419 -0.585 . . . . 0.0 109.419 -179.91 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 2.8 m -78.83 159.21 27.94 Favored 'General case' 0 CA--C 1.535 0.387 0 C-N-CA 123.519 0.728 . . . . 0.0 110.85 176.548 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 63' ' ' PHE . . . . . . . . . . . . . 73.8 t80 -59.17 -31.39 68.95 Favored 'General case' 0 CA--C 1.534 0.329 0 O-C-N 121.036 -1.04 . . . . 0.0 113.341 -176.996 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 29.3 mp0 -68.86 -62.95 1.16 Allowed 'General case' 0 N--CA 1.451 -0.403 0 N-CA-C 108.958 -0.756 . . . . 0.0 108.958 -177.595 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 1.5 pt-20 -59.68 -32.86 70.89 Favored 'General case' 0 CA--C 1.538 0.512 0 O-C-N 121.623 -0.673 . . . . 0.0 112.037 178.0 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 18.5 t80 -48.69 -29.84 4.86 Favored 'General case' 0 CA--C 1.537 0.467 0 O-C-N 121.429 -0.795 . . . . 0.0 112.741 169.194 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 67' ' ' GLN . . . . . . . . . . . . . 69.5 mm-40 -54.63 -22.29 13.09 Favored 'General case' 0 CA--C 1.539 0.543 0 CA-C-N 119.557 1.071 . . . . 0.0 112.872 174.685 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 76.2 t -55.49 -35.54 38.22 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.516 0 CA-C-N 119.751 1.159 . . . . 0.0 110.655 171.166 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 24.6 tp -71.95 -45.47 60.97 Favored 'General case' 0 N--CA 1.454 -0.26 0 N-CA-C 107.286 -1.376 . . . . 0.0 107.286 179.129 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 70' ' ' VAL . . . . . . . . . . . . . 23.4 t -57.02 -40.59 73.85 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.341 0 C-N-CA 123.036 0.535 . . . . 0.0 110.37 178.708 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 37.4 ttmt -56.63 -56.38 22.11 Favored 'General case' 0 N--CA 1.454 -0.243 0 C-N-CA 124.315 1.046 . . . . 0.0 110.273 171.385 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 6.1 mptp? -49.48 -40.19 36.43 Favored 'General case' 0 CA--C 1.536 0.416 0 N-CA-C 112.341 0.497 . . . . 0.0 112.341 174.934 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 73' ' ' ILE . . . . . . . . . . . . . 71.3 mt -62.4 -62.09 1.33 Allowed 'Isoleucine or valine' 0 CA--C 1.531 0.229 0 CA-C-N 118.412 0.551 . . . . 0.0 109.524 173.284 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 74' ' ' SER . . . . . 0.534 ' C ' ' OXT' ' A' ' 75' ' ' GLN . 4.1 m -173.85 -47.82 0.01 OUTLIER 'General case' 0 CA--C 1.533 0.297 0 C-N-CA 125.822 1.649 . . . . 0.0 111.842 -178.232 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 75' ' ' GLN . . . . . 0.534 ' OXT' ' C ' ' A' ' 74' ' ' SER . 19.5 tt0 . . . . . 0 C--O 1.27 2.151 0 C-N-CA 124.739 1.216 . . . . 0.0 111.016 -168.661 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 1' ' ' LYS . . . . . . . . . . . . . 73.7 mmtt . . . . . 0 N--CA 1.452 -0.371 0 N-CA-C 109.647 -0.501 . . . . 0.0 109.647 . . . . . . . . . 0 0 . 1 . 015 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 92.2 p -69.68 157.74 88.81 Favored Pre-proline 0 CA--C 1.532 0.267 0 N-CA-C 108.835 -0.802 . . . . 0.0 108.835 174.131 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 86.7 Cg_exo -48.43 -38.33 34.7 Favored 'Trans proline' 0 N--CA 1.456 -0.68 0 C-N-CA 122.379 2.053 . . . . 0.0 111.982 169.733 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 48.0 mt-10 -61.5 -49.54 76.34 Favored 'General case' 0 N--CA 1.456 -0.149 0 C-N-CA 123.587 0.755 . . . . 0.0 111.114 176.501 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 37.8 mm-40 -59.59 -47.18 86.59 Favored 'General case' 0 C--O 1.225 -0.204 0 N-CA-C 109.044 -0.724 . . . . 0.0 109.044 177.638 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 47.5 mt -58.29 -39.66 79.88 Favored 'General case' 0 N--CA 1.447 -0.589 0 C-N-CA 123.462 0.705 . . . . 0.0 111.802 178.857 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 21.8 tptm -61.62 -49.26 77.3 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 118.626 0.648 . . . . 0.0 110.744 171.673 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . -53.61 -52.17 43.57 Favored Glycine 0 CA--C 1.529 0.932 0 N-CA-C 110.272 -1.131 . . . . 0.0 110.272 -179.666 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 9' ' ' ILE . . . . . . . . . . . . . 80.3 mt -53.37 -56.41 8.49 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.245 0 C-N-CA 126.464 1.906 . . . . 0.0 109.704 172.442 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 10' ' ' PHE . . . . . . . . . . . . . 42.1 t80 -49.34 -49.66 43.24 Favored 'General case' 0 N--CA 1.447 -0.586 0 O-C-N 121.82 -0.55 . . . . 0.0 109.618 -178.144 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 52.4 mt-10 -63.65 -51.45 65.12 Favored 'General case' 0 CA--C 1.532 0.25 0 C-N-CA 123.165 0.586 . . . . 0.0 110.801 179.3 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 43.9 tttp -44.79 -51.23 9.64 Favored 'General case' 0 N--CA 1.461 0.113 0 C-N-CA 125.026 1.33 . . . . 0.0 110.909 177.163 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 57.2 m-85 -78.39 -47.37 17.74 Favored 'General case' 0 N--CA 1.448 -0.525 0 CA-C-N 116.362 -0.381 . . . . 0.0 110.355 -175.664 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -54.89 -38.14 67.19 Favored 'General case' 0 C--N 1.331 -0.204 0 C-N-CA 124.21 1.004 . . . . 0.0 112.418 179.218 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -49.65 -33.7 16.28 Favored 'General case' 0 CA--C 1.533 0.289 0 O-C-N 121.737 -0.602 . . . . 0.0 111.835 174.157 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 89.0 mttt -72.18 -29.62 64.17 Favored 'General case' 0 CA--C 1.535 0.389 0 C-N-CA 122.67 0.388 . . . . 0.0 110.97 -179.881 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 24.8 tt0 -65.4 -47.49 76.12 Favored 'General case' 0 C--N 1.341 0.236 0 N-CA-C 107.234 -1.395 . . . . 0.0 107.234 168.978 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 137.43 -56.21 0.68 Allowed Glycine 0 C--N 1.333 0.385 0 N-CA-C 108.422 -1.871 . . . . 0.0 108.422 178.478 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 35.3 t0 -74.3 110.6 9.87 Favored Pre-proline 0 CA--C 1.534 0.345 0 CA-C-O 118.39 -0.814 . . . . 0.0 108.906 176.079 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 20' ' ' PRO . . . . . . . . . . . . . 32.5 Cg_endo -58.49 -21.11 52.56 Favored 'Trans proline' 0 N--CA 1.458 -0.578 0 C-N-CA 122.279 1.986 . . . . 0.0 112.735 -179.516 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 43.2 m-80 -83.13 -4.51 58.45 Favored 'General case' 0 N--CA 1.451 -0.39 0 C-N-CA 124.35 1.06 . . . . 0.0 112.884 -177.268 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 26.3 tt0 -145.58 132.4 20.09 Favored 'General case' 0 CA--C 1.54 0.561 0 CA-C-N 119.699 1.136 . . . . 0.0 113.182 -168.771 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 84.7 mt -104.06 133.86 48.29 Favored 'General case' 0 C--N 1.342 0.257 0 C-N-CA 125.591 1.557 . . . . 0.0 110.804 176.941 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 82.4 p -79.77 175.63 10.45 Favored 'General case' 0 N--CA 1.452 -0.356 0 C-N-CA 123.76 0.824 . . . . 0.0 109.017 168.481 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 97.8 mttt -55.46 -46.3 76.82 Favored 'General case' 0 N--CA 1.455 -0.189 0 O-C-N 122.059 -0.401 . . . . 0.0 110.023 170.168 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 19.3 tp10 -64.96 -46.79 80.09 Favored 'General case' 0 N--CA 1.451 -0.422 0 CA-C-O 120.7 0.286 . . . . 0.0 110.353 -175.961 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -58.6 -44.08 89.78 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-O 118.806 -0.616 . . . . 0.0 110.45 175.822 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 14.2 mt -56.27 -44.58 79.88 Favored 'General case' 0 CA--C 1.509 -0.6 0 CA-C-N 119.273 0.942 . . . . 0.0 112.539 170.484 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 61.7 tttm -59.96 -49.66 76.81 Favored 'General case' 0 N--CA 1.449 -0.525 0 CA-C-N 118.572 0.624 . . . . 0.0 109.555 -177.849 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 9.2 mp -57.83 -49.64 75.98 Favored 'General case' 0 C--N 1.329 -0.292 0 C-N-CA 122.312 0.245 . . . . 0.0 111.376 177.591 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 7.3 tt -50.23 -57.79 7.04 Favored 'General case' 0 C--N 1.332 -0.166 0 C-N-CA 123.957 0.903 . . . . 0.0 109.552 176.051 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 38.0 mt -59.35 -49.15 78.92 Favored 'General case' 0 C--O 1.222 -0.376 0 C-N-CA 123.513 0.725 . . . . 0.0 109.622 -176.747 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 24.6 tt0 -56.96 -45.84 82.57 Favored 'General case' 0 N--CA 1.452 -0.349 0 C-N-CA 124.222 1.009 . . . . 0.0 110.885 -176.911 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 2.6 m -75.77 -52.34 10.65 Favored 'General case' 0 CA--C 1.533 0.318 0 C-N-CA 120.961 -0.296 . . . . 0.0 110.879 -177.107 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 58.4 mm-40 -90.15 -28.18 19.1 Favored 'General case' 0 N--CA 1.449 -0.483 0 N-CA-C 113.093 0.775 . . . . 0.0 113.093 -166.687 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 76.9 m-85 -145.34 56.91 3.86 Favored Pre-proline 0 CA--C 1.538 0.518 0 C-N-CA 123.965 0.906 . . . . 0.0 112.949 -173.252 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 38.3 Cg_endo -61.08 -34.33 90.04 Favored 'Trans proline' 0 N--CA 1.455 -0.789 0 C-N-CA 122.69 2.26 . . . . 0.0 111.052 -176.891 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 1.4 m -58.76 -39.25 80.44 Favored 'General case' 0 N--CA 1.45 -0.448 0 C-N-CA 124.277 1.031 . . . . 0.0 110.048 -179.142 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 76.9 mt -80.77 -37.96 29.41 Favored 'General case' 0 N--CA 1.451 -0.402 0 C-N-CA 123.95 0.9 . . . . 0.0 110.542 179.437 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 45.6 tp -53.58 -44.3 69.25 Favored 'General case' 0 N--CA 1.461 0.112 0 N-CA-C 110.134 -0.321 . . . . 0.0 110.134 174.474 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 68.9 mttm -70.13 -67.35 0.5 Allowed 'General case' 0 N--CA 1.45 -0.472 0 CA-C-O 121.722 0.773 . . . . 0.0 110.047 172.73 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . -79.74 67.57 3.36 Favored Glycine 0 CA--C 1.524 0.615 0 C-N-CA 124.267 0.937 . . . . 0.0 111.144 -175.456 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 43' ' ' GLY . . . . . . . . . . . . . . . -168.41 175.14 43.14 Favored Glycine 0 CA--C 1.524 0.637 0 N-CA-C 110.815 -0.914 . . . . 0.0 110.815 177.949 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 44' ' ' SER . . . . . . . . . . . . . 1.2 m -57.36 162.27 2.89 Favored 'General case' 0 N--CA 1.453 -0.308 0 C-N-CA 124.477 1.111 . . . . 0.0 110.659 174.062 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 67.0 p -59.79 155.49 16.01 Favored 'General case' 0 CA--C 1.53 0.209 0 C-N-CA 120.023 -0.671 . . . . 0.0 109.798 175.041 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 62.9 tp -49.72 -46.21 50.01 Favored 'General case' 0 N--CA 1.454 -0.247 0 C-N-CA 123.286 0.635 . . . . 0.0 111.078 177.939 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 6.0 m-20 -57.81 -54.75 43.41 Favored 'General case' 0 N--CA 1.451 -0.416 0 C-N-CA 123.792 0.837 . . . . 0.0 111.008 178.279 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 46.0 mt-10 -54.31 -47.77 72.07 Favored 'General case' 0 C--N 1.332 -0.158 0 CA-C-N 116.802 -0.181 . . . . 0.0 110.868 177.739 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 48.7 tp -60.4 -48.26 82.51 Favored 'General case' 0 N--CA 1.453 -0.315 0 CA-C-O 121.348 0.594 . . . . 0.0 109.632 -179.411 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 50' ' ' PHE . . . . . . . . . . . . . 59.2 t80 -53.98 -49.31 69.1 Favored 'General case' 0 N--CA 1.449 -0.483 0 C-N-CA 123.331 0.653 . . . . 0.0 110.266 178.848 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 34.7 mt-10 -60.9 -43.34 98.67 Favored 'General case' 0 N--CA 1.455 -0.209 0 C-N-CA 122.719 0.408 . . . . 0.0 110.996 177.648 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 32.7 tt0 -52.74 -42.31 64.79 Favored 'General case' 0 CA--C 1.529 0.172 0 C-N-CA 122.933 0.493 . . . . 0.0 110.708 176.456 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 82.1 mt -75.36 -63.12 1.35 Allowed 'General case' 0 N--CA 1.45 -0.471 0 C-N-CA 123.062 0.545 . . . . 0.0 111.229 179.046 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 29.4 t70 -110.24 96.61 6.32 Favored 'General case' 0 C--N 1.332 -0.181 0 C-N-CA 125.406 1.482 . . . . 0.0 108.711 -179.207 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 2.6 mptp? -63.44 -59.85 4.13 Favored 'General case' 0 N--CA 1.454 -0.26 0 CA-C-O 122.234 1.016 . . . . 0.0 110.047 -175.118 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 56' ' ' ASN . . . . . . . . . . . . . 37.1 p-10 -154.28 32.12 0.43 Allowed 'General case' 0 C--N 1.327 -0.409 0 C-N-CA 125.671 1.588 . . . . 0.0 107.517 172.777 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . -67.47 -70.43 1.13 Allowed Glycine 0 C--N 1.34 0.761 0 N-CA-C 110.002 -1.239 . . . . 0.0 110.002 -169.911 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 2.4 p30 -129.54 -0.99 4.95 Favored 'General case' 0 N--CA 1.447 -0.601 0 C-N-CA 124.354 1.062 . . . . 0.0 112.752 177.531 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . 85.41 1.45 87.95 Favored Glycine 0 CA--C 1.53 1.017 0 CA-C-O 119.216 -0.769 . . . . 0.0 113.08 178.727 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 45.7 mt-10 -146.13 175.78 10.22 Favored 'General case' 0 N--CA 1.454 -0.24 0 C-N-CA 127.804 2.442 . . . . 0.0 106.637 173.707 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 61' ' ' VAL . . . . . . . . . . . . . 73.0 t -111.59 106.56 21.0 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.236 0 C-N-CA 122.742 0.417 . . . . 0.0 110.161 -169.541 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 53.8 p -82.56 160.73 22.49 Favored 'General case' 0 CA--C 1.539 0.544 0 C-N-CA 123.875 0.87 . . . . 0.0 111.343 173.557 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 63' ' ' PHE . . . . . . . . . . . . . 49.7 t80 -51.16 -49.93 59.93 Favored 'General case' 0 N--CA 1.468 0.426 0 O-C-N 121.422 -0.799 . . . . 0.0 111.417 -173.921 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 12.5 pt-20 -53.26 -28.57 28.28 Favored 'General case' 0 CA--C 1.534 0.342 0 C-N-CA 124.654 1.181 . . . . 0.0 114.145 -178.373 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 14.3 pt-20 -100.15 -30.25 12.04 Favored 'General case' 0 CA--C 1.529 0.167 0 C-N-CA 123.593 0.757 . . . . 0.0 110.432 177.88 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 5.3 t80 -52.62 -32.42 41.6 Favored 'General case' 0 CA--C 1.535 0.372 0 O-C-N 121.412 -0.805 . . . . 0.0 110.121 167.687 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 67' ' ' GLN . . . . . . . . . . . . . 0.8 OUTLIER -46.44 -34.66 4.9 Favored 'General case' 0 CA--C 1.538 0.507 0 N-CA-C 113.747 1.018 . . . . 0.0 113.747 169.15 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 77.1 t -61.23 -29.54 46.04 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.541 0 CA-C-N 119.104 0.865 . . . . 0.0 110.667 175.945 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 1.4 tt -71.98 -50.69 26.65 Favored 'General case' 0 N--CA 1.455 -0.188 0 N-CA-C 106.447 -1.686 . . . . 0.0 106.447 178.14 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 70' ' ' VAL . . . . . . . . . . . . . 18.3 t -54.38 -44.62 67.38 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.389 0 C-N-CA 122.819 0.448 . . . . 0.0 110.175 177.701 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 21.2 ttmm -52.54 -57.99 8.2 Favored 'General case' 0 N--CA 1.453 -0.302 0 C-N-CA 123.616 0.766 . . . . 0.0 109.97 172.334 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 12.5 mptt -49.53 -42.51 44.09 Favored 'General case' 0 CA--C 1.535 0.394 0 N-CA-C 112.825 0.676 . . . . 0.0 112.825 176.6 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 73' ' ' ILE . . . . . . . . . . . . . 46.0 mt -59.1 -34.34 53.02 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.485 0 CA-C-N 118.399 0.545 . . . . 0.0 110.966 176.116 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 21.4 m 50.08 51.69 16.17 Favored 'General case' 0 CA--C 1.532 0.263 0 C-N-CA 124.694 1.198 . . . . 0.0 111.306 178.745 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 75' ' ' GLN . . . . . . . . . . . . . 32.7 mt-30 . . . . . 0 C--O 1.27 2.161 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.193 178.385 . . . . . . . . 0 0 . 1 . 016 nuclear orig full ' A' A ' 1' ' ' LYS . . . . . . . . . . . . . 74.2 mmtt . . . . . 0 N--CA 1.45 -0.442 0 N-CA-C 108.528 -0.915 . . . . 0.0 108.528 . . . . . . . . . 0 0 . 1 . 016 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 86.3 p -69.09 154.54 94.91 Favored Pre-proline 0 CA--C 1.534 0.356 0 N-CA-C 109.758 -0.46 . . . . 0.0 109.758 175.996 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 80.0 Cg_exo -46.54 -39.58 22.77 Favored 'Trans proline' 0 N--CA 1.456 -0.702 0 C-N-CA 122.885 2.39 . . . . 0.0 112.378 169.548 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 2.8 mp0 -59.82 -49.35 78.07 Favored 'General case' 0 N--CA 1.456 -0.136 0 C-N-CA 123.956 0.902 . . . . 0.0 111.981 176.055 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 30.1 mt-10 -60.16 -45.44 93.06 Favored 'General case' 0 C--N 1.332 -0.188 0 N-CA-C 109.109 -0.7 . . . . 0.0 109.109 176.886 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 16.1 mt -61.52 -36.19 79.85 Favored 'General case' 0 N--CA 1.447 -0.579 0 C-N-CA 123.014 0.526 . . . . 0.0 112.28 179.17 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 55.8 tptt -61.31 -49.47 76.89 Favored 'General case' 0 C--N 1.329 -0.286 0 O-C-N 121.737 -0.602 . . . . 0.0 110.074 169.942 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . -50.65 -51.43 33.14 Favored Glycine 0 CA--C 1.531 1.067 0 N-CA-C 110.724 -0.95 . . . . 0.0 110.724 176.639 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 9' ' ' ILE . . . . . . . . . . . . . 3.4 mm -57.11 -55.53 20.0 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.197 0 C-N-CA 125.859 1.663 . . . . 0.0 109.417 176.628 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 10' ' ' PHE . . . . . . . . . . . . . 56.1 t80 -46.48 -52.22 13.66 Favored 'General case' 0 N--CA 1.45 -0.45 0 C-N-CA 123.49 0.716 . . . . 0.0 109.763 178.436 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 51.9 mt-10 -62.43 -50.87 69.78 Favored 'General case' 0 N--CA 1.454 -0.256 0 C-N-CA 123.214 0.606 . . . . 0.0 110.772 -179.614 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 18.1 ttmm -43.81 -53.76 5.73 Favored 'General case' 0 C--N 1.339 0.146 0 C-N-CA 124.657 1.183 . . . . 0.0 110.686 177.446 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 66.0 m-85 -78.24 -47.55 17.69 Favored 'General case' 0 N--CA 1.453 -0.32 0 C-N-CA 120.814 -0.355 . . . . 0.0 110.753 -175.922 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -52.84 -42.55 65.28 Favored 'General case' 0 C--N 1.329 -0.309 0 C-N-CA 123.493 0.717 . . . . 0.0 111.976 -179.116 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -66.05 -16.61 64.07 Favored 'General case' 0 C--N 1.332 -0.169 0 N-CA-C 113.367 0.877 . . . . 0.0 113.367 178.616 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 18.0 ttmm -71.05 83.82 0.7 Allowed 'General case' 0 N--CA 1.45 -0.432 0 N-CA-C 107.839 -1.171 . . . . 0.0 107.839 -179.011 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 38.2 mt-10 73.2 -37.21 0.38 Allowed 'General case' 0 CA--C 1.532 0.285 0 C-N-CA 126.96 2.104 . . . . 0.0 112.759 -178.134 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . -67.27 176.09 23.59 Favored Glycine 0 CA--C 1.532 1.131 0 N-CA-C 111.008 -0.837 . . . . 0.0 111.008 170.223 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 10.3 t70 -80.33 135.78 53.59 Favored Pre-proline 0 CA--C 1.533 0.305 0 N-CA-C 107.869 -1.16 . . . . 0.0 107.869 174.058 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 20' ' ' PRO . . . . . . . . . . . . . 19.5 Cg_endo -52.49 -25.8 26.37 Favored 'Trans proline' 0 CA--C 1.535 0.555 0 C-N-CA 123.205 2.603 . . . . 0.0 114.315 -178.973 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 50.7 m-80 -84.9 -6.35 59.34 Favored 'General case' 0 CA--C 1.533 0.321 0 CA-C-O 118.321 -0.847 . . . . 0.0 112.833 -178.654 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 17.6 tt0 -152.11 118.69 5.68 Favored 'General case' 0 CA--C 1.537 0.444 0 CA-C-N 119.66 1.118 . . . . 0.0 113.664 -167.929 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 52.0 mt -83.72 131.34 34.93 Favored 'General case' 0 N--CA 1.453 -0.292 0 C-N-CA 123.935 0.894 . . . . 0.0 111.186 177.764 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 92.2 p -79.71 175.63 10.45 Favored 'General case' 0 CA--C 1.536 0.431 0 N-CA-C 108.339 -0.986 . . . . 0.0 108.339 167.06 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 63.4 mttp -57.14 -41.92 79.98 Favored 'General case' 0 C--N 1.34 0.161 0 O-C-N 121.772 -0.58 . . . . 0.0 110.017 170.932 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 1.7 mp0 -63.67 -52.19 61.8 Favored 'General case' 0 N--CA 1.452 -0.366 0 C-N-CA 123.142 0.577 . . . . 0.0 110.214 -177.317 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -58.44 -41.59 85.44 Favored 'General case' 0 CA--C 1.536 0.406 0 CA-C-N 115.8 -0.636 . . . . 0.0 109.642 177.881 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 12.1 mt -56.2 -43.7 78.75 Favored 'General case' 0 C--O 1.219 -0.515 0 CA-C-N 119.174 0.897 . . . . 0.0 112.859 169.286 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 59.2 tttp -61.99 -45.93 91.47 Favored 'General case' 0 C--N 1.322 -0.593 0 CA-C-N 119.075 0.852 . . . . 0.0 110.19 -177.192 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 4.4 mm? -60.17 -50.92 71.79 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.148 -0.478 . . . . 0.0 111.159 175.556 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 7.7 tt -51.17 -55.21 19.08 Favored 'General case' 0 C--N 1.333 -0.111 0 C-N-CA 123.575 0.75 . . . . 0.0 109.711 176.876 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 47.2 mt -55.7 -56.29 22.15 Favored 'General case' 0 N--CA 1.451 -0.385 0 C-N-CA 124.346 1.058 . . . . 0.0 109.67 -177.647 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 27.5 mt-30 -55.28 -51.54 66.34 Favored 'General case' 0 N--CA 1.457 -0.086 0 CA-C-N 117.943 0.338 . . . . 0.0 111.232 -177.868 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 5.7 m -72.81 -45.8 56.52 Favored 'General case' 0 N--CA 1.451 -0.402 0 CA-C-N 116.15 -0.477 . . . . 0.0 111.077 -170.016 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 69.6 mm-40 -98.99 -39.05 8.74 Favored 'General case' 0 N--CA 1.451 -0.423 0 C-N-CA 123.757 0.823 . . . . 0.0 112.886 -169.365 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 16.8 m-85 -126.68 56.55 17.7 Favored Pre-proline 0 CA--C 1.531 0.235 0 C-N-CA 123.167 0.587 . . . . 0.0 111.505 -170.867 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 51.0 Cg_endo -61.57 -28.66 83.29 Favored 'Trans proline' 0 N--CA 1.453 -0.856 0 C-N-CA 122.294 1.996 . . . . 0.0 111.266 -175.789 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 9.0 t -57.21 -39.46 75.5 Favored 'General case' 0 CA--C 1.53 0.189 0 C-N-CA 123.354 0.661 . . . . 0.0 109.956 -179.006 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 26.3 mt -56.71 -31.79 64.85 Favored 'General case' 0 CA--C 1.533 0.293 0 O-C-N 121.617 -0.677 . . . . 0.0 111.603 177.909 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 68.2 mt -71.43 -5.56 33.74 Favored 'General case' 0 CA--C 1.533 0.302 0 O-C-N 121.606 -0.684 . . . . 0.0 112.519 -179.074 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 85.2 mttt -57.06 -41.29 78.45 Favored 'General case' 0 CA--C 1.53 0.182 0 CA-C-N 119.2 0.909 . . . . 0.0 110.198 169.234 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . 164.93 47.23 0.02 OUTLIER Glycine 0 CA--C 1.526 0.751 0 CA-C-N 116.537 -0.302 . . . . 0.0 112.882 174.27 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 43' ' ' GLY . . . . . . . . . . . . . . . -74.81 62.0 2.46 Favored Glycine 0 CA--C 1.528 0.885 0 N-CA-C 109.952 -1.259 . . . . 0.0 109.952 172.309 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 44' ' ' SER . . . . . . . . . . . . . 8.7 t 57.0 -162.21 0.2 Allowed 'General case' 0 CA--C 1.536 0.427 0 C-N-CA 125.03 1.332 . . . . 0.0 110.66 -169.432 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 20.1 p -86.9 160.77 18.6 Favored 'General case' 0 CA--C 1.527 0.092 0 N-CA-C 108.177 -1.046 . . . . 0.0 108.177 169.851 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 19.8 mt -61.96 -45.46 93.58 Favored 'General case' 0 N--CA 1.453 -0.307 0 N-CA-C 108.773 -0.825 . . . . 0.0 108.773 177.892 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 5.9 m-20 -60.25 -48.88 79.87 Favored 'General case' 0 N--CA 1.449 -0.523 0 CA-C-N 115.081 -0.963 . . . . 0.0 111.014 -179.448 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 7.9 tm-20 -64.79 -43.26 93.77 Favored 'General case' 0 N--CA 1.453 -0.317 0 N-CA-C 109.839 -0.43 . . . . 0.0 109.839 179.328 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 59.8 tp -57.34 -49.73 75.19 Favored 'General case' 0 C--N 1.333 -0.141 0 N-CA-C 109.657 -0.497 . . . . 0.0 109.657 176.829 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 50' ' ' PHE . . . . . . . . . . . . . 57.3 t80 -52.2 -46.24 65.54 Favored 'General case' 0 N--CA 1.452 -0.367 0 C-N-CA 124.043 0.937 . . . . 0.0 109.595 176.223 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 26.6 tt0 -56.66 -49.34 75.35 Favored 'General case' 0 N--CA 1.453 -0.299 0 CA-C-O 119.735 -0.174 . . . . 0.0 111.383 174.739 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 50.4 mt-10 -51.99 -47.92 64.65 Favored 'General case' 0 N--CA 1.465 0.3 0 CA-C-N 118.159 0.436 . . . . 0.0 111.353 177.582 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 80.8 mt -64.6 -55.51 19.86 Favored 'General case' 0 N--CA 1.452 -0.365 0 CA-C-O 121.269 0.557 . . . . 0.0 110.631 179.777 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 13.0 t70 -116.42 73.89 0.88 Allowed 'General case' 0 N--CA 1.452 -0.333 0 C-N-CA 126.954 2.102 . . . . 0.0 108.992 -171.093 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 17.1 mmtp -60.82 -57.29 13.28 Favored 'General case' 0 CA--C 1.523 -0.066 0 CA-C-O 121.9 0.857 . . . . 0.0 110.335 179.448 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 56' ' ' ASN . . . . . . . . . . . . . 34.3 p-10 -148.2 32.32 0.82 Allowed 'General case' 0 C--N 1.327 -0.39 0 C-N-CA 125.368 1.467 . . . . 0.0 108.099 175.217 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . -65.35 -69.43 1.35 Allowed Glycine 0 CA--C 1.525 0.69 0 N-CA-C 109.984 -1.246 . . . . 0.0 109.984 -174.693 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -145.92 -18.79 0.46 Allowed 'General case' 0 CA--C 1.54 0.584 0 C-N-CA 123.677 0.791 . . . . 0.0 112.259 -178.602 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . 106.55 -5.58 37.86 Favored Glycine 0 CA--C 1.531 1.083 0 CA-C-N 118.976 0.807 . . . . 0.0 112.575 -175.692 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 53.6 mt-10 -143.81 178.44 7.82 Favored 'General case' 0 N--CA 1.453 -0.325 0 C-N-CA 128.25 2.62 . . . . 0.0 106.764 171.823 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 61' ' ' VAL . . . . . . . . . . . . . 90.1 t -109.54 102.12 13.55 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.273 0 N-CA-C 109.794 -0.447 . . . . 0.0 109.794 -170.634 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 98.7 p -77.99 170.73 16.11 Favored 'General case' 0 CA--C 1.539 0.556 0 C-N-CA 123.196 0.598 . . . . 0.0 110.609 173.193 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 63' ' ' PHE . . . . . . . . . . . . . 54.9 t80 -59.61 -41.56 90.64 Favored 'General case' 0 CA--C 1.531 0.227 0 O-C-N 121.661 -0.65 . . . . 0.0 112.572 -172.313 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 1.9 pp20? -59.08 -57.65 12.13 Favored 'General case' 0 CA--C 1.534 0.362 0 O-C-N 121.942 -0.474 . . . . 0.0 110.918 179.782 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 10.8 pt-20 -62.42 -35.13 78.26 Favored 'General case' 0 CA--C 1.535 0.372 0 O-C-N 121.694 -0.629 . . . . 0.0 111.599 179.296 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 14.2 t80 -49.81 -34.02 18.34 Favored 'General case' 0 CA--C 1.536 0.442 0 O-C-N 121.343 -0.848 . . . . 0.0 112.47 169.53 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 67' ' ' GLN . . . . . . . . . . . . . 98.9 mm-40 -60.39 -23.26 64.19 Favored 'General case' 0 CA--C 1.537 0.459 0 O-C-N 120.697 -1.252 . . . . 0.0 112.68 176.311 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 58.5 t -62.77 -29.43 47.03 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.502 0 O-C-N 120.918 -1.114 . . . . 0.0 110.215 170.69 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 1.8 tt -72.38 -46.3 55.92 Favored 'General case' 0 N--CA 1.457 -0.095 0 N-CA-C 106.769 -1.567 . . . . 0.0 106.769 177.571 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 70' ' ' VAL . . . . . . . . . . . . . 36.3 t -57.64 -39.37 69.57 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.502 0 O-C-N 121.952 -0.468 . . . . 0.0 110.525 175.499 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 71' ' ' LYS . . . . . 0.774 ' O ' ' OXT' ' A' ' 75' ' ' GLN . 35.0 ttpt -58.5 -52.38 65.91 Favored 'General case' 0 CA--C 1.53 0.203 0 O-C-N 121.822 -0.548 . . . . 0.0 110.926 171.76 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 5.3 mptp? -47.14 -50.43 20.38 Favored 'General case' 0 CA--C 1.534 0.363 0 C-N-CA 123.062 0.545 . . . . 0.0 111.592 173.179 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 73' ' ' ILE . . . . . . . . . . . . . 61.9 mt -55.92 -52.97 43.47 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.33 0 N-CA-C 109.069 -0.715 . . . . 0.0 109.069 175.751 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 74' ' ' SER . . . . . 0.427 ' C ' ' OXT' ' A' ' 75' ' ' GLN . 4.7 m -77.71 47.25 0.6 Allowed 'General case' 0 CA--C 1.534 0.36 0 C-N-CA 124.629 1.171 . . . . 0.0 110.498 178.557 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 75' ' ' GLN . . . . . 0.774 ' OXT' ' O ' ' A' ' 71' ' ' LYS . 0.4 OUTLIER . . . . . 0 C--O 1.269 2.126 0 C-N-CA 125.591 1.557 . . . . 0.0 112.436 -169.592 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 1' ' ' LYS . . . . . . . . . . . . . 7.7 mptt . . . . . 0 N--CA 1.449 -0.504 0 N-CA-C 107.179 -1.415 . . . . 0.0 107.179 . . . . . . . . . 0 0 . 1 . 017 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 84.2 p -64.13 155.61 78.26 Favored Pre-proline 0 CA--C 1.537 0.48 0 CA-C-O 118.792 -0.623 . . . . 0.0 110.179 -179.749 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 83.4 Cg_exo -43.15 -42.7 9.87 Favored 'Trans proline' 0 N--CA 1.458 -0.572 0 C-N-CA 123.314 2.676 . . . . 0.0 113.001 172.077 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 3.0 mp0 -59.35 -47.87 83.78 Favored 'General case' 0 N--CA 1.455 -0.216 0 C-N-CA 123.934 0.894 . . . . 0.0 111.93 176.164 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 36.9 mt-10 -62.95 -43.97 97.35 Favored 'General case' 0 N--CA 1.453 -0.304 0 N-CA-C 109.349 -0.611 . . . . 0.0 109.349 178.41 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 47.7 mt -60.88 -39.7 90.22 Favored 'General case' 0 N--CA 1.45 -0.466 0 C-N-CA 123.386 0.674 . . . . 0.0 111.528 177.921 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 27.5 tptp -59.38 -46.17 89.43 Favored 'General case' 0 C--N 1.331 -0.215 0 O-C-N 121.806 -0.559 . . . . 0.0 110.348 170.05 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . -54.66 -53.51 38.61 Favored Glycine 0 CA--C 1.529 0.933 0 N-CA-C 110.338 -1.105 . . . . 0.0 110.338 179.129 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 9' ' ' ILE . . . . . . . . . . . . . 46.5 mt -51.33 -56.51 4.99 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.145 0 C-N-CA 125.641 1.576 . . . . 0.0 109.88 172.206 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 10' ' ' PHE . . . . . . . . . . . . . 49.1 t80 -49.24 -50.71 37.38 Favored 'General case' 0 N--CA 1.446 -0.673 0 N-CA-C 109.925 -0.398 . . . . 0.0 109.925 -178.438 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 57.3 mt-10 -61.99 -52.94 61.98 Favored 'General case' 0 CA--C 1.531 0.219 0 C-N-CA 122.444 0.298 . . . . 0.0 110.712 179.249 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 24.7 ttpt -43.32 -53.82 5.02 Favored 'General case' 0 C--N 1.339 0.126 0 C-N-CA 124.92 1.288 . . . . 0.0 110.736 178.645 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 66.6 m-85 -77.78 -47.63 18.5 Favored 'General case' 0 N--CA 1.45 -0.443 0 CA-C-N 116.578 -0.283 . . . . 0.0 110.408 -175.839 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -58.87 -37.18 75.95 Favored 'General case' 0 C--N 1.33 -0.275 0 O-C-N 121.417 -0.802 . . . . 0.0 112.743 -175.857 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -71.23 -22.81 61.94 Favored 'General case' 0 N--CA 1.454 -0.269 0 N-CA-C 112.211 0.448 . . . . 0.0 112.211 176.464 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 38.5 ttpt -77.01 70.37 3.41 Favored 'General case' 0 CA--C 1.534 0.336 0 N-CA-C 107.971 -1.122 . . . . 0.0 107.971 -178.89 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . 0.346 10.3 pt-20 54.85 109.71 0.01 OUTLIER 'General case' 0 N--CA 1.453 -0.304 0 C-N-CA 127.941 2.496 . . . . 0.0 113.776 -167.654 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 152.41 -159.0 28.16 Favored Glycine 0 CA--C 1.524 0.606 0 N-CA-C 104.734 -3.347 . . . . 0.0 104.734 -169.442 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 10.4 t70 -109.06 137.87 20.25 Favored Pre-proline 0 C--O 1.225 -0.235 0 N-CA-C 105.947 -1.872 . . . . 0.0 105.947 169.215 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 20' ' ' PRO . . . . . . . . . . . . . 16.5 Cg_endo -53.13 -26.4 32.93 Favored 'Trans proline' 0 CA--C 1.539 0.726 0 C-N-CA 121.896 1.731 . . . . 0.0 113.519 179.81 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 37.0 m-80 -92.01 -4.1 54.95 Favored 'General case' 0 N--CA 1.454 -0.275 0 C-N-CA 124.694 1.197 . . . . 0.0 111.937 -178.025 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 7.4 tt0 -155.13 116.66 4.05 Favored 'General case' 0 CA--C 1.539 0.533 0 CA-C-N 118.838 0.744 . . . . 0.0 112.485 -168.392 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 26.0 mt -78.29 131.49 37.09 Favored 'General case' 0 N--CA 1.455 -0.191 0 C-N-CA 123.127 0.571 . . . . 0.0 111.352 -172.642 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -77.77 158.86 29.39 Favored 'General case' 0 CA--C 1.54 0.56 0 C-N-CA 126.377 1.871 . . . . 0.0 108.867 168.766 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 31.7 ttmt -60.28 -46.02 91.29 Favored 'General case' 0 CA--C 1.534 0.342 0 O-C-N 121.546 -0.721 . . . . 0.0 112.098 -170.471 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 57.6 mm-40 -65.61 -41.35 92.85 Favored 'General case' 0 N--CA 1.454 -0.241 0 CA-C-O 121.729 0.776 . . . . 0.0 110.199 -179.216 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 4.6 mp0 -57.79 -48.08 80.73 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-N 115.527 -0.76 . . . . 0.0 109.219 175.756 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 5.0 mt -52.91 -45.33 67.55 Favored 'General case' 0 C--O 1.219 -0.546 0 N-CA-C 113.097 0.777 . . . . 0.0 113.097 168.24 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 5.7 ttpm? -58.51 -50.96 71.85 Favored 'General case' 0 C--N 1.324 -0.505 0 CA-C-N 118.883 0.765 . . . . 0.0 110.636 -178.947 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 4.1 mm? -59.58 -46.78 87.92 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.169 -0.469 . . . . 0.0 111.212 177.766 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 6.8 tt -51.45 -58.17 6.99 Favored 'General case' 0 N--CA 1.455 -0.212 0 C-N-CA 124.031 0.933 . . . . 0.0 109.064 174.787 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 38.7 mt -54.02 -58.55 6.88 Favored 'General case' 0 C--N 1.33 -0.259 0 C-N-CA 123.708 0.803 . . . . 0.0 109.421 -178.021 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 1.1 tm0? -52.56 -53.55 44.8 Favored 'General case' 0 N--CA 1.453 -0.288 0 C-N-CA 123.514 0.726 . . . . 0.0 111.2 -177.401 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 11.1 m -73.24 -47.56 42.17 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.657 -0.247 . . . . 0.0 110.997 -171.105 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 69.3 mm-40 -90.69 -37.93 13.41 Favored 'General case' 0 N--CA 1.448 -0.548 0 C-N-CA 123.647 0.779 . . . . 0.0 112.021 -169.033 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 87.0 m-85 -137.48 62.96 39.27 Favored Pre-proline 0 CA--C 1.531 0.247 0 C-N-CA 123.855 0.862 . . . . 0.0 111.784 -170.614 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 51.4 Cg_endo -60.7 -22.18 72.16 Favored 'Trans proline' 0 N--CA 1.456 -0.693 0 C-N-CA 122.382 2.054 . . . . 0.0 111.307 178.213 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 1.6 p -47.48 -52.5 17.02 Favored 'General case' 0 N--CA 1.449 -0.522 0 C-N-CA 125.886 1.674 . . . . 0.0 110.322 170.178 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 56.2 mt -62.68 -23.02 66.91 Favored 'General case' 0 C--N 1.33 -0.243 0 C-N-CA 123.524 0.729 . . . . 0.0 112.666 -177.844 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 50.7 mt -72.84 -23.92 60.82 Favored 'General case' 0 CA--C 1.529 0.167 0 CA-C-N 118.462 0.574 . . . . 0.0 111.563 173.507 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 81.1 mttt -67.62 149.09 50.52 Favored 'General case' 0 N--CA 1.445 -0.677 0 N-CA-C 106.776 -1.564 . . . . 0.0 106.776 168.985 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . 72.51 -65.31 1.38 Allowed Glycine 0 CA--C 1.533 1.159 0 N-CA-C 108.049 -2.021 . . . . 0.0 108.049 -167.212 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 43' ' ' GLY . . . . . . . . . . . . . . . 73.74 -55.82 2.13 Favored Glycine 0 CA--C 1.527 0.816 0 C-N-CA 125.029 1.299 . . . . 0.0 115.316 167.154 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 44' ' ' SER . . . . . . . . . . . . . 30.8 p 55.78 -105.0 0.24 Allowed 'General case' 0 N--CA 1.442 -0.83 0 C-N-CA 125.35 1.46 . . . . 0.0 108.914 -167.925 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 44.4 p -139.51 145.77 39.12 Favored 'General case' 0 N--CA 1.451 -0.395 0 N-CA-C 107.175 -1.417 . . . . 0.0 107.175 167.067 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 50.5 tp -49.61 -42.67 45.43 Favored 'General case' 0 N--CA 1.454 -0.265 0 C-N-CA 122.916 0.486 . . . . 0.0 109.909 170.017 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 6.1 m-20 -57.28 -53.74 54.66 Favored 'General case' 0 N--CA 1.448 -0.563 0 C-N-CA 123.907 0.883 . . . . 0.0 111.08 177.28 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 14.7 tp10 -55.93 -49.17 74.24 Favored 'General case' 0 C--N 1.332 -0.193 0 N-CA-C 110.123 -0.325 . . . . 0.0 110.123 178.741 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 43.5 tp -59.41 -47.95 83.51 Favored 'General case' 0 CA--C 1.532 0.254 0 CA-C-O 121.304 0.573 . . . . 0.0 110.152 -179.882 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 50' ' ' PHE . . . . . . . . . . . . . 74.3 t80 -55.53 -49.05 73.66 Favored 'General case' 0 N--CA 1.451 -0.378 0 C-N-CA 124.165 0.986 . . . . 0.0 110.534 178.423 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 32.9 mt-10 -59.06 -49.29 78.44 Favored 'General case' 0 N--CA 1.455 -0.208 0 C-N-CA 123.217 0.607 . . . . 0.0 110.591 177.34 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 30.5 tp10 -53.92 -44.88 70.95 Favored 'General case' 0 N--CA 1.456 -0.167 0 C-N-CA 123.463 0.705 . . . . 0.0 110.977 178.544 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 95.1 mt -72.37 -47.53 48.72 Favored 'General case' 0 N--CA 1.45 -0.453 0 CA-C-O 120.802 0.334 . . . . 0.0 111.495 -179.767 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 37.7 t0 -75.6 68.5 2.22 Favored 'General case' 0 CA--C 1.533 0.303 0 C-N-CA 124.412 1.085 . . . . 0.0 110.267 -179.942 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 34.3 mmtm -60.8 -35.12 75.68 Favored 'General case' 0 CA--C 1.534 0.363 0 C-N-CA 123.41 0.684 . . . . 0.0 111.273 170.42 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 56' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER -59.65 -39.44 84.41 Favored 'General case' 0 CA--C 1.536 0.412 0 C-N-CA 123.03 0.532 . . . . 0.0 111.203 -177.401 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . 104.16 -11.43 51.79 Favored Glycine 0 CA--C 1.53 0.97 0 C-N-CA 124.278 0.942 . . . . 0.0 114.116 170.184 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 3.0 p-10 -78.32 10.0 3.41 Favored 'General case' 0 CA--C 1.535 0.381 0 CA-C-N 119.746 1.773 . . . . 0.0 114.376 -169.885 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . 79.44 32.44 38.21 Favored Glycine 0 CA--C 1.526 0.728 0 CA-C-N 118.596 0.634 . . . . 0.0 112.347 174.298 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 51.2 mt-10 -161.0 162.54 31.86 Favored 'General case' 0 CA--C 1.534 0.348 0 C-N-CA 126.325 1.85 . . . . 0.0 106.15 168.781 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 61' ' ' VAL . . . . . . . . . . . . . 26.5 t -108.8 115.67 50.0 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.455 0 CA-C-N 118.706 0.685 . . . . 0.0 110.896 -175.833 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -78.92 150.85 32.0 Favored 'General case' 0 CA--C 1.537 0.45 0 C-N-CA 124.863 1.265 . . . . 0.0 111.362 179.411 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 63' ' ' PHE . . . . . . . . . . . . . 66.7 t80 -51.53 -44.7 62.71 Favored 'General case' 0 N--CA 1.468 0.427 0 O-C-N 121.446 -0.784 . . . . 0.0 112.586 -173.746 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 2.9 pm0 -59.77 -31.15 69.39 Favored 'General case' 0 N--CA 1.449 -0.524 0 N-CA-C 113.092 0.775 . . . . 0.0 113.092 -179.395 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 21.6 pt-20 -95.04 -27.65 15.51 Favored 'General case' 0 CA--C 1.531 0.222 0 CA-C-N 118.679 0.672 . . . . 0.0 110.797 179.001 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 9.5 t80 -53.21 -25.66 14.78 Favored 'General case' 0 CA--C 1.536 0.426 0 C-N-CA 123.6 0.76 . . . . 0.0 110.201 166.992 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 67' ' ' GLN . . . . . . . . . . . . . 66.4 mm-40 -51.58 -25.04 6.13 Favored 'General case' 0 CA--C 1.538 0.5 0 N-CA-C 113.633 0.975 . . . . 0.0 113.633 169.869 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 99.4 t -60.86 -33.06 53.9 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.556 0 CA-C-N 119.653 1.115 . . . . 0.0 110.735 172.136 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 10.5 tt -72.16 -46.16 57.53 Favored 'General case' 0 N--CA 1.457 -0.117 0 N-CA-C 107.056 -1.461 . . . . 0.0 107.056 176.694 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 70' ' ' VAL . . . . . . . . . . . . . 21.6 t -55.66 -42.05 67.54 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.457 0 N-CA-C 110.272 -0.27 . . . . 0.0 110.272 176.775 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 37.3 ttmt -56.79 -55.62 32.01 Favored 'General case' 0 N--CA 1.455 -0.205 0 C-N-CA 124.068 0.947 . . . . 0.0 110.588 173.431 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 14.0 mptt -50.1 -47.7 53.73 Favored 'General case' 0 CA--C 1.537 0.448 0 C-N-CA 122.341 0.257 . . . . 0.0 111.678 175.785 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 73' ' ' ILE . . . . . . . . . . . . . 25.3 mm -56.97 -50.13 77.08 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.265 0 C-N-CA 123.183 0.593 . . . . 0.0 109.959 176.507 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 14.2 t 71.21 -63.76 0.41 Allowed 'General case' 0 CA--C 1.531 0.249 0 C-N-CA 126.966 2.106 . . . . 0.0 111.923 175.022 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 75' ' ' GLN . . . . . . . . . . . . . 3.0 pt20 . . . . . 0 C--O 1.271 2.192 0 C-N-CA 124.816 1.246 . . . . 0.0 111.477 -179.735 . . . . . . . . 0 0 . 1 . 018 nuclear orig full ' A' A ' 1' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 N--CA 1.449 -0.485 0 N-CA-C 108.69 -0.855 . . . . 0.0 108.69 . . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 77.4 p -71.32 160.93 81.03 Favored Pre-proline 0 CA--C 1.532 0.274 0 N-CA-C 109.208 -0.664 . . . . 0.0 109.208 176.686 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 82.6 Cg_exo -47.5 -42.16 29.01 Favored 'Trans proline' 0 CA--C 1.536 0.625 0 C-N-CA 122.814 2.343 . . . . 0.0 112.14 169.648 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 42.3 tt0 -58.31 -53.84 53.74 Favored 'General case' 0 N--CA 1.455 -0.175 0 C-N-CA 123.777 0.831 . . . . 0.0 111.189 177.022 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 47.0 mm-40 -62.84 -40.95 99.01 Favored 'General case' 0 N--CA 1.452 -0.367 0 N-CA-C 109.149 -0.686 . . . . 0.0 109.149 -179.265 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 40.8 mt -59.49 -38.16 80.14 Favored 'General case' 0 N--CA 1.448 -0.558 0 C-N-CA 124.286 1.035 . . . . 0.0 111.896 176.609 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 23.2 tptm -60.66 -49.92 75.58 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-N 119.069 0.85 . . . . 0.0 110.712 169.982 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . -53.45 -52.96 37.82 Favored Glycine 0 CA--C 1.531 1.039 0 N-CA-C 110.519 -1.032 . . . . 0.0 110.519 -179.542 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 9' ' ' ILE . . . . . . . . . . . . . 78.3 mt -51.89 -57.25 3.83 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.259 0 C-N-CA 126.081 1.752 . . . . 0.0 109.935 172.044 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 10' ' ' PHE . . . . . . . . . . . . . 44.4 t80 -48.84 -50.03 36.47 Favored 'General case' 0 N--CA 1.446 -0.663 0 N-CA-C 109.239 -0.652 . . . . 0.0 109.239 -177.389 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 51.0 mt-10 -61.61 -53.25 58.67 Favored 'General case' 0 CA--C 1.532 0.268 0 C-N-CA 123.047 0.539 . . . . 0.0 110.717 178.709 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 1.4 ttpm? -45.14 -50.74 11.05 Favored 'General case' 0 C--N 1.34 0.167 0 C-N-CA 124.197 0.999 . . . . 0.0 110.979 178.075 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 54.6 m-85 -77.74 -52.87 8.26 Favored 'General case' 0 N--CA 1.448 -0.561 0 N-CA-C 110.072 -0.344 . . . . 0.0 110.072 -175.397 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -50.41 -37.67 38.99 Favored 'General case' 0 C--N 1.33 -0.253 0 C-N-CA 125.278 1.431 . . . . 0.0 112.762 -179.79 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -43.6 -42.78 5.33 Favored 'General case' 0 CA--C 1.535 0.379 0 C-N-CA 123.309 0.644 . . . . 0.0 111.874 173.832 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 10.2 mtpp -66.61 -23.81 66.23 Favored 'General case' 0 CA--C 1.534 0.338 0 N-CA-C 112.599 0.592 . . . . 0.0 112.599 -177.959 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 27.8 tt0 -66.06 -27.61 68.22 Favored 'General case' 0 CA--C 1.535 0.37 0 CA-C-N 118.512 0.596 . . . . 0.0 110.041 170.37 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 108.87 -46.88 1.1 Allowed Glycine 0 CA--C 1.525 0.682 0 N-CA-C 108.582 -1.807 . . . . 0.0 108.582 -169.685 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 43.8 t0 -90.61 105.01 10.38 Favored Pre-proline 0 CA--C 1.538 0.504 0 CA-C-O 118.519 -0.753 . . . . 0.0 110.323 177.909 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 20' ' ' PRO . . . . . . . . . . . . . 29.4 Cg_endo -57.72 -21.17 46.37 Favored 'Trans proline' 0 N--CA 1.461 -0.437 0 C-N-CA 122.448 2.098 . . . . 0.0 113.365 178.338 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 42.7 m-80 -79.85 -4.92 54.29 Favored 'General case' 0 N--CA 1.45 -0.435 0 CA-C-O 117.849 -1.072 . . . . 0.0 112.74 -178.194 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 28.1 tt0 -147.57 135.08 20.83 Favored 'General case' 0 CA--C 1.539 0.536 0 CA-C-N 119.758 1.163 . . . . 0.0 113.385 -168.717 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 81.9 mt -104.17 133.12 49.63 Favored 'General case' 0 C--N 1.343 0.317 0 C-N-CA 125.171 1.389 . . . . 0.0 111.154 177.524 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 78.8 p -80.4 174.78 11.27 Favored 'General case' 0 CA--C 1.533 0.304 0 C-N-CA 123.876 0.87 . . . . 0.0 108.929 168.297 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 60.1 mttp -56.43 -40.97 75.64 Favored 'General case' 0 C--N 1.34 0.16 0 O-C-N 122.043 -0.411 . . . . 0.0 110.215 169.97 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 26.4 mt-10 -68.56 -47.1 67.7 Favored 'General case' 0 CA--C 1.517 -0.299 0 CA-C-O 120.813 0.339 . . . . 0.0 110.242 -175.764 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -56.97 -46.91 81.86 Favored 'General case' 0 N--CA 1.453 -0.312 0 CA-C-N 115.986 -0.552 . . . . 0.0 109.751 174.815 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 12.1 mt -56.27 -43.77 79.08 Favored 'General case' 0 CA--C 1.512 -0.518 0 CA-C-N 119.035 0.834 . . . . 0.0 112.988 171.827 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 65.1 tttm -61.58 -48.31 81.52 Favored 'General case' 0 C--N 1.323 -0.573 0 CA-C-N 118.672 0.669 . . . . 0.0 109.697 -176.726 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 92.0 mt -61.51 -46.7 88.86 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.232 -0.44 . . . . 0.0 111.3 177.763 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 7.1 tt -50.1 -58.16 6.13 Favored 'General case' 0 CA--C 1.521 -0.147 0 C-N-CA 124.213 1.005 . . . . 0.0 109.443 174.577 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 45.1 mt -57.68 -53.09 62.07 Favored 'General case' 0 N--CA 1.45 -0.433 0 N-CA-C 109.091 -0.707 . . . . 0.0 109.091 -178.332 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 25.5 tt0 -52.74 -47.13 67.62 Favored 'General case' 0 N--CA 1.453 -0.309 0 O-C-N 121.651 -0.656 . . . . 0.0 111.879 -177.41 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 2.5 m -75.46 -51.27 13.42 Favored 'General case' 0 CA--C 1.534 0.358 0 C-N-CA 121.058 -0.257 . . . . 0.0 111.144 -176.21 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 38.8 mm-40 -90.69 -31.25 16.67 Favored 'General case' 0 N--CA 1.451 -0.425 0 C-N-CA 123.6 0.76 . . . . 0.0 112.828 -166.724 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 82.2 m-85 -145.9 69.37 13.25 Favored Pre-proline 0 CA--C 1.537 0.45 0 C-N-CA 124.863 1.265 . . . . 0.0 111.581 -172.801 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 41.1 Cg_endo -61.41 -16.74 49.29 Favored 'Trans proline' 0 N--CA 1.457 -0.651 0 C-N-CA 122.772 2.315 . . . . 0.0 112.504 -179.421 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 4.0 p -66.55 -62.73 1.3 Allowed 'General case' 0 N--CA 1.448 -0.536 0 C-N-CA 124.377 1.071 . . . . 0.0 108.564 169.389 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 96.6 mt -58.65 -28.0 65.28 Favored 'General case' 0 CA--C 1.531 0.227 0 C-N-CA 123.879 0.872 . . . . 0.0 111.948 -178.858 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 28.4 tp -51.09 -45.59 61.52 Favored 'General case' 0 N--CA 1.463 0.198 0 CA-C-N 118.121 0.419 . . . . 0.0 110.871 169.877 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 64.4 mttm -71.21 -54.19 11.8 Favored 'General case' 0 N--CA 1.448 -0.574 0 N-CA-C 107.951 -1.129 . . . . 0.0 107.951 173.913 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . 72.88 -67.57 1.35 Allowed Glycine 0 CA--C 1.527 0.795 0 C-N-CA 124.311 0.958 . . . . 0.0 112.274 170.582 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 43' ' ' GLY . . . . . . . . . . . . . . . 163.75 -60.57 0.26 Allowed Glycine 0 CA--C 1.524 0.601 0 N-CA-C 110.002 -1.239 . . . . 0.0 110.002 179.74 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 44' ' ' SER . . . . . . . . . . . . . 17.7 p -96.69 -89.57 0.27 Allowed 'General case' 0 N--CA 1.452 -0.348 0 C-N-CA 123.979 0.911 . . . . 0.0 110.195 -175.616 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 66.2 p -150.67 156.21 40.88 Favored 'General case' 0 C--O 1.233 0.201 0 C-N-CA 123.999 0.919 . . . . 0.0 109.827 179.424 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 20.3 mt -55.74 -42.94 76.11 Favored 'General case' 0 C--O 1.223 -0.309 0 N-CA-C 108.645 -0.872 . . . . 0.0 108.645 170.474 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 5.1 m-20 -52.28 -60.59 3.03 Favored 'General case' 0 N--CA 1.449 -0.504 0 C-N-CA 124.311 1.044 . . . . 0.0 110.32 176.161 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 34.2 tt0 -53.64 -46.54 70.56 Favored 'General case' 0 N--CA 1.455 -0.205 0 O-C-N 122.425 -0.172 . . . . 0.0 110.806 179.863 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 87.9 mt -56.38 -49.68 73.76 Favored 'General case' 0 C--O 1.224 -0.277 0 C-N-CA 121.069 -0.252 . . . . 0.0 110.384 176.632 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 50' ' ' PHE . . . . . . . . . . . . . 55.0 t80 -54.67 -51.61 64.94 Favored 'General case' 0 C--N 1.329 -0.319 0 C-N-CA 124.567 1.147 . . . . 0.0 110.45 -178.927 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 1.8 mp0 -56.13 -48.25 76.58 Favored 'General case' 0 CA--C 1.531 0.245 0 CA-C-O 120.641 0.258 . . . . 0.0 110.548 174.784 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 37.0 tt0 -55.23 -43.77 74.85 Favored 'General case' 0 N--CA 1.456 -0.155 0 C-N-CA 123.047 0.539 . . . . 0.0 111.437 -179.745 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 48.3 mt -65.64 -56.59 11.36 Favored 'General case' 0 N--CA 1.448 -0.573 0 N-CA-C 109.838 -0.43 . . . . 0.0 109.838 176.028 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 47.2 t0 -79.71 60.76 3.47 Favored 'General case' 0 CA--C 1.532 0.255 0 C-N-CA 123.856 0.862 . . . . 0.0 110.909 -174.601 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 33.3 mmtm -53.93 -40.59 66.88 Favored 'General case' 0 C--N 1.34 0.163 0 C-N-CA 124.003 0.921 . . . . 0.0 111.131 174.272 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 56' ' ' ASN . . . . . . . . . . . . . 12.3 p-10 -65.46 -13.45 58.81 Favored 'General case' 0 CA--C 1.534 0.34 0 C-N-CA 125.316 1.447 . . . . 0.0 112.573 176.879 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . 58.45 40.65 94.61 Favored Glycine 0 CA--C 1.526 0.771 0 C-N-CA 124.107 0.861 . . . . 0.0 112.966 173.51 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 1.5 p30 -77.84 -26.08 49.2 Favored 'General case' 0 N--CA 1.452 -0.347 0 CA-C-N 118.252 1.026 . . . . 0.0 111.436 -179.988 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . 122.71 -19.85 7.86 Favored Glycine 0 CA--C 1.528 0.847 0 CA-C-O 118.712 -1.049 . . . . 0.0 112.873 176.815 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 50.9 mt-10 -145.85 175.99 10.01 Favored 'General case' 0 CA--C 1.529 0.149 0 C-N-CA 126.751 2.02 . . . . 0.0 107.99 178.446 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 61' ' ' VAL . . . . . . . . . . . . . 5.5 t -112.18 106.13 20.15 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.295 0 CA-C-N 118.129 0.422 . . . . 0.0 111.017 -169.621 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 59.9 p -78.87 167.72 20.75 Favored 'General case' 0 CA--C 1.539 0.531 0 C-N-CA 122.995 0.518 . . . . 0.0 111.322 173.578 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 63' ' ' PHE . . . . . . . . . . . . . 57.2 t80 -60.93 -38.15 84.81 Favored 'General case' 0 CA--C 1.533 0.294 0 O-C-N 121.447 -0.783 . . . . 0.0 112.754 -172.81 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 1.9 pp20? -63.95 -56.66 13.52 Favored 'General case' 0 CA--C 1.536 0.408 0 O-C-N 121.8 -0.562 . . . . 0.0 111.061 -178.926 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 9.1 pt-20 -60.55 -36.86 79.46 Favored 'General case' 0 CA--C 1.537 0.443 0 O-C-N 121.425 -0.797 . . . . 0.0 111.408 176.805 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 21.5 t80 -52.32 -26.87 13.31 Favored 'General case' 0 CA--C 1.538 0.489 0 O-C-N 121.551 -0.718 . . . . 0.0 112.209 170.938 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 67' ' ' GLN . . . . . . . . . . . . . 58.6 mm-40 -55.04 -23.21 18.83 Favored 'General case' 0 CA--C 1.535 0.37 0 CA-C-N 119.768 1.167 . . . . 0.0 113.43 172.821 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 92.7 t -58.59 -32.95 47.19 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.555 0 CA-C-N 119.861 1.21 . . . . 0.0 110.468 171.428 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 22.1 tp -73.81 -48.43 31.42 Favored 'General case' 0 N--CA 1.453 -0.304 0 N-CA-C 107.404 -1.332 . . . . 0.0 107.404 176.976 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 70' ' ' VAL . . . . . . . . . . . . . 38.4 t -55.03 -39.06 48.26 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.476 0 C-N-CA 122.543 0.337 . . . . 0.0 110.67 179.501 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 71' ' ' LYS . . . . . 1.016 ' O ' ' OXT' ' A' ' 75' ' ' GLN . 20.9 ttmm -56.12 -55.88 27.61 Favored 'General case' 0 N--CA 1.453 -0.322 0 C-N-CA 124.016 0.926 . . . . 0.0 110.36 171.835 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 1.2 mptm? -53.31 -45.15 68.89 Favored 'General case' 0 CA--C 1.536 0.413 0 N-CA-C 111.985 0.365 . . . . 0.0 111.985 176.276 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 73' ' ' ILE . . . . . . . . . . . . . 71.5 mt -55.84 -50.49 68.18 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.216 0 N-CA-C 108.539 -0.911 . . . . 0.0 108.539 175.29 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 6.0 m -76.74 47.2 0.49 Allowed 'General case' 0 CA--C 1.536 0.411 0 C-N-CA 124.743 1.217 . . . . 0.0 110.323 174.872 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 75' ' ' GLN . . . . . 1.016 ' OXT' ' O ' ' A' ' 71' ' ' LYS . 19.6 tt0 . . . . . 0 C--O 1.27 2.17 0 C-N-CA 123.937 0.895 . . . . 0.0 109.439 -168.52 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 1' ' ' LYS . . . . . 1.07 ' O ' ' OXT' ' A' ' 75' ' ' GLN . 11.7 mptt . . . . . 0 N--CA 1.45 -0.456 0 N-CA-C 108.889 -0.782 . . . . 0.0 108.889 . . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 2.0 p -96.89 168.98 9.39 Favored Pre-proline 0 C--O 1.238 0.477 0 N-CA-C 107.384 -1.339 . . . . 0.0 107.384 168.003 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 90.3 Cg_exo -45.69 -32.69 9.04 Favored 'Trans proline' 0 N--CA 1.455 -0.765 0 C-N-CA 123.451 2.768 . . . . 0.0 112.972 169.072 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 19.0 mt-10 -67.58 -49.0 65.23 Favored 'General case' 0 N--CA 1.455 -0.18 0 CA-C-O 121.302 0.572 . . . . 0.0 110.273 -178.145 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 5.6 mp0 -65.51 -43.18 90.9 Favored 'General case' 0 N--CA 1.452 -0.353 0 N-CA-C 107.835 -1.172 . . . . 0.0 107.835 178.821 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 14.7 mt -57.2 -37.81 72.73 Favored 'General case' 0 N--CA 1.452 -0.341 0 N-CA-C 112.321 0.489 . . . . 0.0 112.321 177.012 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 55.7 tptt -61.83 -51.15 69.44 Favored 'General case' 0 C--N 1.332 -0.152 0 CA-C-N 118.873 0.76 . . . . 0.0 110.967 170.366 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . -52.51 -50.76 46.8 Favored Glycine 0 CA--C 1.531 1.051 0 N-CA-C 110.521 -1.032 . . . . 0.0 110.521 179.869 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 9' ' ' ILE . . . . . . . . . . . . . 88.0 mt -54.79 -54.75 20.26 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.298 0 C-N-CA 126.663 1.985 . . . . 0.0 109.923 173.745 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 10' ' ' PHE . . . . . . . . . . . . . 52.0 t80 -48.63 -52.8 21.29 Favored 'General case' 0 N--CA 1.453 -0.279 0 CA-C-N 118.29 0.495 . . . . 0.0 109.807 179.081 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 52.5 mt-10 -61.26 -52.69 63.7 Favored 'General case' 0 N--CA 1.455 -0.221 0 C-N-CA 123.075 0.55 . . . . 0.0 110.271 -177.986 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 25.9 ttpt -47.79 -57.74 5.23 Favored 'General case' 0 CA--C 1.53 0.191 0 C-N-CA 124.624 1.17 . . . . 0.0 110.838 177.409 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 38.6 m-85 -75.28 -34.62 61.35 Favored 'General case' 0 N--CA 1.45 -0.474 0 CA-C-O 119.193 -0.432 . . . . 0.0 110.522 -170.105 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -57.31 -63.95 1.05 Allowed 'General case' 0 N--CA 1.453 -0.299 0 N-CA-C 109.422 -0.585 . . . . 0.0 109.422 170.87 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -51.49 -31.88 25.29 Favored 'General case' 0 CA--C 1.529 0.143 0 C-N-CA 125.311 1.445 . . . . 0.0 112.682 -177.154 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 21.2 ttmm -53.56 -29.56 37.68 Favored 'General case' 0 CA--C 1.536 0.416 0 C-N-CA 123.274 0.63 . . . . 0.0 112.486 -179.851 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 26.9 tt0 -141.93 -43.49 0.34 Allowed 'General case' 0 CA--C 1.532 0.287 0 CA-C-N 118.429 0.559 . . . . 0.0 111.909 -173.898 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . -110.41 -173.65 20.31 Favored Glycine 0 CA--C 1.526 0.731 0 C-N-CA 124.85 1.214 . . . . 0.0 111.279 -173.545 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 9.3 t70 -63.93 135.01 96.12 Favored Pre-proline 0 CA--C 1.536 0.404 0 CA-C-O 118.203 -0.904 . . . . 0.0 108.617 174.769 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 20' ' ' PRO . . . . . . . . . . . . . 11.9 Cg_endo -51.59 -24.94 18.4 Favored 'Trans proline' 0 CA--C 1.535 0.574 0 C-N-CA 123.656 2.904 . . . . 0.0 114.824 -176.499 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 58.0 m-80 -84.2 3.76 33.73 Favored 'General case' 0 CA--C 1.531 0.222 0 C-N-CA 124.008 0.923 . . . . 0.0 112.017 -178.021 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 0.7 OUTLIER -151.02 127.51 10.73 Favored 'General case' 0 N--CA 1.452 -0.368 0 O-C-N 121.395 -0.816 . . . . 0.0 112.629 -169.223 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 80.8 mt -93.44 129.43 39.61 Favored 'General case' 0 N--CA 1.452 -0.372 0 C-N-CA 122.883 0.473 . . . . 0.0 111.11 171.222 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 41.3 p -78.92 174.12 11.85 Favored 'General case' 0 CA--C 1.534 0.343 0 C-N-CA 124.255 1.022 . . . . 0.0 108.577 166.952 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 98.4 mttt -57.9 -44.84 87.0 Favored 'General case' 0 C--O 1.226 -0.153 0 O-C-N 121.837 -0.539 . . . . 0.0 110.483 172.408 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 24.3 mt-10 -66.73 -42.66 85.94 Favored 'General case' 0 N--CA 1.454 -0.253 0 CA-C-O 121.282 0.563 . . . . 0.0 110.168 -176.713 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 26.6 mt-10 -58.39 -49.42 77.31 Favored 'General case' 0 N--CA 1.451 -0.4 0 CA-C-N 115.738 -0.664 . . . . 0.0 109.211 176.152 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 10.7 mt -54.08 -42.73 69.65 Favored 'General case' 0 CA--C 1.512 -0.483 0 N-CA-C 113.28 0.845 . . . . 0.0 113.28 169.868 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 5.9 ttpm? -60.46 -53.04 62.33 Favored 'General case' 0 C--N 1.323 -0.554 0 CA-C-N 118.637 0.653 . . . . 0.0 109.845 -177.641 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 10.5 mp -59.16 -44.85 92.14 Favored 'General case' 0 C--O 1.235 0.301 0 CA-C-O 120.647 0.261 . . . . 0.0 111.294 178.433 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 6.5 tt -51.14 -57.89 7.56 Favored 'General case' 0 N--CA 1.456 -0.125 0 C-N-CA 123.682 0.793 . . . . 0.0 109.6 174.242 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 43.3 mt -54.86 -54.05 47.45 Favored 'General case' 0 N--CA 1.455 -0.203 0 C-N-CA 124.052 0.941 . . . . 0.0 109.956 -178.887 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 42.7 mt-30 -50.25 -53.11 30.61 Favored 'General case' 0 N--CA 1.457 -0.096 0 C-N-CA 123.098 0.559 . . . . 0.0 111.363 179.732 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 2.0 m -73.22 -49.64 26.83 Favored 'General case' 0 N--CA 1.454 -0.264 0 C-N-CA 120.28 -0.568 . . . . 0.0 111.259 -172.015 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 62.0 mm-40 -95.78 -31.02 13.39 Favored 'General case' 0 N--CA 1.449 -0.509 0 N-CA-C 113.382 0.882 . . . . 0.0 113.382 -166.644 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 67.9 m-85 -143.18 66.37 16.19 Favored Pre-proline 0 CA--C 1.536 0.415 0 N-CA-C 113.198 0.814 . . . . 0.0 113.198 -171.577 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 83.9 Cg_exo -48.7 -33.29 24.07 Favored 'Trans proline' 0 CA--C 1.535 0.568 0 C-N-CA 123.191 2.594 . . . . 0.0 112.598 168.884 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 2.8 p -53.97 -57.06 12.41 Favored 'General case' 0 N--CA 1.447 -0.58 0 C-N-CA 125.719 1.607 . . . . 0.0 109.497 176.657 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 79.1 mt -65.53 -39.88 92.3 Favored 'General case' 0 N--CA 1.452 -0.344 0 CA-C-N 115.51 -0.768 . . . . 0.0 111.117 177.75 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 13.2 tp -52.52 -49.44 64.82 Favored 'General case' 0 CA--C 1.529 0.169 0 CA-C-O 120.917 0.389 . . . . 0.0 110.2 177.798 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 61.5 mtpt -67.18 -53.06 33.91 Favored 'General case' 0 N--CA 1.451 -0.4 0 C-N-CA 123.309 0.644 . . . . 0.0 110.168 175.791 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . -76.24 57.75 3.24 Favored Glycine 0 CA--C 1.528 0.873 0 C-N-CA 124.856 1.217 . . . . 0.0 112.08 -177.567 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 43' ' ' GLY . . . . . . . . . . . . . . . -160.79 103.39 0.22 Allowed Glycine 0 CA--C 1.524 0.638 0 N-CA-C 108.311 -1.915 . . . . 0.0 108.311 179.32 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 44' ' ' SER . . . . . . . . . . . . . 3.4 m -41.73 -48.8 4.27 Favored 'General case' 0 CA--C 1.53 0.209 0 C-N-CA 125.442 1.497 . . . . 0.0 112.137 -174.535 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 68.8 p -145.93 154.52 42.03 Favored 'General case' 0 N--CA 1.45 -0.447 0 N-CA-C 105.733 -1.951 . . . . 0.0 105.733 166.646 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 20.9 mt -56.93 -42.37 79.9 Favored 'General case' 0 N--CA 1.452 -0.35 0 N-CA-C 107.961 -1.126 . . . . 0.0 107.961 172.604 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 5.3 m-20 -53.26 -57.07 11.82 Favored 'General case' 0 N--CA 1.449 -0.509 0 C-N-CA 124.812 1.245 . . . . 0.0 111.345 177.294 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 29.9 mm-40 -55.48 -45.88 76.95 Favored 'General case' 0 C--N 1.333 -0.135 0 O-C-N 122.438 -0.164 . . . . 0.0 110.924 177.447 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 1.1 tt -57.02 -50.0 74.08 Favored 'General case' 0 CA--C 1.537 0.46 0 CA-C-O 121.827 0.822 . . . . 0.0 109.854 178.306 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 50' ' ' PHE . . . . . . . . . . . . . 55.6 t80 -55.5 -50.64 69.39 Favored 'General case' 0 N--CA 1.45 -0.463 0 C-N-CA 125.078 1.351 . . . . 0.0 110.222 -179.195 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 74.6 mm-40 -59.38 -43.16 92.93 Favored 'General case' 0 N--CA 1.454 -0.229 0 CA-C-O 120.6 0.238 . . . . 0.0 111.317 176.185 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 7.7 tm-20 -54.26 -44.36 71.76 Favored 'General case' 0 CA--C 1.531 0.242 0 C-N-CA 122.374 0.27 . . . . 0.0 110.614 177.255 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 85.0 mt -69.43 -62.04 1.54 Allowed 'General case' 0 N--CA 1.453 -0.32 0 C-N-CA 122.436 0.295 . . . . 0.0 111.251 176.86 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 12.6 t0 -99.57 103.04 14.74 Favored 'General case' 0 N--CA 1.455 -0.192 0 C-N-CA 124.961 1.304 . . . . 0.0 109.39 178.999 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 45.3 mmtm -70.83 73.26 0.57 Allowed 'General case' 0 CA--C 1.535 0.368 0 CA-C-O 122.274 1.035 . . . . 0.0 111.728 176.771 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 56' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER 37.28 35.71 0.06 Allowed 'General case' 0 C--N 1.321 -0.644 0 C-N-CA 130.232 3.413 . . . . 0.0 114.606 -176.994 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . -83.41 -80.37 1.01 Allowed Glycine 0 CA--C 1.525 0.715 0 N-CA-C 111.016 -0.834 . . . . 0.0 111.016 -172.558 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 28.7 p-10 -91.73 -16.84 26.32 Favored 'General case' 0 CA--C 1.532 0.265 0 C-N-CA 125.142 1.377 . . . . 0.0 111.802 -178.532 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . 82.8 16.75 69.51 Favored Glycine 0 CA--C 1.529 0.938 0 CA-C-O 119.22 -0.767 . . . . 0.0 112.715 174.326 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 33.2 mt-10 -154.23 173.65 15.84 Favored 'General case' 0 CA--C 1.529 0.135 0 C-N-CA 127.2 2.2 . . . . 0.0 106.233 172.388 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 61' ' ' VAL . . . . . . . . . . . . . 46.6 t -112.1 108.63 25.99 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.318 0 CA-C-N 118.118 0.417 . . . . 0.0 110.591 -171.905 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 1.8 m -76.27 158.85 31.15 Favored 'General case' 0 CA--C 1.536 0.429 0 C-N-CA 125.517 1.527 . . . . 0.0 110.552 170.785 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 63' ' ' PHE . . . . . . . . . . . . . 54.7 t80 -53.12 -48.14 68.1 Favored 'General case' 0 CA--C 1.533 0.29 0 O-C-N 121.665 -0.647 . . . . 0.0 111.914 -174.47 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 2.8 pm0 -61.32 -25.46 67.15 Favored 'General case' 0 CA--C 1.537 0.458 0 N-CA-C 113.871 1.063 . . . . 0.0 113.871 -177.324 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 9.0 pt-20 -90.73 -37.81 13.45 Favored 'General case' 0 CA--C 1.532 0.279 0 CA-C-N 118.81 0.732 . . . . 0.0 109.225 174.977 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 9.5 t80 -51.5 -33.31 30.95 Favored 'General case' 0 CA--C 1.538 0.481 0 O-C-N 121.609 -0.682 . . . . 0.0 110.716 167.391 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 67' ' ' GLN . . . . . . . . . . . . . 60.5 mm-40 -54.09 -23.04 12.47 Favored 'General case' 0 CA--C 1.538 0.503 0 O-C-N 120.841 -1.162 . . . . 0.0 113.495 174.145 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 92.1 t -62.72 -34.46 65.65 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.584 0 CA-C-N 120.039 1.29 . . . . 0.0 110.304 171.454 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 9.1 tt -71.96 -42.29 66.74 Favored 'General case' 0 N--CA 1.456 -0.152 0 N-CA-C 107.402 -1.333 . . . . 0.0 107.402 177.505 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 70' ' ' VAL . . . . . . . . . . . . . 64.4 t -58.48 -41.25 81.2 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.271 0 O-C-N 121.908 -0.495 . . . . 0.0 111.148 173.942 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 51.0 tptt -54.2 -52.43 61.28 Favored 'General case' 0 CA--C 1.53 0.199 0 O-C-N 121.554 -0.716 . . . . 0.0 110.006 173.342 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 2.1 mptm? -51.27 -46.85 62.57 Favored 'General case' 0 CA--C 1.538 0.501 0 N-CA-C 112.149 0.426 . . . . 0.0 112.149 173.27 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 73' ' ' ILE . . . . . . . . . . . . . 76.8 mt -59.21 -38.78 76.4 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.491 0 O-C-N 121.785 -0.572 . . . . 0.0 110.667 175.101 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 36.7 p 68.87 -51.43 0.58 Allowed 'General case' 0 N--CA 1.455 -0.191 0 C-N-CA 129.044 2.937 . . . . 0.0 112.458 -170.722 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 75' ' ' GLN . . . . . 1.07 ' OXT' ' O ' ' A' ' 1' ' ' LYS . 50.2 mm-40 . . . . . 0 C--O 1.27 2.163 0 C-N-CA 123.776 0.83 . . . . 0.0 110.692 176.568 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 1' ' ' LYS . . . . . . . . . . . . . 36.2 mttp . . . . . 0 N--CA 1.452 -0.372 0 N-CA-C 108.562 -0.903 . . . . 0.0 108.562 . . . . . . . . . 0 0 . 1 . 020 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -83.53 159.93 60.23 Favored Pre-proline 0 CA--C 1.54 0.574 0 C-N-CA 124.035 0.934 . . . . 0.0 110.484 -179.143 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 53.4 Cg_exo -43.54 -47.94 8.96 Favored 'Trans proline' 0 C--N 1.348 0.539 0 C-N-CA 124.443 3.429 . . . . 0.0 114.989 -174.261 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 46.3 mt-10 -60.75 -41.3 95.14 Favored 'General case' 0 CA--C 1.532 0.265 0 CA-C-O 121.323 0.582 . . . . 0.0 111.293 179.989 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 10.4 mp0 -69.41 -42.24 75.32 Favored 'General case' 0 N--CA 1.451 -0.414 0 N-CA-C 107.633 -1.247 . . . . 0.0 107.633 -178.688 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 18.7 mt -58.24 -38.71 77.39 Favored 'General case' 0 N--CA 1.448 -0.539 0 CA-C-O 119.075 -0.488 . . . . 0.0 111.674 173.004 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 2.1 tmtt? -62.88 -48.67 77.99 Favored 'General case' 0 CA--C 1.533 0.297 0 CA-C-N 119.111 0.869 . . . . 0.0 109.955 173.844 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . -54.78 -51.51 52.41 Favored Glycine 0 CA--C 1.533 1.2 0 N-CA-C 111.092 -0.803 . . . . 0.0 111.092 177.946 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 9' ' ' ILE . . . . . . . . . . . . . 3.2 mm -56.27 -50.23 72.4 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.262 0 C-N-CA 125.714 1.606 . . . . 0.0 109.359 175.549 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 10' ' ' PHE . . . . . . . . . . . . . 25.6 t80 -51.66 -49.94 61.35 Favored 'General case' 0 N--CA 1.444 -0.745 0 O-C-N 121.689 -0.632 . . . . 0.0 109.3 178.126 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 68.8 mt-10 -60.6 -50.77 72.21 Favored 'General case' 0 CA--C 1.531 0.241 0 CA-C-O 119.065 -0.493 . . . . 0.0 111.36 178.836 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 20.3 tptm -39.79 -53.98 2.17 Favored 'General case' 0 N--CA 1.464 0.238 0 C-N-CA 124.568 1.147 . . . . 0.0 110.941 175.466 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 79.0 m-85 -81.9 -46.85 13.51 Favored 'General case' 0 N--CA 1.454 -0.235 0 N-CA-C 111.655 0.242 . . . . 0.0 111.655 -176.172 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -54.25 -38.19 65.5 Favored 'General case' 0 C--N 1.329 -0.311 0 C-N-CA 124.413 1.085 . . . . 0.0 112.309 -179.333 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -49.66 -34.96 19.89 Favored 'General case' 0 CA--C 1.534 0.362 0 C-N-CA 122.961 0.504 . . . . 0.0 111.697 174.132 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 60.5 mttm -71.11 -32.47 69.07 Favored 'General case' 0 CA--C 1.533 0.323 0 C-N-CA 123.144 0.578 . . . . 0.0 110.933 -179.948 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 22.3 tt0 -63.84 -48.12 78.05 Favored 'General case' 0 C--N 1.342 0.244 0 N-CA-C 107.625 -1.25 . . . . 0.0 107.625 169.702 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 138.82 -59.18 0.6 Allowed Glycine 0 CA--C 1.519 0.329 0 N-CA-C 108.622 -1.791 . . . . 0.0 108.622 177.982 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 32.4 t0 -72.77 111.15 10.13 Favored Pre-proline 0 CA--C 1.535 0.373 0 CA-C-O 118.351 -0.833 . . . . 0.0 108.931 176.55 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 20' ' ' PRO . . . . . . . . . . . . . 30.0 Cg_endo -58.85 -19.29 46.39 Favored 'Trans proline' 0 N--CA 1.458 -0.61 0 C-N-CA 122.207 1.938 . . . . 0.0 112.985 -178.884 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 40.6 m-80 -87.36 -4.93 59.05 Favored 'General case' 0 N--CA 1.453 -0.307 0 C-N-CA 125.032 1.333 . . . . 0.0 113.27 -176.778 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 29.8 tt0 -140.75 134.11 29.78 Favored 'General case' 0 CA--C 1.541 0.61 0 CA-C-N 119.109 0.868 . . . . 0.0 112.754 -170.713 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 81.8 mt -108.8 136.36 48.49 Favored 'General case' 0 C--N 1.344 0.361 0 C-N-CA 125.339 1.455 . . . . 0.0 111.426 178.09 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 73.0 p -81.09 174.81 11.22 Favored 'General case' 0 CA--C 1.532 0.263 0 C-N-CA 124.29 1.036 . . . . 0.0 109.388 168.794 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 98.3 mttt -57.13 -46.6 82.54 Favored 'General case' 0 C--O 1.226 -0.156 0 O-C-N 122.088 -0.382 . . . . 0.0 110.129 172.143 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 45.2 tt0 -64.53 -46.2 83.93 Favored 'General case' 0 N--CA 1.452 -0.348 0 N-CA-C 110.2 -0.296 . . . . 0.0 110.2 -177.037 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -59.33 -44.63 92.58 Favored 'General case' 0 N--CA 1.45 -0.433 0 C-N-CA 120.256 -0.577 . . . . 0.0 109.872 176.97 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 11.3 mt -56.77 -43.57 80.96 Favored 'General case' 0 CA--C 1.511 -0.538 0 CA-C-N 119.168 0.894 . . . . 0.0 113.014 170.865 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 63.0 tttm -59.96 -52.3 66.0 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-N 118.754 0.706 . . . . 0.0 109.483 -178.425 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 10.3 mp -58.31 -47.83 82.45 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 116.36 -0.382 . . . . 0.0 110.92 179.237 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 7.4 tt -50.64 -58.4 5.94 Favored 'General case' 0 N--CA 1.455 -0.19 0 C-N-CA 123.531 0.732 . . . . 0.0 109.83 175.331 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 47.7 mt -54.94 -57.7 10.59 Favored 'General case' 0 C--N 1.332 -0.174 0 C-N-CA 123.654 0.782 . . . . 0.0 109.448 -177.708 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 53.0 tt0 -61.55 -45.41 94.28 Favored 'General case' 0 N--CA 1.449 -0.499 0 C-N-CA 124.729 1.212 . . . . 0.0 111.169 -170.888 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 17.9 m -76.41 -48.75 18.7 Favored 'General case' 0 N--CA 1.451 -0.377 0 CA-C-N 116.341 -0.39 . . . . 0.0 110.738 -175.191 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 71.7 mm-40 -93.26 -32.5 14.31 Favored 'General case' 0 N--CA 1.449 -0.496 0 N-CA-C 112.646 0.61 . . . . 0.0 112.646 -168.108 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 85.7 m-85 -129.1 59.09 41.74 Favored Pre-proline 0 CA--C 1.53 0.203 0 C-N-CA 123.761 0.825 . . . . 0.0 110.668 -176.251 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 46.5 Cg_endo -57.24 -30.37 87.17 Favored 'Trans proline' 0 N--CA 1.456 -0.694 0 C-N-CA 122.446 2.097 . . . . 0.0 110.901 -178.505 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -57.81 -27.66 63.34 Favored 'General case' 0 N--CA 1.449 -0.48 0 C-N-CA 126.334 1.854 . . . . 0.0 111.648 -178.187 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 45.8 mt -74.86 -26.85 59.98 Favored 'General case' 0 N--CA 1.451 -0.424 0 C-N-CA 123.298 0.639 . . . . 0.0 111.393 178.719 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 8.4 mp -78.98 78.69 5.4 Favored 'General case' 0 N--CA 1.457 -0.118 0 CA-C-O 122.868 1.318 . . . . 0.0 109.949 -177.662 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 25.9 mtpp -107.62 -65.81 1.08 Allowed 'General case' 0 C--N 1.319 -0.723 0 C-N-CA 127.705 2.402 . . . . 0.0 108.632 178.491 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . 157.12 164.44 13.63 Favored Glycine 0 CA--C 1.526 0.736 0 N-CA-C 106.888 -2.485 . . . . 0.0 106.888 -173.342 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 43' ' ' GLY . . . . . . . . . . . . . . . 141.63 -153.31 24.04 Favored Glycine 0 CA--C 1.524 0.621 0 N-CA-C 108.167 -1.973 . . . . 0.0 108.167 -175.25 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 44' ' ' SER . . . . . . . . . . . . . 2.3 m -53.14 144.33 15.86 Favored 'General case' 0 N--CA 1.451 -0.379 0 C-N-CA 123.876 0.871 . . . . 0.0 110.858 173.279 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 75.3 p -60.66 157.53 14.41 Favored 'General case' 0 CA--C 1.53 0.207 0 O-C-N 122.358 -0.214 . . . . 0.0 110.718 178.569 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 59.5 tp -47.26 -43.15 21.83 Favored 'General case' 0 C--O 1.223 -0.307 0 C-N-CA 123.29 0.636 . . . . 0.0 110.517 169.14 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 5.4 m-20 -57.84 -56.5 21.22 Favored 'General case' 0 N--CA 1.452 -0.367 0 C-N-CA 124.16 0.984 . . . . 0.0 111.132 178.182 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 33.4 mt-10 -54.63 -45.7 73.79 Favored 'General case' 0 CA--C 1.53 0.187 0 CA-C-O 120.883 0.373 . . . . 0.0 110.93 176.614 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -57.88 -51.54 69.17 Favored 'General case' 0 CA--C 1.532 0.263 0 N-CA-C 109.17 -0.678 . . . . 0.0 109.17 179.596 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 50' ' ' PHE . . . . . . . . . . . . . 68.8 t80 -53.32 -50.41 65.03 Favored 'General case' 0 N--CA 1.453 -0.307 0 C-N-CA 125.143 1.377 . . . . 0.0 110.404 178.667 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 33.1 mt-10 -55.73 -48.91 74.41 Favored 'General case' 0 CA--C 1.531 0.222 0 C-N-CA 122.974 0.51 . . . . 0.0 110.658 176.799 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 33.4 tp10 -55.99 -45.43 78.98 Favored 'General case' 0 CA--C 1.531 0.214 0 C-N-CA 123.184 0.593 . . . . 0.0 111.375 177.284 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 32.0 mt -66.32 -45.09 81.51 Favored 'General case' 0 N--CA 1.45 -0.45 0 O-C-N 122.054 -0.404 . . . . 0.0 111.778 179.138 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 51.9 t0 -74.25 59.41 0.76 Allowed 'General case' 0 CA--C 1.539 0.542 0 C-N-CA 124.961 1.305 . . . . 0.0 111.315 -174.185 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 70.4 mmtt -55.19 -39.34 69.49 Favored 'General case' 0 CA--C 1.529 0.164 0 C-N-CA 124.705 1.202 . . . . 0.0 112.456 -178.533 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 56' ' ' ASN . . . . . . . . . . . . . 26.8 p30 -73.69 -10.86 60.12 Favored 'General case' 0 CA--C 1.536 0.421 0 N-CA-C 112.115 0.413 . . . . 0.0 112.115 179.891 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . 61.59 32.49 81.54 Favored Glycine 0 CA--C 1.53 0.989 0 C-N-CA 123.894 0.759 . . . . 0.0 113.192 178.956 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 1.2 p30 -77.74 -12.93 60.02 Favored 'General case' 0 CA--C 1.531 0.237 0 CA-C-N 118.94 1.37 . . . . 0.0 111.906 -179.702 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . 103.65 -8.12 50.88 Favored Glycine 0 CA--C 1.527 0.814 0 CA-C-O 119.165 -0.797 . . . . 0.0 112.326 176.918 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 50.4 mt-10 -145.03 173.33 11.98 Favored 'General case' 0 N--CA 1.453 -0.287 0 C-N-CA 127.648 2.379 . . . . 0.0 106.859 174.985 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 61' ' ' VAL . . . . . . . . . . . . . 3.7 t -108.77 112.3 39.83 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.174 0 N-CA-C 109.767 -0.456 . . . . 0.0 109.767 -171.186 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 78.1 p -78.62 158.21 28.5 Favored 'General case' 0 CA--C 1.536 0.438 0 C-N-CA 122.804 0.441 . . . . 0.0 110.874 176.369 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 63' ' ' PHE . . . . . . . . . . . . . 69.6 t80 -55.21 -34.09 63.62 Favored 'General case' 0 N--CA 1.468 0.458 0 N-CA-C 113.248 0.833 . . . . 0.0 113.248 -177.81 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 45.7 mm-40 -65.2 -60.37 3.08 Favored 'General case' 0 N--CA 1.451 -0.424 0 O-C-N 121.85 -0.531 . . . . 0.0 109.822 179.735 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 12.8 pt-20 -66.1 -28.45 68.83 Favored 'General case' 0 CA--C 1.537 0.462 0 O-C-N 121.14 -0.975 . . . . 0.0 111.391 -177.421 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 15.9 t80 -51.85 -25.58 8.15 Favored 'General case' 0 CA--C 1.536 0.406 0 C-N-CA 123.8 0.84 . . . . 0.0 112.345 169.016 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 67' ' ' GLN . . . . . . . . . . . . . 59.3 mm-40 -54.09 -25.62 22.82 Favored 'General case' 0 CA--C 1.541 0.607 0 CA-C-N 119.532 1.06 . . . . 0.0 112.859 172.593 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 97.0 t -56.4 -33.93 39.62 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.543 0 O-C-N 121.369 -0.832 . . . . 0.0 110.853 171.626 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 25.1 tp -75.04 -47.65 27.93 Favored 'General case' 0 N--CA 1.457 -0.108 0 N-CA-C 107.993 -1.114 . . . . 0.0 107.993 175.159 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 70' ' ' VAL . . . . . . . . . . . . . 84.5 t -52.31 -37.68 23.63 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.242 0 C-N-CA 122.46 0.304 . . . . 0.0 111.112 -179.793 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 71' ' ' LYS . . . . . 0.774 ' O ' ' OXT' ' A' ' 75' ' ' GLN . 21.3 ttmm -53.01 -57.72 9.4 Favored 'General case' 0 CA--C 1.531 0.234 0 C-N-CA 123.011 0.524 . . . . 0.0 111.291 171.365 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 13.6 mptt -55.43 -44.79 76.6 Favored 'General case' 0 CA--C 1.531 0.234 0 C-N-CA 122.608 0.363 . . . . 0.0 111.181 177.54 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 73' ' ' ILE . . . . . . . . . . . . . 65.9 mt -56.74 -47.79 82.03 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.338 0 N-CA-C 109.047 -0.723 . . . . 0.0 109.047 177.301 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 8.8 m -77.43 50.09 0.77 Allowed 'General case' 0 CA--C 1.534 0.345 0 C-N-CA 124.816 1.247 . . . . 0.0 109.644 174.712 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 75' ' ' GLN . . . . . 0.774 ' OXT' ' O ' ' A' ' 71' ' ' LYS . 0.9 OUTLIER . . . . . 0 C--O 1.27 2.132 0 C-N-CA 123.828 0.851 . . . . 0.0 109.105 -168.688 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 1' ' ' LYS . . . . . . . . . . . . . 1.7 mptp? . . . . . 0 N--CA 1.45 -0.464 0 N-CA-C 108.466 -0.939 . . . . 0.0 108.466 . . . . . . . . . 0 0 . 1 . 021 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 17.1 p -88.2 170.39 11.56 Favored Pre-proline 0 CA--C 1.537 0.454 0 N-CA-C 107.842 -1.17 . . . . 0.0 107.842 169.15 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 96.0 Cg_exo -45.36 -38.85 15.88 Favored 'Trans proline' 0 N--CA 1.458 -0.618 0 C-N-CA 123.512 2.808 . . . . 0.0 113.038 176.158 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 35.1 tt0 -62.67 -45.14 94.17 Favored 'General case' 0 N--CA 1.454 -0.266 0 C-N-CA 122.82 0.448 . . . . 0.0 111.464 178.839 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 6.9 mp0 -70.34 -40.86 73.85 Favored 'General case' 0 N--CA 1.451 -0.405 0 N-CA-C 108.35 -0.982 . . . . 0.0 108.35 179.532 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 7.3 mt -56.3 -38.35 71.14 Favored 'General case' 0 N--CA 1.452 -0.336 0 C-N-CA 122.786 0.434 . . . . 0.0 111.751 175.03 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 22.8 tptm -61.8 -54.31 44.07 Favored 'General case' 0 C--N 1.333 -0.144 0 CA-C-N 118.961 0.801 . . . . 0.0 111.083 170.508 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . -49.87 -48.71 37.05 Favored Glycine 0 CA--C 1.534 1.254 0 N-CA-C 111.202 -0.759 . . . . 0.0 111.202 178.846 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 9' ' ' ILE . . . . . . . . . . . . . 2.8 mm -59.59 -54.44 34.46 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.315 0 C-N-CA 127.156 2.182 . . . . 0.0 109.209 176.999 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 10' ' ' PHE . . . . . . . . . . . . . 55.8 t80 -46.96 -53.07 13.15 Favored 'General case' 0 N--CA 1.45 -0.45 0 N-CA-C 109.45 -0.574 . . . . 0.0 109.45 177.744 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 50.4 mt-10 -59.72 -52.67 64.48 Favored 'General case' 0 N--CA 1.454 -0.251 0 C-N-CA 123.015 0.526 . . . . 0.0 110.55 179.666 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 44.5 tttp -44.13 -52.82 6.97 Favored 'General case' 0 CA--C 1.528 0.12 0 C-N-CA 124.567 1.147 . . . . 0.0 111.307 178.375 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 69.9 m-85 -78.39 -46.41 20.0 Favored 'General case' 0 CA--C 1.532 0.287 0 C-N-CA 121.182 -0.207 . . . . 0.0 110.877 -175.88 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -56.59 -31.94 64.74 Favored 'General case' 0 CA--C 1.535 0.382 0 C-N-CA 125.019 1.327 . . . . 0.0 112.583 -179.778 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -65.07 -27.83 69.05 Favored 'General case' 0 N--CA 1.452 -0.373 0 O-C-N 121.68 -0.638 . . . . 0.0 112.419 176.095 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 98.3 mttt -64.43 -50.7 66.53 Favored 'General case' 0 C--N 1.341 0.221 0 CA-C-N 119.388 0.995 . . . . 0.0 112.122 -169.506 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 26.2 tt0 -71.6 -22.93 61.65 Favored 'General case' 0 CA--C 1.533 0.289 0 O-C-N 122.215 -0.303 . . . . 0.0 110.283 175.394 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 102.51 30.85 5.44 Favored Glycine 0 C--N 1.337 0.62 0 C-N-CA 124.488 1.042 . . . . 0.0 111.188 175.739 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 65.4 t0 -128.25 67.71 75.61 Favored Pre-proline 0 N--CA 1.452 -0.371 0 N-CA-C 108.323 -0.992 . . . . 0.0 108.323 176.619 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 20' ' ' PRO . . . . . . . . . . . . . 18.9 Cg_endo -52.92 -26.68 32.31 Favored 'Trans proline' 0 CA--C 1.534 0.499 0 C-N-CA 123.315 2.676 . . . . 0.0 113.621 -172.955 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 69.0 m-80 -79.83 -20.18 46.67 Favored 'General case' 0 N--CA 1.452 -0.367 0 C-N-CA 124.306 1.042 . . . . 0.0 113.075 -178.541 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 12.0 tt0 -154.13 124.32 6.9 Favored 'General case' 0 CA--C 1.538 0.481 0 CA-C-N 119.147 0.885 . . . . 0.0 112.631 -168.098 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 42.6 mt -81.65 141.2 33.87 Favored 'General case' 0 C--O 1.234 0.276 0 C-N-CA 124.083 0.953 . . . . 0.0 112.101 -177.775 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 90.5 p -86.57 173.08 9.8 Favored 'General case' 0 CA--C 1.537 0.442 0 C-N-CA 124.42 1.088 . . . . 0.0 109.373 167.312 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 92.9 mttt -55.0 -44.18 74.27 Favored 'General case' 0 C--O 1.225 -0.224 0 O-C-N 121.814 -0.554 . . . . 0.0 110.731 173.685 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 46.4 mp0 -66.02 -50.27 64.82 Favored 'General case' 0 N--CA 1.45 -0.443 0 CA-C-O 121.389 0.614 . . . . 0.0 109.769 -174.136 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 65.5 mt-10 -53.13 -48.88 67.54 Favored 'General case' 0 N--CA 1.451 -0.376 0 CA-C-N 114.874 -1.057 . . . . 0.0 109.867 174.131 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 11.5 mt -57.18 -40.67 77.81 Favored 'General case' 0 CA--C 1.514 -0.418 0 N-CA-C 113.386 0.884 . . . . 0.0 113.386 172.959 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 5.1 ttpm? -63.23 -49.72 73.05 Favored 'General case' 0 C--N 1.322 -0.601 0 CA-C-N 118.817 0.735 . . . . 0.0 109.836 -177.572 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 4.1 mm? -60.01 -48.52 81.38 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.752 177.369 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 8.6 tt -50.26 -56.81 9.59 Favored 'General case' 0 N--CA 1.456 -0.143 0 C-N-CA 123.869 0.867 . . . . 0.0 109.568 175.476 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 39.1 mt -55.73 -58.63 7.02 Favored 'General case' 0 C--N 1.331 -0.22 0 C-N-CA 123.696 0.798 . . . . 0.0 109.58 -178.809 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 23.0 tt0 -55.9 -47.48 77.38 Favored 'General case' 0 N--CA 1.452 -0.328 0 C-N-CA 123.231 0.612 . . . . 0.0 111.337 -174.171 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 12.7 m -76.98 -45.82 26.12 Favored 'General case' 0 N--CA 1.451 -0.381 0 CA-C-N 116.224 -0.444 . . . . 0.0 111.229 -172.538 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 71.3 mm-40 -97.35 -33.37 11.45 Favored 'General case' 0 N--CA 1.451 -0.42 0 N-CA-C 112.685 0.624 . . . . 0.0 112.685 -168.32 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 54.2 m-85 -138.37 61.85 27.64 Favored Pre-proline 0 C--O 1.236 0.343 0 C-N-CA 123.521 0.728 . . . . 0.0 111.409 -174.408 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 57.1 Cg_endo -61.39 -25.29 79.87 Favored 'Trans proline' 0 N--CA 1.455 -0.781 0 C-N-CA 122.549 2.166 . . . . 0.0 110.682 176.354 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 2.7 p -51.12 -56.81 10.8 Favored 'General case' 0 N--CA 1.448 -0.543 0 C-N-CA 125.976 1.711 . . . . 0.0 109.247 170.337 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 39.5 mt -66.65 -40.02 88.49 Favored 'General case' 0 N--CA 1.454 -0.268 0 C-N-CA 123.51 0.724 . . . . 0.0 111.315 177.422 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 9.1 tp -51.77 -48.74 63.62 Favored 'General case' 0 CA--C 1.529 0.167 0 CA-C-O 120.75 0.31 . . . . 0.0 110.356 178.919 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 36.4 mtmm -71.98 -65.2 0.8 Allowed 'General case' 0 N--CA 1.45 -0.426 0 CA-C-O 121.738 0.78 . . . . 0.0 110.199 174.845 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . -77.29 65.53 3.04 Favored Glycine 0 CA--C 1.525 0.668 0 C-N-CA 125.019 1.295 . . . . 0.0 110.866 -176.97 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 43' ' ' GLY . . . . . . . . . . . . . . . -151.5 -110.42 0.47 Allowed Glycine 0 CA--C 1.524 0.608 0 N-CA-C 109.679 -1.368 . . . . 0.0 109.679 177.133 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 44' ' ' SER . . . . . . . . . . . . . 32.8 t -171.09 -160.53 0.19 Allowed 'General case' 0 N--CA 1.453 -0.297 0 N-CA-C 105.969 -1.864 . . . . 0.0 105.969 178.033 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 53.1 p -60.1 145.97 44.76 Favored 'General case' 0 N--CA 1.454 -0.25 0 CA-C-O 121.193 0.521 . . . . 0.0 110.061 177.042 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 52.0 tp -49.24 -43.54 42.87 Favored 'General case' 0 C--O 1.224 -0.249 0 CA-C-N 116.0 -0.545 . . . . 0.0 110.058 171.335 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 6.6 m-20 -53.16 -61.18 2.47 Favored 'General case' 0 N--CA 1.448 -0.563 0 C-N-CA 124.053 0.941 . . . . 0.0 110.588 175.7 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 25.5 mt-10 -51.33 -49.89 60.52 Favored 'General case' 0 C--N 1.332 -0.169 0 N-CA-C 111.308 0.114 . . . . 0.0 111.308 178.765 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 8.8 mp -55.87 -48.08 76.2 Favored 'General case' 0 C--N 1.334 -0.105 0 CA-C-O 120.747 0.308 . . . . 0.0 110.454 178.032 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 50' ' ' PHE . . . . . . . . . . . . . 63.8 t80 -58.34 -48.94 78.95 Favored 'General case' 0 N--CA 1.448 -0.533 0 C-N-CA 123.198 0.599 . . . . 0.0 110.481 -178.989 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 1.2 mp0 -56.77 -50.27 72.8 Favored 'General case' 0 N--CA 1.455 -0.224 0 N-CA-C 110.51 -0.182 . . . . 0.0 110.51 176.854 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 39.1 mt-10 -54.04 -47.18 71.86 Favored 'General case' 0 CA--C 1.529 0.166 0 CA-C-O 121.1 0.476 . . . . 0.0 110.972 178.597 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 90.8 mt -68.96 -42.38 76.71 Favored 'General case' 0 N--CA 1.451 -0.424 0 C-N-CA 123.509 0.724 . . . . 0.0 111.931 -177.05 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 52.5 t0 -73.65 64.66 0.92 Allowed 'General case' 0 CA--C 1.537 0.461 0 C-N-CA 124.286 1.034 . . . . 0.0 111.31 -175.545 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 32.6 mmtp -76.41 71.92 3.11 Favored 'General case' 0 N--CA 1.453 -0.291 0 CA-C-O 122.694 1.235 . . . . 0.0 110.087 168.883 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 56' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -167.17 -47.85 0.02 OUTLIER 'General case' 0 C--N 1.322 -0.628 0 C-N-CA 127.725 2.41 . . . . 0.0 108.527 173.693 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . 101.95 4.29 51.39 Favored Glycine 0 CA--C 1.531 1.043 0 CA-C-O 118.988 -0.896 . . . . 0.0 114.553 170.31 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 5.3 p-10 -77.29 -0.21 24.58 Favored 'General case' 0 CA--C 1.532 0.273 0 CA-C-N 119.653 1.726 . . . . 0.0 112.584 -179.827 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . 77.45 38.02 29.75 Favored Glycine 0 CA--C 1.525 0.661 0 CA-C-O 119.256 -0.747 . . . . 0.0 111.37 176.996 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 35.3 mt-10 -161.07 173.43 15.21 Favored 'General case' 0 CA--C 1.533 0.322 0 C-N-CA 127.696 2.398 . . . . 0.0 106.809 169.82 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 61' ' ' VAL . . . . . . . . . . . . . 3.4 t -129.08 108.76 17.51 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.516 0 CA-C-N 118.469 0.577 . . . . 0.0 112.125 -172.418 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 75.7 m -77.82 163.76 25.79 Favored 'General case' 0 CA--C 1.538 0.483 0 C-N-CA 124.467 1.107 . . . . 0.0 111.512 173.813 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 63' ' ' PHE . . . . . . . . . . . . . 61.7 t80 -59.69 -38.26 81.08 Favored 'General case' 0 CA--C 1.534 0.353 0 N-CA-C 113.028 0.751 . . . . 0.0 113.028 -172.806 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 50.0 mt-10 -61.74 -59.57 4.97 Favored 'General case' 0 CA--C 1.532 0.256 0 O-C-N 121.902 -0.499 . . . . 0.0 110.167 -179.067 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 16.6 pt-20 -61.55 -35.94 79.19 Favored 'General case' 0 CA--C 1.539 0.536 0 O-C-N 121.458 -0.776 . . . . 0.0 111.644 178.561 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 18.5 t80 -52.74 -22.89 5.77 Favored 'General case' 0 CA--C 1.536 0.426 0 C-N-CA 123.703 0.801 . . . . 0.0 112.439 169.932 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 67' ' ' GLN . . . . . . . . . . . . . 34.2 mm-40 -53.69 -21.55 7.25 Favored 'General case' 0 CA--C 1.537 0.453 0 CA-C-N 119.789 1.177 . . . . 0.0 113.001 171.063 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 70.8 t -55.49 -36.7 42.49 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.651 0 CA-C-N 119.886 1.221 . . . . 0.0 110.464 169.454 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 12.4 tp -72.59 -44.22 62.31 Favored 'General case' 0 N--CA 1.457 -0.108 0 N-CA-C 108.061 -1.088 . . . . 0.0 108.061 177.662 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 70' ' ' VAL . . . . . . . . . . . . . 54.3 t -54.04 -40.04 44.04 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.36 0 N-CA-C 110.157 -0.312 . . . . 0.0 110.157 175.946 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 21.4 ttmm -59.8 -56.62 19.48 Favored 'General case' 0 CA--C 1.53 0.193 0 C-N-CA 123.297 0.639 . . . . 0.0 110.799 171.433 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 2.6 mptm? -48.64 -34.5 11.87 Favored 'General case' 0 CA--C 1.539 0.527 0 N-CA-C 112.583 0.586 . . . . 0.0 112.583 175.837 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 73' ' ' ILE . . . . . . . . . . . . . 27.9 mm -72.39 -66.08 0.6 Allowed 'Isoleucine or valine' 0 CA--C 1.533 0.323 0 CA-C-N 118.423 0.556 . . . . 0.0 110.583 173.288 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 74' ' ' SER . . . . . 0.702 ' O ' ' OXT' ' A' ' 75' ' ' GLN . 61.3 p -63.17 -35.22 79.57 Favored 'General case' 0 C--N 1.332 -0.169 0 N-CA-C 113.885 1.068 . . . . 0.0 113.885 -168.342 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 75' ' ' GLN . . . . . 0.702 ' OXT' ' O ' ' A' ' 74' ' ' SER . 35.3 mt-30 . . . . . 0 C--O 1.27 2.15 0 C-N-CA 125.078 1.351 . . . . 0.0 111.744 175.184 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 1' ' ' LYS . . . . . . . . . . . . . 9.4 mptt . . . . . 0 N--CA 1.45 -0.452 0 N-CA-C 107.46 -1.311 . . . . 0.0 107.46 . . . . . . . . . 0 0 . 1 . 022 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 6.3 p -71.79 156.94 90.56 Favored Pre-proline 0 CA--C 1.536 0.442 0 CA-C-O 118.834 -0.603 . . . . 0.0 109.41 176.737 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 85.1 Cg_exo -44.78 -42.7 15.08 Favored 'Trans proline' 0 N--CA 1.46 -0.495 0 C-N-CA 123.491 2.794 . . . . 0.0 113.665 177.95 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 3.2 mp0 -58.13 -48.92 78.74 Favored 'General case' 0 N--CA 1.456 -0.135 0 C-N-CA 123.88 0.872 . . . . 0.0 111.531 176.893 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 58.5 mm-40 -66.38 -38.5 87.68 Favored 'General case' 0 N--CA 1.448 -0.565 0 N-CA-C 109.085 -0.709 . . . . 0.0 109.085 179.343 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 48.2 mt -62.32 -35.62 79.62 Favored 'General case' 0 N--CA 1.451 -0.415 0 C-N-CA 123.436 0.694 . . . . 0.0 112.536 174.877 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 23.4 tptm -61.07 -49.18 78.39 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 118.88 0.764 . . . . 0.0 109.599 169.045 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . -49.7 -51.57 27.94 Favored Glycine 0 CA--C 1.534 1.22 0 N-CA-C 111.092 -0.803 . . . . 0.0 111.092 176.055 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 9' ' ' ILE . . . . . . . . . . . . . 2.8 mm -58.12 -54.22 35.2 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.241 0 C-N-CA 126.28 1.832 . . . . 0.0 109.327 177.117 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 10' ' ' PHE . . . . . . . . . . . . . 50.6 t80 -47.9 -52.21 20.21 Favored 'General case' 0 N--CA 1.449 -0.476 0 C-N-CA 123.503 0.721 . . . . 0.0 109.219 178.693 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 52.0 mt-10 -61.22 -51.4 69.16 Favored 'General case' 0 CA--C 1.532 0.281 0 C-N-CA 123.063 0.545 . . . . 0.0 110.553 179.724 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 37.7 tttm -45.1 -53.26 8.19 Favored 'General case' 0 C--N 1.338 0.108 0 C-N-CA 124.42 1.088 . . . . 0.0 111.124 177.981 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 68.2 m-85 -78.6 -43.78 25.58 Favored 'General case' 0 N--CA 1.454 -0.24 0 C-N-CA 121.041 -0.264 . . . . 0.0 110.97 -175.832 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -58.55 -28.73 65.76 Favored 'General case' 0 CA--C 1.532 0.284 0 C-N-CA 124.181 0.992 . . . . 0.0 112.228 179.779 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -58.6 -32.7 69.23 Favored 'General case' 0 N--CA 1.452 -0.342 0 C-N-CA 122.999 0.519 . . . . 0.0 112.191 174.106 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 3.9 mptp? -64.25 151.5 43.47 Favored 'General case' 0 CA--C 1.532 0.287 0 N-CA-C 108.591 -0.892 . . . . 0.0 108.591 178.871 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 37.2 mt-10 68.87 -60.43 0.45 Allowed 'General case' 0 CA--C 1.532 0.28 0 C-N-CA 125.834 1.654 . . . . 0.0 109.672 -168.34 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 139.02 50.61 0.05 OUTLIER Glycine 0 CA--C 1.524 0.599 0 C-N-CA 124.756 1.169 . . . . 0.0 111.927 169.285 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 44.7 t0 -135.51 64.51 58.73 Favored Pre-proline 0 C--N 1.34 0.185 0 CA-C-N 118.467 1.133 . . . . 0.0 110.782 177.094 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 20' ' ' PRO . . . . . . . . . . . . . 12.8 Cg_endo -50.38 -23.57 10.49 Favored 'Trans proline' 0 CA--C 1.537 0.656 0 C-N-CA 123.846 3.03 . . . . 0.0 114.385 -177.312 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -80.84 -25.26 37.85 Favored 'General case' 0 N--CA 1.451 -0.42 0 C-N-CA 125.591 1.556 . . . . 0.0 111.814 -174.685 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 59.1 tt0 -153.33 121.62 6.22 Favored 'General case' 0 N--CA 1.451 -0.409 0 N-CA-C 110.013 -0.366 . . . . 0.0 110.013 -165.9 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 50.0 mt -77.65 131.81 37.93 Favored 'General case' 0 N--CA 1.449 -0.511 0 N-CA-C 109.338 -0.616 . . . . 0.0 109.338 -174.798 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 50.9 p -75.2 167.02 22.71 Favored 'General case' 0 N--CA 1.448 -0.538 0 N-CA-C 108.448 -0.945 . . . . 0.0 108.448 169.038 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 30.9 ttmt -58.06 -37.84 75.18 Favored 'General case' 0 CA--C 1.538 0.505 0 O-C-N 121.984 -0.448 . . . . 0.0 110.104 173.963 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 24.6 mt-10 -67.68 -47.2 70.15 Favored 'General case' 0 N--CA 1.455 -0.212 0 O-C-N 121.529 -0.732 . . . . 0.0 110.667 179.008 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 23.7 mt-10 -57.49 -44.7 85.16 Favored 'General case' 0 CA--C 1.534 0.364 0 N-CA-C 109.525 -0.546 . . . . 0.0 109.525 177.455 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 15.3 mt -54.0 -48.23 70.64 Favored 'General case' 0 CA--C 1.508 -0.646 0 CA-C-N 118.317 0.508 . . . . 0.0 112.192 169.205 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 52.4 tttp -60.64 -43.12 97.91 Favored 'General case' 0 C--N 1.322 -0.593 0 CA-C-N 118.602 0.637 . . . . 0.0 110.268 -176.505 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 87.7 mt -60.88 -52.01 66.88 Favored 'General case' 0 C--N 1.328 -0.355 0 O-C-N 122.18 -0.325 . . . . 0.0 111.324 175.263 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 7.1 tt -48.15 -58.22 4.81 Favored 'General case' 0 C--N 1.334 -0.108 0 C-N-CA 124.38 1.072 . . . . 0.0 109.27 175.887 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 46.6 mt -59.14 -54.16 50.15 Favored 'General case' 0 N--CA 1.449 -0.512 0 C-N-CA 123.96 0.904 . . . . 0.0 109.868 -175.6 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 25.7 mt-30 -56.55 -48.91 76.31 Favored 'General case' 0 C--O 1.227 -0.13 0 CA-C-N 118.548 0.613 . . . . 0.0 110.996 -177.515 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 11.2 m -72.36 -47.52 48.88 Favored 'General case' 0 N--CA 1.453 -0.298 0 CA-C-N 116.325 -0.398 . . . . 0.0 110.691 -171.983 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 76.3 mm-40 -91.77 -33.4 15.01 Favored 'General case' 0 N--CA 1.451 -0.425 0 C-N-CA 123.553 0.741 . . . . 0.0 112.295 -169.438 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 79.8 m-85 -142.74 63.44 13.88 Favored Pre-proline 0 CA--C 1.539 0.54 0 C-N-CA 123.969 0.907 . . . . 0.0 112.857 -171.105 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 88.9 Cg_exo -43.83 -39.17 10.44 Favored 'Trans proline' 0 CA--C 1.534 0.504 0 C-N-CA 123.734 2.956 . . . . 0.0 114.053 176.297 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 1.5 m -60.5 -43.25 97.25 Favored 'General case' 0 N--CA 1.448 -0.561 0 C-N-CA 124.502 1.121 . . . . 0.0 110.9 -169.824 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 40.1 mt -56.53 -29.94 62.5 Favored 'General case' 0 CA--C 1.53 0.199 0 C-N-CA 124.754 1.222 . . . . 0.0 112.9 -169.822 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 9.8 mp -58.22 -35.4 71.62 Favored 'General case' 0 CA--C 1.533 0.291 0 C-N-CA 122.576 0.351 . . . . 0.0 110.802 176.771 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 58.7 mtmt -105.77 -68.76 0.85 Allowed 'General case' 0 N--CA 1.449 -0.504 0 C-N-CA 125.39 1.476 . . . . 0.0 109.187 -176.559 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . -76.53 64.31 2.92 Favored Glycine 0 CA--C 1.525 0.669 0 N-CA-C 109.393 -1.483 . . . . 0.0 109.393 175.718 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 43' ' ' GLY . . . . . . . . . . . . . . . 174.96 -89.77 0.08 OUTLIER Glycine 0 N--CA 1.449 -0.451 0 N-CA-C 108.378 -1.889 . . . . 0.0 108.378 179.494 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 44' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -177.56 165.65 2.15 Favored 'General case' 0 N--CA 1.448 -0.554 0 C-N-CA 124.13 0.972 . . . . 0.0 108.897 -177.885 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 69.5 p -70.34 163.35 26.78 Favored 'General case' 0 CA--C 1.532 0.267 0 CA-C-O 121.65 0.738 . . . . 0.0 110.772 179.298 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 49.3 tp -51.13 -51.6 52.02 Favored 'General case' 0 N--CA 1.454 -0.27 0 C-N-CA 124.074 0.95 . . . . 0.0 111.833 177.735 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 13.5 m-20 -59.48 -49.41 77.91 Favored 'General case' 0 N--CA 1.45 -0.458 0 C-N-CA 123.104 0.561 . . . . 0.0 109.908 -177.627 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 47.8 mt-10 -51.94 -53.13 44.78 Favored 'General case' 0 N--CA 1.454 -0.253 0 CA-C-N 116.357 -0.383 . . . . 0.0 110.644 174.413 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 6.0 mp -53.6 -52.44 59.81 Favored 'General case' 0 CA--C 1.527 0.068 0 CA-C-O 121.256 0.551 . . . . 0.0 110.428 178.304 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 50' ' ' PHE . . . . . . . . . . . . . 39.3 t80 -55.76 -45.37 78.08 Favored 'General case' 0 N--CA 1.446 -0.647 0 O-C-N 122.015 -0.428 . . . . 0.0 110.584 -178.065 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 35.5 mt-10 -67.6 -40.76 84.74 Favored 'General case' 0 N--CA 1.456 -0.17 0 CA-C-N 118.237 0.471 . . . . 0.0 112.069 179.67 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 30.8 mt-10 -53.15 -46.95 69.09 Favored 'General case' 0 N--CA 1.456 -0.128 0 C-N-CA 122.964 0.506 . . . . 0.0 110.147 174.326 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 76.2 mt -80.85 -55.89 4.5 Favored 'General case' 0 N--CA 1.45 -0.426 0 C-N-CA 122.849 0.46 . . . . 0.0 111.462 -173.358 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 14.3 t0 -102.47 102.61 12.92 Favored 'General case' 0 N--CA 1.448 -0.538 0 C-N-CA 126.173 1.789 . . . . 0.0 107.624 -179.156 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 1.6 tppt? -66.51 -9.57 35.97 Favored 'General case' 0 CA--C 1.535 0.369 0 N-CA-C 113.429 0.9 . . . . 0.0 113.429 179.878 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 56' ' ' ASN . . . . . . . . . . . . . 6.5 p30 129.7 -25.26 0.01 OUTLIER 'General case' 0 N--CA 1.467 0.401 0 C-N-CA 131.499 3.92 . . . . 0.0 109.152 -174.914 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . -52.82 -57.7 13.62 Favored Glycine 0 C--N 1.338 0.667 0 C-N-CA 124.168 0.89 . . . . 0.0 112.609 -168.697 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 24.3 p-10 -95.6 -9.66 31.6 Favored 'General case' 0 CA--C 1.536 0.436 0 N-CA-C 112.666 0.617 . . . . 0.0 112.666 -175.434 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . 68.19 -8.51 1.98 Allowed Glycine 0 CA--C 1.531 1.032 0 C-N-CA 125.725 1.631 . . . . 0.0 116.468 168.077 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 7.3 mm-40 -149.9 164.64 34.87 Favored 'General case' 0 CA--C 1.535 0.376 0 C-N-CA 129.65 3.18 . . . . 0.0 102.94 169.543 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 61' ' ' VAL . . . . . . . . . . . . . 91.8 t -96.21 111.56 26.67 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.432 0 CA-C-N 120.365 1.439 . . . . 0.0 112.992 -167.791 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 60.4 p -80.41 161.46 24.94 Favored 'General case' 0 CA--C 1.541 0.606 0 O-C-N 121.428 -0.795 . . . . 0.0 112.173 175.866 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 63' ' ' PHE . . . . . . . . . . . . . 63.6 t80 -58.65 -40.29 83.0 Favored 'General case' 0 N--CA 1.464 0.246 0 C-N-CA 123.026 0.53 . . . . 0.0 112.428 -172.885 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 20.8 pm0 -61.82 -50.64 71.47 Favored 'General case' 0 N--CA 1.448 -0.535 0 O-C-N 121.865 -0.522 . . . . 0.0 111.355 -178.267 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 10.5 pt-20 -71.38 -31.55 67.43 Favored 'General case' 0 CA--C 1.53 0.195 0 O-C-N 121.398 -0.814 . . . . 0.0 110.948 178.232 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 25.0 t80 -51.83 -27.93 14.14 Favored 'General case' 0 CA--C 1.54 0.591 0 CA-C-N 118.526 0.603 . . . . 0.0 111.747 169.472 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 67' ' ' GLN . . . . . . . . . . . . . 46.7 mm-40 -54.54 -29.79 51.97 Favored 'General case' 0 N--CA 1.469 0.492 0 O-C-N 120.742 -1.224 . . . . 0.0 113.022 171.393 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 82.9 t -61.38 -32.8 54.24 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.405 0 O-C-N 121.173 -0.954 . . . . 0.0 110.028 172.575 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 1.2 tt -71.78 -48.75 44.44 Favored 'General case' 0 N--CA 1.454 -0.243 0 N-CA-C 106.206 -1.776 . . . . 0.0 106.206 177.788 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 70' ' ' VAL . . . . . . . . . . . . . 42.9 t -50.64 -45.87 27.3 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.373 0 C-N-CA 122.176 0.19 . . . . 0.0 110.494 175.922 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 5.7 ttpm? -57.08 -54.51 45.89 Favored 'General case' 0 CA--C 1.532 0.276 0 C-N-CA 123.267 0.627 . . . . 0.0 111.08 173.674 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 1.9 mptm? -50.13 -38.68 40.26 Favored 'General case' 0 CA--C 1.534 0.342 0 N-CA-C 112.608 0.596 . . . . 0.0 112.608 176.318 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 73' ' ' ILE . . . . . . . . . . . . . 19.2 mt -66.06 -58.8 5.33 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.27 0 N-CA-C 109.022 -0.733 . . . . 0.0 109.022 171.576 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 43.0 t -74.19 58.13 0.69 Allowed 'General case' 0 CA--C 1.533 0.317 0 C-N-CA 126.74 2.016 . . . . 0.0 111.879 -173.072 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 75' ' ' GLN . . . . . . . . . . . . . 13.7 mt-30 . . . . . 0 C--O 1.271 2.195 0 C-N-CA 124.592 1.157 . . . . 0.0 110.062 177.572 . . . . . . . . 0 0 . 1 . 023 nuclear orig full ' A' A ' 1' ' ' LYS . . . . . . . . . . . . . 36.9 mttm . . . . . 0 N--CA 1.449 -0.476 0 N-CA-C 108.651 -0.87 . . . . 0.0 108.651 . . . . . . . . . 0 0 . 1 . 023 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 92.6 p -73.12 160.58 82.44 Favored Pre-proline 0 CA--C 1.532 0.267 0 N-CA-C 109.13 -0.693 . . . . 0.0 109.13 177.414 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 79.8 Cg_exo -50.21 -36.18 45.54 Favored 'Trans proline' 0 N--CA 1.456 -0.702 0 C-N-CA 122.311 2.008 . . . . 0.0 112.284 169.585 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 48.2 mt-10 -63.74 -49.68 72.1 Favored 'General case' 0 CA--C 1.529 0.166 0 C-N-CA 123.59 0.756 . . . . 0.0 110.923 177.209 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 46.9 mm-40 -58.65 -45.76 88.64 Favored 'General case' 0 N--CA 1.455 -0.204 0 N-CA-C 108.959 -0.756 . . . . 0.0 108.959 176.016 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 66.9 mt -60.83 -37.96 83.83 Favored 'General case' 0 N--CA 1.447 -0.579 0 C-N-CA 124.141 0.976 . . . . 0.0 112.56 179.848 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 2.6 tppp? -57.99 -53.85 53.55 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 119.249 0.932 . . . . 0.0 109.575 168.832 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . -49.17 -52.99 20.94 Favored Glycine 0 CA--C 1.536 1.344 0 N-CA-C 111.651 -0.58 . . . . 0.0 111.651 178.005 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 9' ' ' ILE . . . . . . . . . . . . . 1.9 mm -56.83 -51.38 68.34 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.231 0 C-N-CA 127.056 2.142 . . . . 0.0 109.265 176.205 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 10' ' ' PHE . . . . . . . . . . . . . 21.7 t80 -51.62 -48.95 63.1 Favored 'General case' 0 N--CA 1.445 -0.68 0 O-C-N 121.365 -0.834 . . . . 0.0 108.955 179.659 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 49.8 mt-10 -63.77 -49.39 73.16 Favored 'General case' 0 CA--C 1.531 0.237 0 CA-C-O 118.679 -0.677 . . . . 0.0 111.281 179.344 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 48.2 tptt -39.09 -51.47 1.87 Allowed 'General case' 0 N--CA 1.467 0.41 0 C-N-CA 124.74 1.216 . . . . 0.0 110.662 174.072 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 80.8 m-85 -81.43 -57.69 3.37 Favored 'General case' 0 N--CA 1.451 -0.4 0 C-N-CA 121.074 -0.25 . . . . 0.0 111.532 -177.632 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -48.63 -43.63 36.57 Favored 'General case' 0 C--N 1.331 -0.204 0 C-N-CA 124.665 1.186 . . . . 0.0 112.374 -177.242 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -47.11 -33.78 5.38 Favored 'General case' 0 CA--C 1.53 0.183 0 C-N-CA 124.272 1.029 . . . . 0.0 112.921 -179.821 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 24.5 mtmm -59.97 -26.66 66.19 Favored 'General case' 0 CA--C 1.539 0.531 0 CA-C-N 118.946 0.794 . . . . 0.0 112.427 179.926 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 42.3 mt-10 -79.56 -15.29 57.95 Favored 'General case' 0 CA--C 1.529 0.159 0 C-N-CA 124.395 1.078 . . . . 0.0 111.986 174.707 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 97.47 -56.49 1.2 Allowed Glycine 0 CA--C 1.523 0.556 0 N-CA-C 108.532 -1.827 . . . . 0.0 108.532 -169.759 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 9.9 t70 -62.96 117.83 36.46 Favored Pre-proline 0 CA--C 1.538 0.494 0 CA-C-O 118.977 -0.535 . . . . 0.0 110.062 178.235 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 20' ' ' PRO . . . . . . . . . . . . . 68.8 Cg_endo -79.75 -25.38 5.37 Favored 'Trans proline' 0 N--CA 1.456 -0.72 0 C-N-CA 122.303 2.002 . . . . 0.0 112.855 -177.53 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 35.7 m120 -91.24 -5.2 55.16 Favored 'General case' 0 C--O 1.234 0.267 0 C-N-CA 125.207 1.403 . . . . 0.0 113.763 -168.716 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 49.2 tt0 -141.42 129.6 22.19 Favored 'General case' 0 CA--C 1.541 0.599 0 C-N-CA 123.674 0.79 . . . . 0.0 111.69 -169.684 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 63.0 mt -102.42 137.39 40.73 Favored 'General case' 0 C--N 1.344 0.359 0 C-N-CA 125.107 1.363 . . . . 0.0 111.958 -179.358 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 78.1 p -79.51 172.95 13.09 Favored 'General case' 0 C--O 1.234 0.25 0 C-N-CA 124.609 1.164 . . . . 0.0 109.368 168.542 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 58.7 mttm -56.66 -47.58 79.48 Favored 'General case' 0 N--CA 1.456 -0.161 0 O-C-N 122.124 -0.36 . . . . 0.0 110.031 172.007 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 41.5 tt0 -64.2 -46.39 84.14 Favored 'General case' 0 N--CA 1.45 -0.433 0 N-CA-C 110.286 -0.264 . . . . 0.0 110.286 -175.911 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 1.1 mp0 -61.6 -41.69 97.8 Favored 'General case' 0 N--CA 1.45 -0.47 0 CA-C-O 118.532 -0.746 . . . . 0.0 110.098 177.671 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 12.8 mt -57.0 -44.89 83.19 Favored 'General case' 0 CA--C 1.512 -0.519 0 CA-C-N 119.746 1.157 . . . . 0.0 112.611 169.476 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 4.8 ttpm? -61.7 -47.55 84.77 Favored 'General case' 0 C--N 1.323 -0.549 0 CA-C-N 118.495 0.589 . . . . 0.0 109.905 -176.113 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 9.8 mp -60.53 -48.23 82.68 Favored 'General case' 0 C--N 1.329 -0.289 0 C-N-CA 122.539 0.336 . . . . 0.0 111.198 176.715 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 7.4 tt -50.38 -58.25 6.12 Favored 'General case' 0 C--N 1.333 -0.138 0 C-N-CA 123.7 0.8 . . . . 0.0 109.552 175.441 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 42.0 mt -57.45 -53.46 57.85 Favored 'General case' 0 N--CA 1.452 -0.339 0 CA-C-N 115.656 -0.702 . . . . 0.0 109.295 -177.527 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 22.2 tt0 -54.6 -49.31 70.75 Favored 'General case' 0 N--CA 1.453 -0.301 0 C-N-CA 123.683 0.793 . . . . 0.0 111.659 -177.281 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 2.7 m -72.8 -50.4 24.5 Favored 'General case' 0 CA--C 1.532 0.269 0 C-N-CA 120.968 -0.293 . . . . 0.0 110.869 -175.416 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 65.5 mm-40 -92.67 -30.02 15.79 Favored 'General case' 0 N--CA 1.45 -0.453 0 N-CA-C 113.254 0.835 . . . . 0.0 113.254 -165.966 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 80.8 m-85 -142.19 61.45 12.14 Favored Pre-proline 0 CA--C 1.535 0.368 0 C-N-CA 124.019 0.928 . . . . 0.0 111.413 -175.256 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 39.2 Cg_endo -60.54 -30.49 90.77 Favored 'Trans proline' 0 N--CA 1.457 -0.668 0 C-N-CA 122.825 2.35 . . . . 0.0 111.19 -178.42 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 2.9 p -53.59 -57.22 11.52 Favored 'General case' 0 N--CA 1.446 -0.627 0 C-N-CA 125.523 1.529 . . . . 0.0 109.173 174.834 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 93.1 mt -66.82 -38.41 86.4 Favored 'General case' 0 N--CA 1.452 -0.346 0 C-N-CA 123.962 0.905 . . . . 0.0 111.484 179.119 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 2.9 tm? -53.08 -49.6 66.09 Favored 'General case' 0 N--CA 1.462 0.135 0 N-CA-C 110.018 -0.364 . . . . 0.0 110.018 177.425 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 58.9 mtmt -70.15 -65.74 0.69 Allowed 'General case' 0 N--CA 1.451 -0.388 0 CA-C-O 121.765 0.793 . . . . 0.0 110.228 175.539 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . -79.13 67.84 3.2 Favored Glycine 0 CA--C 1.525 0.689 0 C-N-CA 124.559 1.076 . . . . 0.0 110.62 -177.833 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 43' ' ' GLY . . . . . . . . . . . . . . . -154.57 175.25 32.76 Favored Glycine 0 CA--C 1.524 0.65 0 N-CA-C 110.461 -1.056 . . . . 0.0 110.461 178.882 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 44' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -63.61 160.05 17.57 Favored 'General case' 0 N--CA 1.45 -0.472 0 C-N-CA 123.72 0.808 . . . . 0.0 109.74 171.195 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 11.7 p -59.45 144.15 47.85 Favored 'General case' 0 N--CA 1.452 -0.345 0 N-CA-C 108.82 -0.807 . . . . 0.0 108.82 174.101 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 65.6 tp -50.27 -45.78 54.55 Favored 'General case' 0 C--O 1.227 -0.115 0 C-N-CA 123.314 0.646 . . . . 0.0 111.923 -170.464 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 16.0 m-20 -60.02 -51.9 67.68 Favored 'General case' 0 N--CA 1.447 -0.624 0 CA-C-O 120.918 0.39 . . . . 0.0 111.305 -179.839 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 44.0 tt0 -56.05 -48.26 76.35 Favored 'General case' 0 N--CA 1.451 -0.419 0 CA-C-N 115.998 -0.546 . . . . 0.0 109.759 177.157 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 62.1 tp -56.02 -50.94 69.5 Favored 'General case' 0 N--CA 1.452 -0.362 0 C-N-CA 122.893 0.477 . . . . 0.0 110.216 178.943 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 50' ' ' PHE . . . . . . . . . . . . . 64.3 t80 -54.77 -50.44 68.44 Favored 'General case' 0 N--CA 1.45 -0.444 0 C-N-CA 123.649 0.78 . . . . 0.0 110.217 179.54 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 35.4 mt-10 -59.21 -47.26 86.0 Favored 'General case' 0 N--CA 1.454 -0.252 0 CA-C-O 120.677 0.275 . . . . 0.0 110.905 179.552 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 35.3 mm-40 -62.34 -37.0 83.95 Favored 'General case' 0 C--N 1.332 -0.17 0 C-N-CA 123.025 0.53 . . . . 0.0 111.75 179.962 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 79.9 mt -72.97 -44.95 60.51 Favored 'General case' 0 N--CA 1.449 -0.478 0 O-C-N 122.038 -0.414 . . . . 0.0 111.53 178.176 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 27.4 t70 -78.78 60.16 2.73 Favored 'General case' 0 C--O 1.235 0.298 0 CA-C-O 121.023 0.439 . . . . 0.0 111.795 -170.01 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 29.7 mmmt -74.97 77.74 2.18 Favored 'General case' 0 N--CA 1.452 -0.354 0 CA-C-O 122.941 1.353 . . . . 0.0 110.956 -179.66 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 56' ' ' ASN . . . . . . . . . . . . . 3.8 p30 -172.28 -37.65 0.02 OUTLIER 'General case' 0 C--N 1.322 -0.595 0 C-N-CA 129.206 3.003 . . . . 0.0 108.6 175.862 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . 94.43 14.17 51.56 Favored Glycine 0 CA--C 1.53 0.99 0 CA-C-O 118.732 -1.038 . . . . 0.0 114.844 170.222 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 1.3 p-10 -74.35 -36.33 63.61 Favored 'General case' 0 CA--C 1.532 0.253 0 CA-C-N 119.756 1.778 . . . . 0.0 109.395 172.116 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . 127.9 -66.53 0.56 Allowed Glycine 0 N--CA 1.443 -0.868 0 C-N-CA 126.107 1.813 . . . . 0.0 108.813 178.289 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 36.4 mt-10 -77.69 130.95 37.45 Favored 'General case' 0 C--N 1.331 -0.199 0 CA-C-O 121.211 0.529 . . . . 0.0 110.062 -168.331 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 61' ' ' VAL . . . . . . . . . . . . . 3.6 t -80.42 117.69 26.78 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.251 0 C-N-CA 123.827 0.851 . . . . 0.0 110.955 -166.361 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 87.0 p -76.71 157.01 32.06 Favored 'General case' 0 CA--C 1.532 0.267 0 CA-C-N 118.161 0.437 . . . . 0.0 110.466 177.484 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 63' ' ' PHE . . . . . . . . . . . . . 79.3 t80 -55.22 -32.13 62.01 Favored 'General case' 0 CA--C 1.533 0.291 0 O-C-N 121.762 -0.586 . . . . 0.0 112.394 177.087 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 44.3 mt-10 -64.95 -61.63 2.05 Favored 'General case' 0 N--CA 1.451 -0.404 0 O-C-N 121.803 -0.56 . . . . 0.0 110.12 178.329 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 8.4 pt-20 -66.21 -27.53 68.05 Favored 'General case' 0 CA--C 1.538 0.508 0 O-C-N 121.143 -0.973 . . . . 0.0 111.522 -177.824 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 18.0 t80 -52.22 -25.26 8.8 Favored 'General case' 0 CA--C 1.537 0.468 0 C-N-CA 123.848 0.859 . . . . 0.0 111.931 168.449 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 67' ' ' GLN . . . . . . . . . . . . . 67.9 mm-40 -55.17 -23.95 24.26 Favored 'General case' 0 CA--C 1.538 0.482 0 CA-C-N 119.678 1.126 . . . . 0.0 113.01 171.435 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 91.6 t -60.86 -36.32 70.79 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.532 0 CA-C-N 119.575 1.08 . . . . 0.0 110.233 169.914 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 1.4 tt -72.38 -46.05 57.04 Favored 'General case' 0 N--CA 1.453 -0.283 0 N-CA-C 106.694 -1.595 . . . . 0.0 106.694 178.659 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 70' ' ' VAL . . . . . . . . . . . . . 40.3 t -54.16 -42.4 55.86 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.408 0 O-C-N 122.092 -0.38 . . . . 0.0 110.743 175.193 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 48.8 tttp -55.81 -53.54 55.47 Favored 'General case' 0 N--CA 1.452 -0.331 0 CA-C-O 119.124 -0.465 . . . . 0.0 110.243 172.983 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 14.2 mptt -52.07 -47.88 64.96 Favored 'General case' 0 CA--C 1.535 0.394 0 CA-C-N 118.049 0.386 . . . . 0.0 111.913 176.668 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 73' ' ' ILE . . . . . . . . . . . . . 76.3 mt -53.09 -49.01 52.34 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.378 0 N-CA-C 108.671 -0.863 . . . . 0.0 108.671 175.082 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 74' ' ' SER . . . . . 0.987 ' O ' ' OXT' ' A' ' 75' ' ' GLN . 4.2 m -83.02 19.17 1.45 Allowed 'General case' 0 CA--C 1.536 0.432 0 C-N-CA 124.462 1.105 . . . . 0.0 112.402 179.462 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 75' ' ' GLN . . . . . 0.987 ' OXT' ' O ' ' A' ' 74' ' ' SER . 32.2 mm-40 . . . . . 0 C--O 1.271 2.19 0 C-N-CA 125.691 1.597 . . . . 0.0 112.242 -169.26 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 1' ' ' LYS . . . . . 0.612 ' O ' ' OXT' ' A' ' 75' ' ' GLN . 42.0 mmtm . . . . . 0 CA--C 1.533 0.301 0 N-CA-C 109.727 -0.472 . . . . 0.0 109.727 . . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 56.2 p -83.16 163.33 51.05 Favored Pre-proline 0 CA--C 1.534 0.36 0 C-N-CA 123.198 0.599 . . . . 0.0 109.388 174.916 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 92.8 Cg_exo -45.35 -44.09 16.6 Favored 'Trans proline' 0 N--CA 1.459 -0.505 0 C-N-CA 123.382 2.721 . . . . 0.0 113.037 173.917 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 3.0 mp0 -57.43 -50.71 72.12 Favored 'General case' 0 N--CA 1.455 -0.191 0 C-N-CA 123.957 0.903 . . . . 0.0 111.51 177.978 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 54.0 mm-40 -60.86 -44.46 97.0 Favored 'General case' 0 N--CA 1.451 -0.389 0 N-CA-C 108.667 -0.864 . . . . 0.0 108.667 177.693 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 21.0 mt -60.46 -35.75 76.62 Favored 'General case' 0 N--CA 1.447 -0.579 0 C-N-CA 123.492 0.717 . . . . 0.0 112.212 -179.023 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 23.9 tptm -61.09 -51.9 67.18 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 118.799 0.727 . . . . 0.0 110.731 169.369 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . -53.27 -52.16 42.39 Favored Glycine 0 CA--C 1.53 1.028 0 N-CA-C 110.412 -1.075 . . . . 0.0 110.412 -179.434 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 9' ' ' ILE . . . . . . . . . . . . . 77.5 mt -53.34 -54.61 17.05 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.345 0 C-N-CA 126.466 1.906 . . . . 0.0 110.1 173.289 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 10' ' ' PHE . . . . . . . . . . . . . 53.5 t80 -49.36 -53.34 22.89 Favored 'General case' 0 N--CA 1.45 -0.475 0 N-CA-C 108.84 -0.8 . . . . 0.0 108.84 -179.075 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 51.3 mt-10 -60.81 -52.93 63.0 Favored 'General case' 0 N--CA 1.455 -0.213 0 C-N-CA 122.623 0.369 . . . . 0.0 110.333 -178.273 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 17.2 ttpp -45.88 -54.84 7.51 Favored 'General case' 0 C--O 1.23 0.074 0 C-N-CA 125.142 1.377 . . . . 0.0 111.322 178.73 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 57.9 m-85 -77.18 -48.21 18.24 Favored 'General case' 0 N--CA 1.451 -0.415 0 N-CA-C 110.009 -0.367 . . . . 0.0 110.009 -175.191 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -47.91 -50.08 27.92 Favored 'General case' 0 N--CA 1.463 0.215 0 C-N-CA 124.641 1.176 . . . . 0.0 111.413 179.461 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -50.52 -37.92 41.7 Favored 'General case' 0 N--CA 1.453 -0.279 0 C-N-CA 123.717 0.807 . . . . 0.0 112.526 177.279 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 37.4 ttpt -76.18 70.36 2.82 Favored 'General case' 0 N--CA 1.45 -0.444 0 C-N-CA 123.72 0.808 . . . . 0.0 109.245 -177.924 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 34.4 tt0 120.2 -56.65 0.0 OUTLIER 'General case' 0 N--CA 1.468 0.457 0 C-N-CA 129.803 3.241 . . . . 0.0 111.314 173.564 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . -88.95 14.05 61.46 Favored Glycine 0 CA--C 1.525 0.678 0 CA-C-O 119.128 -0.818 . . . . 0.0 114.221 -167.436 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER 58.1 150.95 0.07 OUTLIER Pre-proline 0 CA--C 1.543 0.68 0 C-N-CA 125.728 1.611 . . . . 0.0 112.091 -169.707 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 20' ' ' PRO . . . . . . . . . . . . . 4.8 Cg_endo -47.02 -22.0 1.88 Allowed 'Trans proline' 0 CA--C 1.536 0.597 0 C-N-CA 123.914 3.076 . . . . 0.0 116.576 -174.317 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 53.1 m-80 -91.49 -5.66 53.85 Favored 'General case' 0 N--CA 1.449 -0.523 0 C-N-CA 123.695 0.798 . . . . 0.0 112.023 -171.969 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -152.43 127.52 9.75 Favored 'General case' 0 CA--C 1.538 0.493 0 CA-C-N 119.671 1.123 . . . . 0.0 112.852 -167.942 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 70.2 mt -94.54 124.82 38.8 Favored 'General case' 0 C--O 1.235 0.328 0 O-C-N 121.501 -0.749 . . . . 0.0 110.555 174.761 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 4.9 p -79.02 177.67 8.62 Favored 'General case' 0 C--O 1.238 0.463 0 N-CA-C 107.841 -1.17 . . . . 0.0 107.841 166.411 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 98.7 mttt -54.94 -39.77 69.22 Favored 'General case' 0 N--CA 1.451 -0.377 0 O-C-N 122.192 -0.318 . . . . 0.0 110.338 173.304 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 28.5 mt-10 -69.94 -45.61 67.1 Favored 'General case' 0 N--CA 1.454 -0.272 0 N-CA-C 109.65 -0.5 . . . . 0.0 109.65 -173.113 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 1.6 mp0 -55.17 -50.14 70.1 Favored 'General case' 0 N--CA 1.45 -0.464 0 N-CA-C 109.24 -0.652 . . . . 0.0 109.24 173.676 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 8.0 mt -56.33 -41.59 76.31 Favored 'General case' 0 CA--C 1.513 -0.473 0 N-CA-C 113.198 0.814 . . . . 0.0 113.198 174.365 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 64.7 tttm -62.6 -51.84 65.74 Favored 'General case' 0 C--N 1.321 -0.651 0 CA-C-N 118.485 0.584 . . . . 0.0 110.026 -177.383 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 4.0 mm? -60.41 -46.15 91.03 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.115 -0.493 . . . . 0.0 111.143 178.008 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 6.6 tt -51.23 -57.49 8.68 Favored 'General case' 0 C--N 1.333 -0.152 0 C-N-CA 124.217 1.007 . . . . 0.0 109.399 174.649 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 35.1 mt -55.07 -56.78 15.95 Favored 'General case' 0 C--N 1.331 -0.22 0 C-N-CA 123.23 0.612 . . . . 0.0 109.557 -178.065 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 23.5 mt-30 -52.25 -53.48 43.27 Favored 'General case' 0 N--CA 1.456 -0.135 0 C-N-CA 123.088 0.555 . . . . 0.0 111.671 -178.67 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 13.4 m -74.07 -47.73 34.64 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 116.266 -0.424 . . . . 0.0 110.822 -169.96 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 69.8 mm-40 -85.71 -34.59 21.21 Favored 'General case' 0 N--CA 1.449 -0.513 0 C-N-CA 123.207 0.603 . . . . 0.0 111.313 -170.986 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 82.5 m-85 -139.78 61.07 17.37 Favored Pre-proline 0 CA--C 1.536 0.438 0 C-N-CA 123.67 0.788 . . . . 0.0 112.278 -171.562 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 49.2 Cg_endo -62.33 -21.13 72.21 Favored 'Trans proline' 0 N--CA 1.458 -0.611 0 C-N-CA 123.169 2.58 . . . . 0.0 111.952 -179.558 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 4.8 p -73.39 -68.7 0.48 Allowed 'General case' 0 N--CA 1.445 -0.687 0 C-N-CA 124.217 1.007 . . . . 0.0 108.363 175.403 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 91.1 mt -58.51 -24.11 59.75 Favored 'General case' 0 CA--C 1.53 0.185 0 C-N-CA 124.384 1.073 . . . . 0.0 112.197 -173.709 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 57.9 tp -44.1 -37.85 3.31 Favored 'General case' 0 CA--C 1.537 0.45 0 C-N-CA 123.649 0.78 . . . . 0.0 112.56 169.104 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 53.4 mtpt 26.36 -93.76 0.01 OUTLIER 'General case' 0 N--CA 1.446 -0.629 0 C-N-CA 128.276 2.63 . . . . 0.0 114.623 -176.642 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . 151.72 -148.38 19.32 Favored Glycine 0 CA--C 1.525 0.664 0 N-CA-C 107.499 -2.241 . . . . 0.0 107.499 -173.468 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 43' ' ' GLY . . . . . . . . . . . . . . . 71.45 -74.63 0.71 Allowed Glycine 0 CA--C 1.526 0.755 0 N-CA-C 109.42 -1.472 . . . . 0.0 109.42 -176.725 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 44' ' ' SER . . . . . . . . . . . . . 17.2 m -68.6 139.89 55.53 Favored 'General case' 0 N--CA 1.452 -0.328 0 N-CA-C 108.428 -0.953 . . . . 0.0 108.428 169.913 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 69.8 p -80.45 154.49 27.59 Favored 'General case' 0 CA--C 1.531 0.225 0 N-CA-C 109.668 -0.493 . . . . 0.0 109.668 179.426 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 58.2 tp -52.5 -43.5 65.08 Favored 'General case' 0 C--O 1.225 -0.204 0 N-CA-C 109.739 -0.467 . . . . 0.0 109.739 169.807 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 5.6 m-20 -56.77 -53.51 56.96 Favored 'General case' 0 N--CA 1.45 -0.472 0 C-N-CA 124.067 0.947 . . . . 0.0 110.868 177.285 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 76.5 tt0 -54.78 -50.55 68.2 Favored 'General case' 0 C--N 1.33 -0.254 0 C-N-CA 122.942 0.497 . . . . 0.0 110.528 177.929 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 59.5 tp -57.31 -48.36 79.13 Favored 'General case' 0 N--CA 1.455 -0.18 0 CA-C-O 121.27 0.557 . . . . 0.0 109.979 178.856 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 50' ' ' PHE . . . . . . . . . . . . . 80.3 t80 -56.18 -48.12 76.99 Favored 'General case' 0 N--CA 1.45 -0.469 0 C-N-CA 123.777 0.831 . . . . 0.0 110.43 179.492 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 33.6 mt-10 -59.6 -46.77 87.98 Favored 'General case' 0 N--CA 1.455 -0.207 0 C-N-CA 122.883 0.473 . . . . 0.0 110.612 177.641 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 44.5 tt0 -54.47 -49.22 70.62 Favored 'General case' 0 CA--C 1.53 0.182 0 C-N-CA 123.065 0.546 . . . . 0.0 110.589 177.416 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 72.8 mt -70.1 -44.49 68.89 Favored 'General case' 0 N--CA 1.45 -0.449 0 C-N-CA 123.229 0.612 . . . . 0.0 111.672 -177.102 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 52.1 t0 -73.58 57.18 0.55 Allowed 'General case' 0 CA--C 1.535 0.371 0 C-N-CA 125.34 1.456 . . . . 0.0 109.655 177.108 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 12.3 tptm -65.36 -28.82 69.55 Favored 'General case' 0 N--CA 1.452 -0.361 0 O-C-N 121.611 -0.681 . . . . 0.0 111.449 -172.627 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 56' ' ' ASN . . . . . . . . . . . . . 30.0 p30 -75.09 -11.34 60.07 Favored 'General case' 0 CA--C 1.536 0.422 0 N-CA-C 112.178 0.436 . . . . 0.0 112.178 174.827 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . 63.75 32.83 85.49 Favored Glycine 0 CA--C 1.53 0.981 0 C-N-CA 124.043 0.83 . . . . 0.0 113.345 179.28 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 2.2 p30 -78.31 -15.17 59.01 Favored 'General case' 0 CA--C 1.533 0.314 0 CA-C-N 118.948 1.374 . . . . 0.0 112.237 -179.509 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . 108.21 -8.44 35.67 Favored Glycine 0 CA--C 1.53 0.975 0 C-N-CA 123.909 0.766 . . . . 0.0 112.653 177.521 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 37.3 mt-10 -146.29 177.38 9.05 Favored 'General case' 0 N--CA 1.455 -0.223 0 C-N-CA 127.265 2.226 . . . . 0.0 107.087 175.286 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 61' ' ' VAL . . . . . . . . . . . . . 3.0 t -108.47 115.32 48.96 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.244 0 N-CA-C 109.865 -0.42 . . . . 0.0 109.865 -177.554 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 78.1 p -79.52 161.68 25.87 Favored 'General case' 0 CA--C 1.536 0.405 0 C-N-CA 123.842 0.857 . . . . 0.0 110.086 171.272 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 63' ' ' PHE . . . . . . . . . . . . . 60.4 t80 -59.15 -38.56 79.98 Favored 'General case' 0 N--CA 1.462 0.172 0 O-C-N 121.613 -0.679 . . . . 0.0 111.732 -176.064 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 22.0 mp0 -63.38 -57.29 10.81 Favored 'General case' 0 N--CA 1.447 -0.613 0 N-CA-C 109.163 -0.68 . . . . 0.0 109.163 -175.071 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 15.5 pt-20 -66.4 -32.81 74.43 Favored 'General case' 0 CA--C 1.537 0.464 0 O-C-N 121.545 -0.722 . . . . 0.0 111.459 179.007 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 18.6 t80 -53.22 -24.85 12.12 Favored 'General case' 0 CA--C 1.538 0.502 0 O-C-N 121.467 -0.771 . . . . 0.0 111.73 169.553 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 67' ' ' GLN . . . . . . . . . . . . . 33.8 mm-40 -54.05 -22.96 11.99 Favored 'General case' 0 CA--C 1.535 0.389 0 CA-C-N 119.569 1.077 . . . . 0.0 113.291 172.218 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 69.7 t -53.25 -37.92 29.71 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.487 0 CA-C-N 119.484 1.038 . . . . 0.0 110.38 170.073 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 19.9 tp -74.6 -48.55 25.9 Favored 'General case' 0 N--CA 1.456 -0.165 0 N-CA-C 108.3 -1.0 . . . . 0.0 108.3 177.53 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 70' ' ' VAL . . . . . . . . . . . . . 56.5 t -51.25 -41.5 24.74 Favored 'Isoleucine or valine' 0 C--O 1.225 -0.233 0 C-N-CA 122.574 0.35 . . . . 0.0 110.641 -179.718 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 21.7 tptm -51.97 -58.21 7.18 Favored 'General case' 0 N--CA 1.454 -0.248 0 C-N-CA 123.331 0.652 . . . . 0.0 110.993 174.392 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 4.4 mptp? -54.23 -45.74 72.37 Favored 'General case' 0 CA--C 1.531 0.23 0 C-N-CA 122.528 0.331 . . . . 0.0 111.144 177.816 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 73' ' ' ILE . . . . . 0.852 HG23 ' OXT' ' A' ' 75' ' ' GLN . 50.1 mm -63.24 -39.92 87.08 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.323 0 O-C-N 122.333 -0.23 . . . . 0.0 110.933 -179.766 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 85.4 p 57.72 -84.71 0.02 OUTLIER 'General case' 0 CA--C 1.533 0.319 0 C-N-CA 127.555 2.342 . . . . 0.0 110.233 -169.137 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 75' ' ' GLN . . . . . 0.852 ' OXT' HG23 ' A' ' 73' ' ' ILE . 14.1 mm100 . . . . . 0 C--O 1.27 2.148 0 C-N-CA 125.81 1.644 . . . . 0.0 107.645 169.293 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 95.4 Cg_exo . . . . . 0 N--CA 1.458 -0.614 0 N-CA-C 112.657 0.214 . . . . 0.0 112.657 . . . . . . . . . 0 0 . 1 . 001 nuclear build core ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 2.9 mp0 -60.38 -48.74 80.47 Favored 'General case' 0 N--CA 1.455 -0.216 0 C-N-CA 124.005 0.922 . . . . 0.0 112.04 176.114 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 32.8 mt-10 -62.18 -44.41 96.66 Favored 'General case' 0 N--CA 1.453 -0.282 0 N-CA-C 109.19 -0.67 . . . . 0.0 109.19 177.802 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 40.9 mt -60.48 -38.01 82.88 Favored 'General case' 0 N--CA 1.449 -0.504 0 C-N-CA 123.455 0.702 . . . . 0.0 111.869 177.648 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 20.8 tptm -60.62 -49.72 76.39 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 118.442 0.564 . . . . 0.0 110.221 170.635 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . -50.84 -50.1 39.1 Favored Glycine 0 CA--C 1.531 1.061 0 N-CA-C 110.63 -0.988 . . . . 0.0 110.63 177.176 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 9' ' ' ILE . . . . . . . . . . . . . 19.5 mm -58.98 -54.76 29.63 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.235 0 C-N-CA 125.826 1.65 . . . . 0.0 109.958 176.904 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 10' ' ' PHE . . . . . . . . . . . . . 32.3 t80 -47.66 -52.78 16.97 Favored 'General case' 0 N--CA 1.451 -0.419 0 O-C-N 121.605 -0.685 . . . . 0.0 109.703 177.762 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 52.9 mt-10 -60.02 -51.19 70.71 Favored 'General case' 0 N--CA 1.453 -0.318 0 C-N-CA 123.668 0.787 . . . . 0.0 110.359 -179.578 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 58.4 tttt -44.27 -59.91 2.16 Favored 'General case' 0 C--N 1.339 0.115 0 C-N-CA 124.126 0.97 . . . . 0.0 110.214 175.913 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 63.0 m-85 -75.42 -38.73 59.63 Favored 'General case' 0 N--CA 1.452 -0.345 0 C-N-CA 120.449 -0.5 . . . . 0.0 110.88 -169.124 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -57.24 -58.85 6.44 Favored 'General case' 0 C--O 1.237 0.411 0 CA-C-O 122.013 0.911 . . . . 0.0 110.015 174.939 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.454 -0.267 0 C-N-CA 124.282 1.033 . . . . 0.0 111.441 178.972 . . . . . . . . 0 0 . 1 . 001 nuclear build core ' A' A ' 20' ' ' PRO . . . . . . . . . . . . . 72.2 Cg_endo . . . . . 0 N--CA 1.455 -0.793 0 N-CA-C 112.781 0.262 . . . . 0.0 112.781 . . . . . . . . . 0 0 . 1 . 001 nuclear build core ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 92.9 m-20 -97.69 -15.15 20.51 Favored 'General case' 0 N--CA 1.454 -0.242 0 C-N-CA 124.464 1.106 . . . . 0.0 113.325 -166.772 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 7.1 tp60 -138.67 127.23 23.27 Favored 'General case' 0 CA--C 1.537 0.443 0 C-N-CA 123.725 0.81 . . . . 0.0 109.992 -168.307 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 74.8 mt -95.07 129.32 42.21 Favored 'General case' 0 CA--C 1.531 0.241 0 C-N-CA 124.301 1.041 . . . . 0.0 110.782 178.666 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 1.5 p -79.16 176.02 10.06 Favored 'General case' 0 C--O 1.238 0.472 0 N-CA-C 108.301 -1.0 . . . . 0.0 108.301 167.103 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 58.1 mttp -54.24 -38.77 66.14 Favored 'General case' 0 N--CA 1.451 -0.39 0 CA-C-O 119.352 -0.356 . . . . 0.0 110.902 175.162 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 31.3 mm-40 -71.42 -47.4 56.21 Favored 'General case' 0 CA--C 1.518 -0.26 0 CA-C-N 118.436 0.562 . . . . 0.0 110.557 -171.243 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 2.2 mp0 -53.97 -48.96 69.81 Favored 'General case' 0 N--CA 1.451 -0.418 0 CA-C-N 115.87 -0.605 . . . . 0.0 109.549 172.368 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 13.1 mt -56.97 -43.52 81.71 Favored 'General case' 0 C--O 1.218 -0.554 0 C-N-CA 120.023 -0.671 . . . . 0.0 112.304 174.59 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 37.6 ttpt -61.67 -47.86 83.44 Favored 'General case' 0 C--N 1.32 -0.702 0 CA-C-N 118.5 0.591 . . . . 0.0 110.121 -176.641 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 11.8 tp -65.56 -43.8 88.76 Favored 'General case' 0 CA--C 1.533 0.326 0 CA-C-O 120.609 0.242 . . . . 0.0 110.877 179.823 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 7.1 tt -50.73 -58.71 5.25 Favored 'General case' 0 CA--C 1.522 -0.119 0 C-N-CA 124.146 0.979 . . . . 0.0 109.549 173.521 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 31.0 mt -58.93 -52.73 64.52 Favored 'General case' 0 C--O 1.219 -0.501 0 N-CA-C 108.782 -0.821 . . . . 0.0 108.782 -177.882 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 22.9 tt0 -49.5 -45.62 47.28 Favored 'General case' 0 C--N 1.332 -0.194 0 O-C-N 121.37 -0.831 . . . . 0.0 111.775 179.25 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 7.9 m -74.09 -54.74 7.18 Favored 'General case' 0 CA--C 1.533 0.325 0 CA-C-O 120.61 0.243 . . . . 0.0 111.612 -177.81 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 29.5 mm-40 -91.98 -33.4 14.86 Favored 'General case' 0 N--CA 1.452 -0.339 0 C-N-CA 124.008 0.923 . . . . 0.0 113.138 -166.36 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 79.6 m-85 . . . . . 0 CA--C 1.536 0.439 0 C-N-CA 124.98 1.312 . . . . 0.0 111.525 -171.912 . . . . . . . . 0 0 . 1 . 001 nuclear build core ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 48.3 tp . . . . . 0 CA--C 1.519 -0.242 0 N-CA-C 112.842 0.682 . . . . 0.0 112.842 . . . . . . . . . 0 0 . 1 . 001 nuclear build core ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 7.4 m-20 -64.07 -43.38 95.64 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-N 115.843 -0.617 . . . . 0.0 111.1 -174.898 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 29.7 mm-40 -71.14 -42.24 69.42 Favored 'General case' 0 N--CA 1.45 -0.45 0 N-CA-C 109.263 -0.643 . . . . 0.0 109.263 177.219 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 56.5 tp -53.96 -47.64 71.13 Favored 'General case' 0 N--CA 1.452 -0.367 0 N-CA-C 109.539 -0.541 . . . . 0.0 109.539 177.448 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 50' ' ' PHE . . . . . . . . . . . . . 82.9 t80 -51.69 -53.73 35.93 Favored 'General case' 0 N--CA 1.454 -0.266 0 C-N-CA 123.657 0.783 . . . . 0.0 110.614 177.987 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 72.2 mm-40 -56.06 -49.12 74.64 Favored 'General case' 0 CA--C 1.532 0.283 0 CA-C-O 120.605 0.24 . . . . 0.0 110.968 177.429 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 50.2 mm-40 -57.73 -40.99 80.92 Favored 'General case' 0 CA--C 1.531 0.219 0 C-N-CA 122.779 0.432 . . . . 0.0 112.138 179.801 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 62.2 mt -71.44 -41.15 69.83 Favored 'General case' 0 N--CA 1.45 -0.464 0 C-N-CA 122.857 0.463 . . . . 0.0 111.011 179.16 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 19.6 t70 . . . . . 0 CA--C 1.541 0.621 0 C-N-CA 125.966 1.707 . . . . 0.0 112.136 -178.386 . . . . . . . . 0 0 . 1 . 001 nuclear build core ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 56.5 mt-10 . . . . . 0 N--CA 1.452 -0.345 0 N-CA-C 109.42 -0.585 . . . . 0.0 109.42 . . . . . . . . . 0 0 . 1 . 001 nuclear build core ' A' A ' 61' ' ' VAL . . . . . . . . . . . . . 3.7 t -103.91 120.94 54.81 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.422 0 C-N-CA 123.332 0.653 . . . . 0.0 111.354 -167.183 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 95.1 p -77.45 163.7 26.11 Favored 'General case' 0 N--CA 1.463 0.195 0 C-N-CA 123.196 0.598 . . . . 0.0 110.492 174.931 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 63' ' ' PHE . . . . . . . . . . . . . 68.9 t80 -59.38 -32.99 70.65 Favored 'General case' 0 CA--C 1.528 0.133 0 O-C-N 122.032 -0.418 . . . . 0.0 111.879 176.091 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 39.2 mm-40 -66.97 -59.1 3.78 Favored 'General case' 0 N--CA 1.446 -0.639 0 N-CA-C 109.363 -0.606 . . . . 0.0 109.363 -179.437 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 8.3 pt-20 -66.91 -29.58 69.49 Favored 'General case' 0 CA--C 1.54 0.578 0 O-C-N 121.5 -0.75 . . . . 0.0 111.313 -177.656 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 13.3 t80 -50.63 -28.53 9.01 Favored 'General case' 0 CA--C 1.536 0.417 0 C-N-CA 123.825 0.85 . . . . 0.0 111.891 168.779 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 67' ' ' GLN . . . . . . . . . . . . . 80.5 mm-40 -55.32 -23.32 23.08 Favored 'General case' 0 CA--C 1.535 0.401 0 CA-C-N 119.696 1.135 . . . . 0.0 112.962 174.668 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 88.4 t -55.25 -32.38 28.42 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.526 0 CA-C-N 119.472 1.033 . . . . 0.0 110.765 171.701 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 37.2 tp -71.33 -47.72 54.81 Favored 'General case' 0 N--CA 1.454 -0.257 0 N-CA-C 107.159 -1.423 . . . . 0.0 107.159 179.47 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 70' ' ' VAL . . . . . . . . . . . . . 18.5 t . . . . . 0 CA--C 1.534 0.348 0 C-N-CA 122.88 0.472 . . . . 0.0 110.142 -179.983 . . . . . . . . 0 0 . 1 . 002 nuclear build core ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 86.9 Cg_exo . . . . . 0 N--CA 1.457 -0.664 0 CA-C-O 120.429 0.095 . . . . 0.0 112.338 . . . . . . . . . 0 0 . 1 . 002 nuclear build core ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 40.3 tt0 -61.11 -49.37 77.56 Favored 'General case' 0 CA--C 1.529 0.17 0 C-N-CA 123.389 0.676 . . . . 0.0 111.103 177.534 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 29.7 mt-10 -60.75 -45.63 93.54 Favored 'General case' 0 N--CA 1.454 -0.272 0 N-CA-C 109.009 -0.738 . . . . 0.0 109.009 177.943 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 19.9 mt -58.41 -40.19 81.8 Favored 'General case' 0 N--CA 1.447 -0.611 0 C-N-CA 123.755 0.822 . . . . 0.0 111.192 179.142 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 21.4 tptm -60.12 -53.05 62.36 Favored 'General case' 0 C--N 1.333 -0.131 0 CA-C-N 118.798 0.726 . . . . 0.0 110.898 171.054 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . -50.5 -52.2 29.55 Favored Glycine 0 CA--C 1.533 1.192 0 N-CA-C 111.269 -0.732 . . . . 0.0 111.269 179.15 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 9' ' ' ILE . . . . . . . . . . . . . 2.4 mm -56.04 -55.04 20.43 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.305 0 C-N-CA 126.475 1.91 . . . . 0.0 108.944 175.818 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 10' ' ' PHE . . . . . . . . . . . . . 38.6 t80 -49.1 -49.89 39.63 Favored 'General case' 0 N--CA 1.448 -0.534 0 O-C-N 121.725 -0.609 . . . . 0.0 109.846 179.797 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 51.0 mt-10 -62.05 -50.99 69.77 Favored 'General case' 0 N--CA 1.455 -0.197 0 C-N-CA 123.081 0.553 . . . . 0.0 110.567 179.417 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 68.9 tttt -44.52 -51.62 8.7 Favored 'General case' 0 CA--C 1.53 0.21 0 C-N-CA 124.341 1.057 . . . . 0.0 110.9 177.167 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 63.1 m-85 -78.4 -46.31 20.21 Favored 'General case' 0 CA--C 1.53 0.206 0 O-C-N 122.341 -0.224 . . . . 0.0 111.296 -176.403 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -57.23 -42.35 81.26 Favored 'General case' 0 C--N 1.329 -0.318 0 O-C-N 121.384 -0.823 . . . . 0.0 111.659 -178.427 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.533 0.308 0 C-N-CA 123.603 0.761 . . . . 0.0 111.921 173.772 . . . . . . . . 0 0 . 1 . 002 nuclear build core ' A' A ' 20' ' ' PRO . . . . . . . . . . . . . 36.4 Cg_endo . . . . . 0 N--CA 1.457 -0.62 0 N-CA-C 112.63 0.204 . . . . 0.0 112.63 . . . . . . . . . 0 0 . 1 . 002 nuclear build core ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 48.5 m-80 -85.06 -1.16 56.52 Favored 'General case' 0 N--CA 1.453 -0.288 0 C-N-CA 124.481 1.112 . . . . 0.0 113.137 -173.17 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 23.6 tt0 -151.27 124.99 9.05 Favored 'General case' 0 CA--C 1.542 0.637 0 CA-C-N 119.749 1.159 . . . . 0.0 113.887 -169.271 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 82.7 mt -98.82 138.11 36.44 Favored 'General case' 0 C--N 1.345 0.386 0 C-N-CA 125.296 1.438 . . . . 0.0 111.632 178.376 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 88.9 p -80.69 174.17 11.88 Favored 'General case' 0 CA--C 1.532 0.283 0 C-N-CA 123.466 0.706 . . . . 0.0 109.734 168.3 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 7.6 mtpm? -56.92 -44.28 82.26 Favored 'General case' 0 C--O 1.226 -0.173 0 N-CA-C 109.721 -0.474 . . . . 0.0 109.721 171.352 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 1.8 mp0 -63.09 -51.95 64.61 Favored 'General case' 0 N--CA 1.451 -0.424 0 C-N-CA 123.285 0.634 . . . . 0.0 110.259 -176.861 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -57.67 -41.77 82.23 Favored 'General case' 0 N--CA 1.451 -0.401 0 CA-C-O 118.564 -0.731 . . . . 0.0 110.422 176.687 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 14.3 mt -57.79 -43.66 85.74 Favored 'General case' 0 CA--C 1.513 -0.446 0 CA-C-N 119.614 1.097 . . . . 0.0 113.126 169.744 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 21.0 ttmm -61.11 -49.36 77.61 Favored 'General case' 0 N--CA 1.449 -0.497 0 CA-C-N 118.773 0.715 . . . . 0.0 109.857 -178.163 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 95.9 mt -62.02 -45.49 93.35 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.39 -0.368 . . . . 0.0 111.169 179.156 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 7.6 tt -50.84 -57.85 7.42 Favored 'General case' 0 C--O 1.232 0.132 0 C-N-CA 124.098 0.959 . . . . 0.0 109.405 173.668 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 40.7 mt -55.56 -58.01 9.53 Favored 'General case' 0 N--CA 1.455 -0.179 0 N-CA-C 109.637 -0.505 . . . . 0.0 109.637 -178.794 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 22.8 tt0 -53.07 -50.45 64.35 Favored 'General case' 0 N--CA 1.452 -0.349 0 C-N-CA 124.202 1.001 . . . . 0.0 111.674 -176.012 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 15.0 m -74.48 -49.97 20.11 Favored 'General case' 0 N--CA 1.453 -0.303 0 CA-C-N 116.34 -0.391 . . . . 0.0 110.898 -173.017 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 73.2 mm-40 -94.58 -32.5 13.41 Favored 'General case' 0 N--CA 1.448 -0.554 0 N-CA-C 112.685 0.624 . . . . 0.0 112.685 -167.06 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 81.6 m-85 . . . . . 0 CA--C 1.538 0.494 0 C-N-CA 123.49 0.716 . . . . 0.0 112.443 -173.919 . . . . . . . . 0 0 . 1 . 002 nuclear build core ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 57.3 tp . . . . . 0 C--O 1.223 -0.305 0 N-CA-C 109.936 -0.394 . . . . 0.0 109.936 . . . . . . . . . 0 0 . 1 . 002 nuclear build core ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 5.6 m-20 -58.96 -52.62 64.98 Favored 'General case' 0 N--CA 1.449 -0.524 0 C-N-CA 123.734 0.814 . . . . 0.0 111.027 179.781 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 33.8 mt-10 -59.37 -45.59 91.0 Favored 'General case' 0 N--CA 1.455 -0.18 0 CA-C-N 116.618 -0.265 . . . . 0.0 111.125 177.88 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 59.7 mt -54.9 -54.72 38.98 Favored 'General case' 0 C--O 1.224 -0.238 0 N-CA-C 109.636 -0.505 . . . . 0.0 109.636 174.802 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 50' ' ' PHE . . . . . . . . . . . . . 80.4 t80 -52.43 -49.92 63.6 Favored 'General case' 0 N--CA 1.449 -0.475 0 C-N-CA 123.965 0.906 . . . . 0.0 110.36 -177.527 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 27.7 tp10 -58.72 -48.34 81.5 Favored 'General case' 0 N--CA 1.454 -0.268 0 CA-C-O 120.755 0.312 . . . . 0.0 110.83 177.143 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 42.8 tt0 -56.68 -39.71 74.28 Favored 'General case' 0 CA--C 1.53 0.174 0 C-N-CA 123.631 0.772 . . . . 0.0 111.156 179.598 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 38.1 mt -78.71 -43.99 24.56 Favored 'General case' 0 N--CA 1.448 -0.56 0 C-N-CA 122.952 0.501 . . . . 0.0 112.114 -178.636 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 53.1 t0 . . . . . 0 CA--C 1.538 0.493 0 C-N-CA 125.101 1.361 . . . . 0.0 111.361 -177.356 . . . . . . . . 0 0 . 1 . 002 nuclear build core ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 31.5 mt-10 . . . . . 0 N--CA 1.452 -0.331 0 N-CA-C 104.944 -2.243 . . . . 0.0 104.944 . . . . . . . . . 0 0 . 1 . 002 nuclear build core ' A' A ' 61' ' ' VAL . . . . . . . . . . . . . 5.1 t -117.02 115.2 48.14 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.193 0 N-CA-C 109.685 -0.487 . . . . 0.0 109.685 -178.599 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 12.6 t -84.89 164.31 18.46 Favored 'General case' 0 CA--C 1.537 0.465 0 C-N-CA 122.65 0.38 . . . . 0.0 111.572 173.537 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 63' ' ' PHE . . . . . . . . . . . . . 64.4 t80 -62.01 -39.63 92.89 Favored 'General case' 0 N--CA 1.464 0.238 0 N-CA-C 112.65 0.611 . . . . 0.0 112.65 -170.044 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 50.9 mt-10 -62.33 -57.09 12.61 Favored 'General case' 0 N--CA 1.453 -0.292 0 N-CA-C 109.639 -0.504 . . . . 0.0 109.639 -178.471 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 20.3 pt-20 -64.28 -34.33 77.88 Favored 'General case' 0 CA--C 1.539 0.547 0 O-C-N 121.639 -0.663 . . . . 0.0 111.425 -179.692 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 17.8 t80 -52.03 -25.4 8.43 Favored 'General case' 0 CA--C 1.538 0.493 0 C-N-CA 123.828 0.851 . . . . 0.0 112.237 169.357 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 67' ' ' GLN . . . . . . . . . . . . . 45.6 mm-40 -54.64 -23.78 18.7 Favored 'General case' 0 CA--C 1.537 0.459 0 CA-C-N 119.745 1.157 . . . . 0.0 113.197 172.473 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 83.0 t -53.96 -33.16 23.55 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.485 0 CA-C-N 119.162 0.892 . . . . 0.0 110.817 170.469 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 19.3 tp -75.47 -53.11 9.2 Favored 'General case' 0 N--CA 1.452 -0.345 0 N-CA-C 108.134 -1.061 . . . . 0.0 108.134 173.163 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 70' ' ' VAL . . . . . . . . . . . . . 58.1 t . . . . . 0 CA--C 1.534 0.352 0 CA-C-N 118.324 0.511 . . . . 0.0 111.74 -175.295 . . . . . . . . 0 0 . 1 . 003 nuclear build core ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 85.8 Cg_exo . . . . . 0 N--CA 1.455 -0.78 0 CA-C-O 120.347 0.061 . . . . 0.0 112.015 . . . . . . . . . 0 0 . 1 . 003 nuclear build core ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 2.8 mp0 -61.3 -47.07 87.64 Favored 'General case' 0 N--CA 1.455 -0.175 0 C-N-CA 123.841 0.857 . . . . 0.0 111.942 176.607 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -62.88 -44.23 96.67 Favored 'General case' 0 C--N 1.331 -0.215 0 N-CA-C 108.974 -0.75 . . . . 0.0 108.974 178.108 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 6' ' ' LEU . . . . . 0.475 HD13 HG22 ' A' ' 70' ' ' VAL . 12.8 mt -59.43 -40.58 87.2 Favored 'General case' 0 N--CA 1.449 -0.501 0 C-N-CA 122.646 0.379 . . . . 0.0 111.844 177.047 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 51.7 tptt -58.62 -47.11 85.46 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 118.414 0.552 . . . . 0.0 110.307 170.167 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . -52.89 -54.65 27.47 Favored Glycine 0 CA--C 1.53 0.989 0 N-CA-C 110.744 -0.943 . . . . 0.0 110.744 179.648 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 9' ' ' ILE . . . . . . . . . . . . . 65.9 mt -51.12 -58.14 2.25 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.13 0 C-N-CA 125.407 1.483 . . . . 0.0 109.523 171.639 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 10' ' ' PHE . . . . . . . . . . . . . 23.7 t80 -49.91 -48.11 51.84 Favored 'General case' 0 N--CA 1.442 -0.826 0 O-C-N 122.006 -0.434 . . . . 0.0 110.07 -175.883 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 55.3 mt-10 -64.88 -50.24 67.34 Favored 'General case' 0 N--CA 1.452 -0.33 0 C-N-CA 123.483 0.713 . . . . 0.0 110.636 179.118 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 21.8 ttpt -43.55 -50.37 7.22 Favored 'General case' 0 N--CA 1.461 0.114 0 C-N-CA 124.161 0.984 . . . . 0.0 110.384 175.422 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 59.6 m-85 -78.73 -44.97 22.24 Favored 'General case' 0 N--CA 1.449 -0.475 0 CA-C-N 116.47 -0.332 . . . . 0.0 111.862 -175.137 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -67.52 -35.04 78.34 Favored 'General case' 0 N--CA 1.466 0.342 0 C-N-CA 125.139 1.376 . . . . 0.0 113.24 -176.545 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.452 -0.373 0 C-N-CA 123.039 0.536 . . . . 0.0 111.455 -178.956 . . . . . . . . 0 0 . 1 . 003 nuclear build core ' A' A ' 20' ' ' PRO . . . . . . . . . . . . . 26.4 Cg_endo . . . . . 0 N--CA 1.456 -0.723 0 N-CA-C 112.66 0.215 . . . . 0.0 112.66 . . . . . . . . . 0 0 . 1 . 003 nuclear build core ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 38.8 m-80 -87.56 -7.18 57.87 Favored 'General case' 0 N--CA 1.453 -0.316 0 C-N-CA 124.831 1.253 . . . . 0.0 112.962 -175.521 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 9.9 tt0 -144.89 125.1 13.71 Favored 'General case' 0 CA--C 1.539 0.523 0 CA-C-N 119.294 0.952 . . . . 0.0 113.256 -171.942 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 52.1 mt -96.07 142.98 27.62 Favored 'General case' 0 C--N 1.343 0.284 0 C-N-CA 124.8 1.24 . . . . 0.0 111.423 179.349 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 93.2 p -92.35 174.61 7.2 Favored 'General case' 0 CA--C 1.538 0.512 0 C-N-CA 124.091 0.956 . . . . 0.0 108.974 167.029 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 97.6 mttt -54.6 -49.4 70.51 Favored 'General case' 0 C--N 1.339 0.135 0 O-C-N 121.895 -0.503 . . . . 0.0 111.49 -179.173 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 24.2 mt-10 -63.73 -43.51 96.31 Favored 'General case' 0 CA--C 1.519 -0.215 0 CA-C-O 121.234 0.54 . . . . 0.0 110.414 -175.105 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 57.6 mt-10 -58.22 -47.55 83.14 Favored 'General case' 0 N--CA 1.45 -0.426 0 CA-C-N 115.929 -0.578 . . . . 0.0 109.709 176.149 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 11.4 mt -56.8 -41.3 77.51 Favored 'General case' 0 CA--C 1.511 -0.545 0 N-CA-C 112.932 0.716 . . . . 0.0 112.932 171.683 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 84.8 tttt -61.5 -49.74 75.53 Favored 'General case' 0 C--N 1.324 -0.515 0 CA-C-N 118.747 0.703 . . . . 0.0 109.604 -178.37 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 10.4 mp -60.15 -46.89 88.13 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.394 -0.366 . . . . 0.0 111.101 177.847 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 7.5 tt -51.9 -57.27 9.89 Favored 'General case' 0 C--N 1.333 -0.12 0 C-N-CA 123.652 0.781 . . . . 0.0 109.682 175.366 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 43.2 mt -55.44 -53.61 54.15 Favored 'General case' 0 N--CA 1.454 -0.252 0 C-N-CA 123.994 0.918 . . . . 0.0 109.246 -178.522 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 22.7 tt0 -55.21 -46.48 75.91 Favored 'General case' 0 N--CA 1.451 -0.386 0 C-N-CA 123.665 0.786 . . . . 0.0 111.629 -177.508 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 5.3 m -73.96 -53.11 10.8 Favored 'General case' 0 CA--C 1.532 0.258 0 C-N-CA 120.916 -0.314 . . . . 0.0 111.03 -176.307 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 79.4 mm-40 -91.82 -39.05 11.98 Favored 'General case' 0 N--CA 1.45 -0.442 0 C-N-CA 123.762 0.825 . . . . 0.0 112.751 -166.953 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 17.7 m-85 . . . . . 0 CA--C 1.539 0.541 0 N-CA-C 113.22 0.822 . . . . 0.0 113.22 -169.132 . . . . . . . . 0 0 . 1 . 003 nuclear build core ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 52.6 tp . . . . . 0 N--CA 1.457 -0.115 0 N-CA-C 109.375 -0.602 . . . . 0.0 109.375 . . . . . . . . . 0 0 . 1 . 003 nuclear build core ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 5.0 m-20 -55.78 -52.56 63.54 Favored 'General case' 0 N--CA 1.449 -0.495 0 C-N-CA 124.575 1.15 . . . . 0.0 110.602 177.805 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 4.0 tm-20 -53.49 -52.27 60.1 Favored 'General case' 0 C--N 1.331 -0.218 0 C-N-CA 122.512 0.325 . . . . 0.0 110.784 176.22 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 95.6 mt -55.18 -49.53 71.63 Favored 'General case' 0 CA--C 1.529 0.169 0 CA-C-O 121.282 0.563 . . . . 0.0 110.305 178.671 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 50' ' ' PHE . . . . . . . . . . . . . 62.4 t80 -55.49 -50.67 69.3 Favored 'General case' 0 N--CA 1.45 -0.426 0 C-N-CA 123.827 0.851 . . . . 0.0 110.828 -179.115 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 36.0 mt-10 -59.3 -45.93 89.94 Favored 'General case' 0 N--CA 1.454 -0.234 0 C-N-CA 123.289 0.636 . . . . 0.0 110.547 177.994 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 12.5 tm-20 -56.25 -46.16 79.73 Favored 'General case' 0 N--CA 1.456 -0.172 0 C-N-CA 123.358 0.663 . . . . 0.0 110.072 178.708 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 91.6 mt -72.6 -43.34 63.44 Favored 'General case' 0 N--CA 1.45 -0.435 0 C-N-CA 123.021 0.528 . . . . 0.0 112.04 -176.58 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 47.4 t0 . . . . . 0 CA--C 1.537 0.459 0 C-N-CA 124.206 1.002 . . . . 0.0 112.206 -172.616 . . . . . . . . 0 0 . 1 . 003 nuclear build core ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 30.3 mt-10 . . . . . 0 CA--C 1.528 0.129 0 N-CA-C 105.924 -1.88 . . . . 0.0 105.924 . . . . . . . . . 0 0 . 1 . 003 nuclear build core ' A' A ' 61' ' ' VAL . . . . . . . . . . . . . 3.5 t -123.57 115.36 45.07 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.183 0 N-CA-C 109.373 -0.603 . . . . 0.0 109.373 179.582 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 62.4 p -77.95 156.96 29.92 Favored 'General case' 0 CA--C 1.532 0.267 0 C-N-CA 123.515 0.726 . . . . 0.0 110.395 177.794 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 63' ' ' PHE . . . . . . . . . . . . . 71.4 t80 -55.11 -34.97 64.15 Favored 'General case' 0 N--CA 1.463 0.207 0 N-CA-C 112.318 0.488 . . . . 0.0 112.318 178.042 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 45.8 mt-10 -58.1 -67.56 0.33 Allowed 'General case' 0 N--CA 1.452 -0.339 0 N-CA-C 109.903 -0.406 . . . . 0.0 109.903 176.78 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 9.8 pt-20 -65.24 -28.55 69.44 Favored 'General case' 0 CA--C 1.534 0.348 0 O-C-N 121.842 -0.536 . . . . 0.0 111.669 -175.015 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 8.2 t80 -49.15 -29.88 5.98 Favored 'General case' 0 CA--C 1.532 0.276 0 C-N-CA 123.391 0.677 . . . . 0.0 112.283 169.102 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 67' ' ' GLN . . . . . . . . . . . . . 97.8 mm-40 -56.86 -19.93 20.25 Favored 'General case' 0 CA--C 1.54 0.571 0 CA-C-N 119.661 1.119 . . . . 0.0 112.933 175.993 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 69.8 t -56.97 -34.29 44.23 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.552 0 CA-C-N 119.61 1.095 . . . . 0.0 110.878 169.472 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 9.4 tt -70.9 -44.36 66.42 Favored 'General case' 0 N--CA 1.456 -0.147 0 N-CA-C 107.179 -1.415 . . . . 0.0 107.179 -179.675 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 70' ' ' VAL . . . . . 0.475 HG22 HD13 ' A' ' 6' ' ' LEU . 22.2 t . . . . . 0 N--CA 1.452 -0.371 0 N-CA-C 109.913 -0.403 . . . . 0.0 109.913 176.879 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 99.2 Cg_exo . . . . . 0 N--CA 1.458 -0.58 0 CA-C-O 120.602 0.167 . . . . 0.0 112.463 . . . . . . . . . 0 0 . 1 . 004 nuclear build core ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 2.9 mp0 -58.59 -50.33 74.2 Favored 'General case' 0 N--CA 1.454 -0.246 0 C-N-CA 123.762 0.825 . . . . 0.0 111.971 176.473 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 31.9 mt-10 -60.35 -45.57 93.02 Favored 'General case' 0 C--N 1.332 -0.183 0 N-CA-C 109.101 -0.703 . . . . 0.0 109.101 178.254 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 20.2 mt -59.45 -38.03 79.67 Favored 'General case' 0 N--CA 1.446 -0.651 0 C-N-CA 122.841 0.457 . . . . 0.0 111.998 178.116 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 78.3 tttt -64.55 -44.48 90.62 Favored 'General case' 0 N--CA 1.449 -0.504 0 CA-C-N 118.292 0.496 . . . . 0.0 110.664 172.769 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . -54.55 -51.71 50.18 Favored Glycine 0 CA--C 1.529 0.966 0 N-CA-C 109.893 -1.283 . . . . 0.0 109.893 177.709 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 9' ' ' ILE . . . . . . . . . . . . . 63.1 mt -53.84 -56.79 7.46 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.23 0 C-N-CA 125.935 1.694 . . . . 0.0 110.055 173.245 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 10' ' ' PHE . . . . . . . . . . . . . 51.9 t80 -45.97 -53.43 10.01 Favored 'General case' 0 N--CA 1.451 -0.414 0 C-N-CA 123.169 0.588 . . . . 0.0 109.843 179.019 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 44.3 mt-10 -62.8 -51.92 65.21 Favored 'General case' 0 CA--C 1.532 0.265 0 C-N-CA 122.756 0.423 . . . . 0.0 110.731 -178.591 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 26.4 ttpt -45.8 -53.72 9.16 Favored 'General case' 0 C--N 1.338 0.102 0 C-N-CA 125.15 1.38 . . . . 0.0 111.077 178.186 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 57.0 m-85 -77.28 -44.36 30.03 Favored 'General case' 0 N--CA 1.45 -0.44 0 N-CA-C 110.107 -0.331 . . . . 0.0 110.107 -175.456 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -52.99 -45.92 68.07 Favored 'General case' 0 C--O 1.225 -0.204 0 C-N-CA 123.652 0.781 . . . . 0.0 111.897 178.956 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.331 -0.21 0 N-CA-C 113.007 0.743 . . . . 0.0 113.007 178.075 . . . . . . . . 0 0 . 1 . 004 nuclear build core ' A' A ' 20' ' ' PRO . . . . . . . . . . . . . 19.2 Cg_endo . . . . . 0 CA--C 1.535 0.567 0 N-CA-C 113.988 0.726 . . . . 0.0 113.988 . . . . . . . . . 0 0 . 1 . 004 nuclear build core ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 44.8 m-80 -85.0 -7.59 59.08 Favored 'General case' 0 N--CA 1.453 -0.289 0 C-N-CA 123.779 0.832 . . . . 0.0 112.877 -178.523 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 11.4 tt0 -156.87 117.63 3.64 Favored 'General case' 0 CA--C 1.538 0.482 0 CA-C-N 119.648 1.113 . . . . 0.0 112.903 -169.017 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 19.2 mt -79.66 136.31 36.77 Favored 'General case' 0 C--O 1.234 0.278 0 C-N-CA 124.566 1.146 . . . . 0.0 110.918 179.43 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 12.4 p -97.42 -179.62 4.55 Favored 'General case' 0 CA--C 1.54 0.583 0 N-CA-C 107.322 -1.362 . . . . 0.0 107.322 164.796 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 62.4 mttp -55.14 -47.11 75.55 Favored 'General case' 0 C--O 1.226 -0.135 0 O-C-N 121.941 -0.475 . . . . 0.0 112.157 -173.097 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 34.4 tt0 -64.09 -46.3 84.88 Favored 'General case' 0 N--CA 1.456 -0.173 0 CA-C-N 118.16 0.436 . . . . 0.0 110.62 -174.54 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 2.6 mp0 -54.7 -49.93 69.52 Favored 'General case' 0 N--CA 1.451 -0.414 0 N-CA-C 109.578 -0.527 . . . . 0.0 109.578 175.214 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 9.6 mt -55.88 -43.74 77.48 Favored 'General case' 0 CA--C 1.51 -0.573 0 N-CA-C 113.266 0.839 . . . . 0.0 113.266 173.473 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 84.8 tttt -62.45 -48.54 79.21 Favored 'General case' 0 C--N 1.323 -0.567 0 CA-C-N 118.512 0.596 . . . . 0.0 109.769 -175.858 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 81.5 mt -62.44 -47.51 83.75 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.875 178.905 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 6.7 tt -49.5 -58.22 5.59 Favored 'General case' 0 CA--C 1.522 -0.12 0 C-N-CA 123.979 0.912 . . . . 0.0 109.264 174.023 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 39.9 mt -56.68 -57.99 10.01 Favored 'General case' 0 N--CA 1.451 -0.4 0 C-N-CA 123.533 0.733 . . . . 0.0 109.281 -177.404 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 7.0 tp-100 -52.2 -49.7 63.38 Favored 'General case' 0 N--CA 1.455 -0.206 0 C-N-CA 123.04 0.536 . . . . 0.0 111.161 -176.343 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 11.4 m -75.74 -49.38 18.37 Favored 'General case' 0 N--CA 1.454 -0.258 0 CA-C-N 116.223 -0.444 . . . . 0.0 111.069 -171.574 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 70.4 mm-40 -89.67 -29.25 18.92 Favored 'General case' 0 N--CA 1.45 -0.458 0 C-N-CA 123.362 0.665 . . . . 0.0 111.771 -169.465 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 94.1 m-85 . . . . . 0 CA--C 1.537 0.443 0 C-N-CA 124.425 1.09 . . . . 0.0 111.63 -174.66 . . . . . . . . 0 0 . 1 . 004 nuclear build core ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 66.6 tp . . . . . 0 C--O 1.224 -0.246 0 N-CA-C 111.714 0.265 . . . . 0.0 111.714 . . . . . . . . . 0 0 . 1 . 004 nuclear build core ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 5.3 m-20 -60.6 -46.11 91.46 Favored 'General case' 0 N--CA 1.451 -0.4 0 C-N-CA 123.339 0.656 . . . . 0.0 111.542 179.803 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 93.0 mt-10 -59.64 -52.12 66.91 Favored 'General case' 0 N--CA 1.455 -0.181 0 N-CA-C 109.557 -0.535 . . . . 0.0 109.557 177.383 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 46.9 tp -58.47 -46.39 86.71 Favored 'General case' 0 N--CA 1.452 -0.364 0 N-CA-C 109.416 -0.587 . . . . 0.0 109.416 -178.147 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 50' ' ' PHE . . . . . . . . . . . . . 71.2 t80 -54.6 -50.11 68.83 Favored 'General case' 0 N--CA 1.449 -0.497 0 C-N-CA 123.934 0.894 . . . . 0.0 110.249 177.281 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 41.2 tt0 -57.35 -49.84 74.88 Favored 'General case' 0 N--CA 1.453 -0.279 0 C-N-CA 122.275 0.23 . . . . 0.0 110.761 177.411 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 39.9 mt-10 -55.18 -44.57 75.36 Favored 'General case' 0 CA--C 1.53 0.196 0 C-N-CA 123.141 0.576 . . . . 0.0 111.458 178.931 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 84.7 mt -71.3 -42.66 68.38 Favored 'General case' 0 N--CA 1.451 -0.388 0 C-N-CA 122.955 0.502 . . . . 0.0 111.582 -178.879 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 21.4 t0 . . . . . 0 CA--C 1.534 0.331 0 C-N-CA 124.289 1.036 . . . . 0.0 110.363 177.553 . . . . . . . . 0 0 . 1 . 004 nuclear build core ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 46.9 mt-10 . . . . . 0 CA--C 1.532 0.254 0 N-CA-C 107.466 -1.309 . . . . 0.0 107.466 . . . . . . . . . 0 0 . 1 . 004 nuclear build core ' A' A ' 61' ' ' VAL . . . . . . . . . . . . . 4.4 t -127.78 111.75 25.6 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.408 0 C-N-CA 123.006 0.522 . . . . 0.0 111.213 -169.679 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 8.6 t -83.3 177.4 8.53 Favored 'General case' 0 CA--C 1.537 0.467 0 CA-C-O 121.249 0.547 . . . . 0.0 111.991 172.572 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 63' ' ' PHE . . . . . . . . . . . . . 40.2 t80 -64.97 -47.59 77.06 Favored 'General case' 0 N--CA 1.461 0.086 0 C-N-CA 123.615 0.766 . . . . 0.0 112.723 -168.693 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 23.1 mp0 -59.87 -56.24 24.19 Favored 'General case' 0 N--CA 1.452 -0.342 0 N-CA-C 108.862 -0.792 . . . . 0.0 108.862 -175.984 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 18.0 pt-20 -62.84 -35.1 78.85 Favored 'General case' 0 CA--C 1.537 0.45 0 N-CA-C 112.102 0.408 . . . . 0.0 112.102 179.429 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 7.4 t80 -50.06 -31.73 13.81 Favored 'General case' 0 CA--C 1.535 0.397 0 O-C-N 121.172 -0.955 . . . . 0.0 112.403 169.542 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 67' ' ' GLN . . . . . . . . . . . . . 14.7 mm-40 -55.66 -20.43 14.07 Favored 'General case' 0 CA--C 1.54 0.593 0 CA-C-N 119.388 0.995 . . . . 0.0 113.372 174.265 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 76.8 t -53.63 -28.8 16.58 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.56 0 CA-C-N 119.654 1.116 . . . . 0.0 110.929 169.942 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 31.1 tp -70.69 -39.13 73.66 Favored 'General case' 0 CA--C 1.532 0.27 0 O-C-N 121.094 -1.004 . . . . 0.0 108.293 176.706 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 70' ' ' VAL . . . . . . . . . . . . . 11.5 t . . . . . 0 N--CA 1.454 -0.256 0 O-C-N 121.786 -0.571 . . . . 0.0 109.699 176.911 . . . . . . . . 0 0 . 1 . 005 nuclear build core ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 98.0 Cg_exo . . . . . 0 N--CA 1.459 -0.501 0 CA-C-O 120.821 0.259 . . . . 0.0 112.619 . . . . . . . . . 0 0 . 1 . 005 nuclear build core ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 45.0 mt-10 -61.79 -45.51 93.58 Favored 'General case' 0 N--CA 1.454 -0.256 0 C-N-CA 123.046 0.539 . . . . 0.0 111.249 178.152 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 31.7 mt-10 -65.28 -44.3 88.43 Favored 'General case' 0 N--CA 1.45 -0.436 0 N-CA-C 109.108 -0.701 . . . . 0.0 109.108 178.378 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 14.6 mt -55.02 -42.87 73.12 Favored 'General case' 0 N--CA 1.453 -0.323 0 C-N-CA 123.684 0.794 . . . . 0.0 111.075 175.843 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 23.3 tptm -61.53 -52.14 65.7 Favored 'General case' 0 C--O 1.226 -0.136 0 CA-C-N 118.483 0.583 . . . . 0.0 111.113 172.954 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . -51.06 -49.3 43.49 Favored Glycine 0 CA--C 1.533 1.18 0 N-CA-C 111.081 -0.808 . . . . 0.0 111.081 179.297 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 9' ' ' ILE . . . . . . . . . . . . . 3.0 mm -58.81 -55.48 22.9 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.257 0 C-N-CA 126.885 2.074 . . . . 0.0 109.037 176.46 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 10' ' ' PHE . . . . . . . . . . . . . 58.7 t80 -46.15 -52.24 12.61 Favored 'General case' 0 N--CA 1.451 -0.398 0 C-N-CA 123.242 0.617 . . . . 0.0 109.938 177.785 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 52.6 mt-10 -62.06 -51.56 67.49 Favored 'General case' 0 CA--C 1.532 0.287 0 C-N-CA 123.213 0.605 . . . . 0.0 110.738 -179.986 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 67.2 tttt -44.65 -51.91 8.7 Favored 'General case' 0 N--CA 1.462 0.15 0 C-N-CA 124.877 1.271 . . . . 0.0 111.128 177.7 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 58.1 m-85 -77.75 -46.24 22.3 Favored 'General case' 0 N--CA 1.454 -0.259 0 O-C-N 122.304 -0.248 . . . . 0.0 110.645 -175.532 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -56.34 -41.48 76.13 Favored 'General case' 0 C--N 1.332 -0.17 0 C-N-CA 123.491 0.716 . . . . 0.0 111.793 -179.655 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.53 0.181 0 C-N-CA 124.518 1.127 . . . . 0.0 112.232 177.8 . . . . . . . . 0 0 . 1 . 005 nuclear build core ' A' A ' 20' ' ' PRO . . . . . . . . . . . . . 41.4 Cg_endo . . . . . 0 N--CA 1.458 -0.598 0 N-CA-C 113.201 0.424 . . . . 0.0 113.201 . . . . . . . . . 0 0 . 1 . 005 nuclear build core ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 51.0 m-80 -81.51 -4.12 55.04 Favored 'General case' 0 C--O 1.234 0.272 0 N-CA-C 113.58 0.955 . . . . 0.0 113.58 -169.21 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 43.5 tt0 -155.52 130.87 9.59 Favored 'General case' 0 CA--C 1.533 0.322 0 CA-C-N 119.333 0.969 . . . . 0.0 112.428 -168.311 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 40.2 mt -102.66 123.58 46.63 Favored 'General case' 0 N--CA 1.453 -0.283 0 C-N-CA 124.651 1.18 . . . . 0.0 111.85 179.13 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -84.21 170.84 13.33 Favored 'General case' 0 CA--C 1.537 0.471 0 C-N-CA 123.625 0.77 . . . . 0.0 109.591 165.202 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 98.4 mttt -51.14 -49.94 59.85 Favored 'General case' 0 C--N 1.339 0.123 0 N-CA-C 113.333 0.864 . . . . 0.0 113.333 -168.949 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 38.6 tp10 -63.2 -45.12 93.21 Favored 'General case' 0 N--CA 1.456 -0.152 0 O-C-N 121.983 -0.448 . . . . 0.0 111.045 -173.249 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 1.9 mp0 -53.66 -51.19 63.94 Favored 'General case' 0 N--CA 1.452 -0.358 0 N-CA-C 109.598 -0.519 . . . . 0.0 109.598 173.319 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 9.2 mt -55.73 -41.72 74.29 Favored 'General case' 0 CA--C 1.513 -0.472 0 N-CA-C 113.173 0.805 . . . . 0.0 113.173 173.748 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 60.0 tttm -61.82 -51.96 66.13 Favored 'General case' 0 C--N 1.325 -0.494 0 CA-C-N 118.67 0.668 . . . . 0.0 109.82 -177.249 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 10.5 mp -63.2 -44.09 96.32 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.146 -0.479 . . . . 0.0 110.606 -179.936 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 7.4 tt -50.32 -58.25 6.07 Favored 'General case' 0 C--N 1.332 -0.167 0 C-N-CA 123.789 0.835 . . . . 0.0 109.543 173.074 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 29.4 mt -54.19 -62.13 1.85 Allowed 'General case' 0 N--CA 1.455 -0.193 0 C-N-CA 123.561 0.744 . . . . 0.0 109.605 -179.103 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 25.5 tt0 -55.73 -45.08 78.05 Favored 'General case' 0 N--CA 1.452 -0.331 0 C-N-CA 123.575 0.75 . . . . 0.0 111.534 -173.096 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 19.8 m -78.44 -48.0 16.33 Favored 'General case' 0 C--N 1.33 -0.28 0 C-N-CA 122.367 0.267 . . . . 0.0 111.313 -173.376 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 66.7 mm-40 -96.42 -31.02 13.05 Favored 'General case' 0 N--CA 1.45 -0.463 0 N-CA-C 112.766 0.654 . . . . 0.0 112.766 -167.748 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 69.7 m-85 . . . . . 0 CA--C 1.53 0.197 0 C-N-CA 123.522 0.729 . . . . 0.0 110.462 -176.205 . . . . . . . . 0 0 . 1 . 005 nuclear build core ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 58.8 tp . . . . . 0 C--O 1.226 -0.153 0 CA-C-O 120.787 0.327 . . . . 0.0 110.775 . . . . . . . . . 0 0 . 1 . 005 nuclear build core ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 5.7 m-20 -61.03 -54.5 44.06 Favored 'General case' 0 N--CA 1.45 -0.431 0 C-N-CA 123.395 0.678 . . . . 0.0 110.788 -179.215 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 59.1 mm-40 -58.29 -43.67 88.17 Favored 'General case' 0 N--CA 1.455 -0.217 0 C-N-CA 120.681 -0.407 . . . . 0.0 110.535 178.676 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 46.5 tp -61.17 -47.47 86.02 Favored 'General case' 0 N--CA 1.452 -0.335 0 N-CA-C 109.746 -0.465 . . . . 0.0 109.746 179.816 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 50' ' ' PHE . . . . . . . . . . . . . 70.4 t80 -51.96 -49.61 62.87 Favored 'General case' 0 C--N 1.331 -0.209 0 C-N-CA 124.022 0.929 . . . . 0.0 110.367 176.595 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 36.0 mt-10 -62.46 -44.11 97.2 Favored 'General case' 0 CA--C 1.532 0.266 0 C-N-CA 122.45 0.3 . . . . 0.0 111.687 177.464 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 34.4 mt-10 -57.36 -40.75 78.75 Favored 'General case' 0 C--N 1.332 -0.183 0 C-N-CA 122.921 0.488 . . . . 0.0 110.962 176.097 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 94.6 mt -66.33 -67.32 0.46 Allowed 'General case' 0 N--CA 1.449 -0.499 0 C-N-CA 123.054 0.542 . . . . 0.0 109.971 176.732 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 39.8 t0 . . . . . 0 N--CA 1.454 -0.267 0 N-CA-C 108.192 -1.04 . . . . 0.0 108.192 177.368 . . . . . . . . 0 0 . 1 . 005 nuclear build core ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 11.3 mp0 . . . . . 0 N--CA 1.454 -0.266 0 N-CA-C 108.375 -0.972 . . . . 0.0 108.375 . . . . . . . . . 0 0 . 1 . 005 nuclear build core ' A' A ' 61' ' ' VAL . . . . . . . . . . . . . 15.2 t -79.18 110.54 15.01 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.375 0 C-N-CA 123.399 0.68 . . . . 0.0 111.397 -166.42 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 8.7 t -79.36 172.91 13.14 Favored 'General case' 0 CA--C 1.537 0.465 0 CA-C-O 120.815 0.34 . . . . 0.0 111.316 169.668 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 63' ' ' PHE . . . . . . . . . . . . . 55.1 t80 -63.45 -36.83 85.04 Favored 'General case' 0 N--CA 1.464 0.265 0 N-CA-C 113.3 0.852 . . . . 0.0 113.3 -168.679 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 21.1 mp0 -67.55 -58.4 4.77 Favored 'General case' 0 N--CA 1.453 -0.321 0 N-CA-C 108.864 -0.791 . . . . 0.0 108.864 -177.857 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 17.8 pt-20 -59.58 -35.04 73.49 Favored 'General case' 0 CA--C 1.539 0.549 0 O-C-N 121.775 -0.578 . . . . 0.0 111.796 177.351 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 19.2 t80 -51.39 -28.6 13.13 Favored 'General case' 0 CA--C 1.534 0.344 0 O-C-N 121.288 -0.882 . . . . 0.0 112.489 169.89 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 67' ' ' GLN . . . . . . . . . . . . . 74.8 mm-40 -54.38 -23.73 16.85 Favored 'General case' 0 CA--C 1.538 0.497 0 CA-C-N 120.119 1.327 . . . . 0.0 113.063 174.04 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 86.5 t -55.64 -27.93 22.4 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.704 0 CA-C-N 119.44 1.018 . . . . 0.0 111.042 172.079 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 8.4 tt -71.44 -41.03 69.96 Favored 'General case' 0 CA--C 1.529 0.164 0 O-C-N 120.892 -1.13 . . . . 0.0 108.256 176.597 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 70' ' ' VAL . . . . . . . . . . . . . 15.7 t . . . . . 0 CA--C 1.538 0.498 0 O-C-N 121.705 -0.622 . . . . 0.0 109.812 176.642 . . . . . . . . 0 0 . 1 . 006 nuclear build core ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 88.8 Cg_exo . . . . . 0 N--CA 1.458 -0.592 0 CA-C-O 120.647 0.186 . . . . 0.0 112.465 . . . . . . . . . 0 0 . 1 . 006 nuclear build core ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 45.7 mt-10 -59.25 -48.14 82.72 Favored 'General case' 0 C--O 1.232 0.159 0 C-N-CA 123.504 0.722 . . . . 0.0 111.083 177.687 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 31.6 mt-10 -61.42 -46.22 91.04 Favored 'General case' 0 C--O 1.221 -0.41 0 N-CA-C 108.957 -0.757 . . . . 0.0 108.957 177.263 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 14.8 mt -59.25 -40.38 85.8 Favored 'General case' 0 N--CA 1.451 -0.417 0 C-N-CA 123.596 0.759 . . . . 0.0 111.477 -178.334 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -60.18 -53.93 51.89 Favored 'General case' 0 CA--C 1.53 0.206 0 C-N-CA 123.332 0.653 . . . . 0.0 110.73 170.987 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . -51.84 -49.03 49.57 Favored Glycine 0 CA--C 1.533 1.192 0 N-CA-C 111.295 -0.722 . . . . 0.0 111.295 179.205 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 9' ' ' ILE . . . . . . . . . . . . . 3.4 mm -59.41 -52.07 65.21 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.265 0 C-N-CA 127.416 2.286 . . . . 0.0 109.254 177.339 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 10' ' ' PHE . . . . . . . . . . . . . 51.9 t80 -48.13 -53.21 17.42 Favored 'General case' 0 N--CA 1.45 -0.463 0 N-CA-C 109.306 -0.627 . . . . 0.0 109.306 177.234 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 44.5 mt-10 -60.48 -52.97 62.94 Favored 'General case' 0 CA--C 1.53 0.173 0 C-N-CA 122.438 0.295 . . . . 0.0 110.682 179.411 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 39.4 tttm -43.06 -54.82 4.13 Favored 'General case' 0 N--CA 1.455 -0.177 0 C-N-CA 125.025 1.33 . . . . 0.0 110.668 179.832 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 70.0 m-85 -78.47 -44.1 25.43 Favored 'General case' 0 N--CA 1.454 -0.238 0 CA-C-O 119.533 -0.27 . . . . 0.0 111.386 -176.254 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -52.19 -37.96 56.41 Favored 'General case' 0 N--CA 1.463 0.208 0 C-N-CA 123.351 0.66 . . . . 0.0 112.086 179.118 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.402 0 N-CA-C 113.597 0.962 . . . . 0.0 113.597 179.589 . . . . . . . . 0 0 . 1 . 006 nuclear build core ' A' A ' 20' ' ' PRO . . . . . . . . . . . . . 17.8 Cg_endo . . . . . 0 CA--C 1.54 0.804 0 CA-C-O 120.451 0.104 . . . . 0.0 112.351 . . . . . . . . . 0 0 . 1 . 006 nuclear build core ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 31.9 m-80 -86.22 -7.62 58.4 Favored 'General case' 0 CA--C 1.533 0.314 0 C-N-CA 124.615 1.166 . . . . 0.0 112.97 -179.1 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 25.3 tt0 -155.57 115.53 3.71 Favored 'General case' 0 CA--C 1.538 0.506 0 CA-C-N 119.443 1.02 . . . . 0.0 111.81 -168.907 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 32.3 mt -80.49 128.32 33.45 Favored 'General case' 0 C--O 1.234 0.283 0 C-N-CA 123.513 0.725 . . . . 0.0 112.015 -171.421 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -86.12 175.25 8.63 Favored 'General case' 0 CA--C 1.541 0.629 0 N-CA-C 108.108 -1.071 . . . . 0.0 108.108 166.13 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 98.6 mttt -56.15 -44.83 79.63 Favored 'General case' 0 N--CA 1.456 -0.165 0 C-N-CA 123.394 0.678 . . . . 0.0 112.187 -172.209 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 24.8 mt-10 -65.46 -46.84 78.23 Favored 'General case' 0 CA--C 1.521 -0.136 0 CA-C-O 121.116 0.484 . . . . 0.0 110.551 -173.56 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 2.0 mp0 -53.36 -51.32 62.85 Favored 'General case' 0 N--CA 1.451 -0.424 0 CA-C-N 115.734 -0.666 . . . . 0.0 109.257 174.089 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 8.6 mt -55.42 -42.17 73.77 Favored 'General case' 0 CA--C 1.511 -0.551 0 N-CA-C 113.646 0.98 . . . . 0.0 113.646 173.486 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 84.1 tttt -60.63 -56.67 18.54 Favored 'General case' 0 C--N 1.324 -0.533 0 N-CA-C 108.835 -0.802 . . . . 0.0 108.835 -178.291 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 4.2 mm? -58.37 -43.65 88.54 Favored 'General case' 0 C--N 1.328 -0.341 0 C-N-CA 120.887 -0.325 . . . . 0.0 110.92 -178.348 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 9.3 tt -51.99 -57.85 8.25 Favored 'General case' 0 CA--C 1.53 0.179 0 C-N-CA 123.533 0.733 . . . . 0.0 109.906 173.769 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 38.9 mt -54.46 -58.41 7.58 Favored 'General case' 0 C--N 1.332 -0.159 0 C-N-CA 123.739 0.816 . . . . 0.0 110.309 -178.596 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 23.8 mm100 -52.32 -55.01 24.32 Favored 'General case' 0 N--CA 1.453 -0.277 0 C-N-CA 124.603 1.161 . . . . 0.0 110.846 -176.96 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 11.9 m -74.42 -43.43 56.31 Favored 'General case' 0 N--CA 1.449 -0.479 0 CA-C-N 115.602 -0.727 . . . . 0.0 111.202 -169.558 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 71.8 mm-40 -100.1 -29.36 12.55 Favored 'General case' 0 N--CA 1.448 -0.572 0 N-CA-C 113.583 0.956 . . . . 0.0 113.583 -167.734 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 50.9 m-85 . . . . . 0 C--O 1.234 0.276 0 N-CA-C 113.157 0.799 . . . . 0.0 113.157 -171.23 . . . . . . . . 0 0 . 1 . 006 nuclear build core ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 22.7 mt . . . . . 0 C--O 1.221 -0.438 0 N-CA-C 107.913 -1.143 . . . . 0.0 107.913 . . . . . . . . . 0 0 . 1 . 006 nuclear build core ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 5.4 m-20 -53.28 -53.64 47.92 Favored 'General case' 0 N--CA 1.449 -0.521 0 C-N-CA 124.633 1.173 . . . . 0.0 111.66 176.901 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 19.9 tp10 -56.89 -52.06 66.65 Favored 'General case' 0 N--CA 1.456 -0.146 0 N-CA-C 110.403 -0.221 . . . . 0.0 110.403 177.513 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 3.9 mm? -56.08 -45.43 79.35 Favored 'General case' 0 C--O 1.225 -0.213 0 CA-C-O 120.969 0.414 . . . . 0.0 110.264 179.781 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 50' ' ' PHE . . . . . . . . . . . . . 64.9 t80 -58.86 -50.89 72.3 Favored 'General case' 0 N--CA 1.448 -0.533 0 C-N-CA 124.117 0.967 . . . . 0.0 110.084 -178.287 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 24.9 tp10 -59.46 -46.42 88.83 Favored 'General case' 0 N--CA 1.453 -0.306 0 N-CA-C 109.996 -0.372 . . . . 0.0 109.996 178.555 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 13.6 tm-20 -57.44 -44.24 84.54 Favored 'General case' 0 CA--C 1.531 0.231 0 C-N-CA 123.609 0.764 . . . . 0.0 110.493 -179.824 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 84.6 mt -72.09 -45.23 61.47 Favored 'General case' 0 N--CA 1.45 -0.429 0 C-N-CA 123.5 0.72 . . . . 0.0 111.568 -178.363 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 47.1 t0 . . . . . 0 CA--C 1.533 0.319 0 C-N-CA 123.699 0.8 . . . . 0.0 110.697 -177.786 . . . . . . . . 0 0 . 1 . 006 nuclear build core ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 59.5 mt-10 . . . . . 0 CA--C 1.532 0.272 0 N-CA-C 106.431 -1.692 . . . . 0.0 106.431 . . . . . . . . . 0 0 . 1 . 006 nuclear build core ' A' A ' 61' ' ' VAL . . . . . . . . . . . . . 8.9 t -108.93 109.54 28.71 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.446 0 CA-C-N 118.554 0.616 . . . . 0.0 110.78 -175.911 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 3.8 m -78.76 154.03 30.31 Favored 'General case' 0 CA--C 1.537 0.45 0 C-N-CA 123.296 0.638 . . . . 0.0 111.107 173.418 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 63' ' ' PHE . . . . . . . . . . . . . 69.7 t80 -51.13 -42.37 60.7 Favored 'General case' 0 CA--C 1.534 0.358 0 C-N-CA 123.524 0.73 . . . . 0.0 112.711 -173.334 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 12.6 pt-20 -59.18 -37.09 76.52 Favored 'General case' 0 CA--C 1.534 0.349 0 N-CA-C 112.746 0.647 . . . . 0.0 112.746 -178.565 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 18.7 pt-20 -91.23 -30.52 16.59 Favored 'General case' 0 CA--C 1.531 0.239 0 C-N-CA 123.091 0.557 . . . . 0.0 110.062 -179.087 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 7.9 t80 -49.97 -27.28 5.17 Favored 'General case' 0 CA--C 1.536 0.421 0 C-N-CA 123.86 0.864 . . . . 0.0 111.071 167.815 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 67' ' ' GLN . . . . . . . . . . . . . 68.9 mm-40 -49.55 -27.61 4.63 Favored 'General case' 0 CA--C 1.537 0.47 0 CA-C-N 119.259 0.936 . . . . 0.0 113.448 171.586 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 69.2 t -53.17 -32.25 18.81 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.58 0 O-C-N 121.368 -0.833 . . . . 0.0 111.368 172.613 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 8.5 tt -71.54 -42.69 67.59 Favored 'General case' 0 N--CA 1.455 -0.192 0 N-CA-C 107.946 -1.131 . . . . 0.0 107.946 178.806 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 70' ' ' VAL . . . . . . . . . . . . . 19.0 t . . . . . 0 N--CA 1.453 -0.286 0 N-CA-C 109.721 -0.474 . . . . 0.0 109.721 177.272 . . . . . . . . 0 0 . 1 . 007 nuclear build core ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 97.1 Cg_exo . . . . . 0 N--CA 1.458 -0.598 0 N-CA-C 112.821 0.277 . . . . 0.0 112.821 . . . . . . . . . 0 0 . 1 . 007 nuclear build core ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 3.0 mp0 -59.06 -49.84 76.34 Favored 'General case' 0 N--CA 1.456 -0.125 0 C-N-CA 123.54 0.736 . . . . 0.0 111.757 176.751 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 46.6 mm-40 -62.63 -43.15 99.53 Favored 'General case' 0 C--N 1.331 -0.204 0 N-CA-C 109.201 -0.666 . . . . 0.0 109.201 179.165 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 12.8 mt -60.34 -36.66 78.49 Favored 'General case' 0 N--CA 1.446 -0.664 0 CA-C-O 119.266 -0.397 . . . . 0.0 111.916 175.67 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 79.3 tttt -64.64 -45.07 88.38 Favored 'General case' 0 N--CA 1.448 -0.55 0 CA-C-N 118.813 0.733 . . . . 0.0 110.526 172.294 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . -52.8 -52.36 39.26 Favored Glycine 0 CA--C 1.53 1.028 0 N-CA-C 110.169 -1.172 . . . . 0.0 110.169 177.253 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 9' ' ' ILE . . . . . . . . . . . . . 15.1 mm -54.19 -58.25 4.12 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.198 0 C-N-CA 125.631 1.572 . . . . 0.0 109.391 173.848 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 10' ' ' PHE . . . . . . . . . . . . . 28.5 t80 -46.05 -51.11 14.3 Favored 'General case' 0 N--CA 1.448 -0.566 0 C-N-CA 123.173 0.589 . . . . 0.0 109.995 179.854 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 48.0 mt-10 -63.4 -49.94 71.81 Favored 'General case' 0 CA--C 1.53 0.195 0 C-N-CA 123.657 0.783 . . . . 0.0 111.037 -179.385 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 41.1 tttp -42.57 -51.16 5.24 Favored 'General case' 0 C--N 1.341 0.212 0 C-N-CA 124.635 1.174 . . . . 0.0 110.649 176.693 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 81.2 m-85 -78.79 -51.27 9.99 Favored 'General case' 0 N--CA 1.452 -0.348 0 CA-C-N 116.521 -0.309 . . . . 0.0 110.504 -178.78 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -56.93 -25.56 57.76 Favored 'General case' 0 N--CA 1.465 0.287 0 C-N-CA 126.347 1.859 . . . . 0.0 114.436 -174.46 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.453 -0.318 0 CA-C-O 118.276 -0.868 . . . . 0.0 113.278 177.3 . . . . . . . . 0 0 . 1 . 007 nuclear build core ' A' A ' 20' ' ' PRO . . . . . . . . . . . . . 10.4 Cg_endo . . . . . 0 CA--C 1.542 0.902 0 N-CA-C 114.546 0.941 . . . . 0.0 114.546 . . . . . . . . . 0 0 . 1 . 007 nuclear build core ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 38.9 m-80 -98.88 -1.96 38.85 Favored 'General case' 0 CA--C 1.538 0.486 0 C-N-CA 125.395 1.478 . . . . 0.0 112.827 -178.955 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 4.4 tp60 -145.22 116.84 8.1 Favored 'General case' 0 CA--C 1.55 0.964 0 C-N-CA 124.684 1.194 . . . . 0.0 112.42 -168.152 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 44.3 mt -91.71 128.83 37.7 Favored 'General case' 0 C--N 1.344 0.331 0 C-N-CA 124.592 1.157 . . . . 0.0 112.578 -175.354 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 98.3 p -79.4 167.71 20.48 Favored 'General case' 0 CA--C 1.537 0.462 0 C-N-CA 123.779 0.832 . . . . 0.0 109.316 167.665 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 97.4 mttt -54.79 -47.7 73.66 Favored 'General case' 0 C--N 1.339 0.141 0 O-C-N 121.866 -0.521 . . . . 0.0 111.342 -179.421 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 42.2 tt0 -61.41 -44.06 97.79 Favored 'General case' 0 N--CA 1.454 -0.234 0 CA-C-O 120.695 0.283 . . . . 0.0 110.729 -178.138 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 69.5 mt-10 -59.58 -48.8 80.25 Favored 'General case' 0 N--CA 1.448 -0.525 0 N-CA-C 109.717 -0.475 . . . . 0.0 109.717 177.329 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 7.5 mt -54.16 -42.53 69.71 Favored 'General case' 0 CA--C 1.511 -0.549 0 N-CA-C 113.084 0.772 . . . . 0.0 113.084 170.868 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 82.5 tttt -62.46 -50.1 72.81 Favored 'General case' 0 N--CA 1.448 -0.565 0 CA-C-N 118.68 0.673 . . . . 0.0 109.593 -177.304 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 79.1 mt -59.95 -45.43 92.66 Favored 'General case' 0 C--O 1.235 0.341 0 C-N-CA 122.725 0.41 . . . . 0.0 111.506 178.272 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 7.9 tt -53.63 -56.74 14.57 Favored 'General case' 0 N--CA 1.455 -0.188 0 C-N-CA 123.77 0.828 . . . . 0.0 109.169 174.851 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 50.2 mt -55.72 -51.08 68.56 Favored 'General case' 0 N--CA 1.454 -0.267 0 C-N-CA 123.813 0.845 . . . . 0.0 109.751 -178.569 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 35.5 mt-30 -49.51 -54.6 17.01 Favored 'General case' 0 N--CA 1.458 -0.032 0 C-N-CA 123.165 0.586 . . . . 0.0 111.236 176.982 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 6.0 m -70.71 -48.66 53.47 Favored 'General case' 0 N--CA 1.454 -0.267 0 CA-C-N 116.059 -0.519 . . . . 0.0 111.095 -170.93 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 19.6 mm-40 -97.57 -37.34 9.98 Favored 'General case' 0 N--CA 1.45 -0.445 0 C-N-CA 123.759 0.824 . . . . 0.0 113.131 -167.339 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 27.0 m-85 . . . . . 0 CA--C 1.536 0.411 0 C-N-CA 122.93 0.492 . . . . 0.0 112.155 -168.744 . . . . . . . . 0 0 . 1 . 007 nuclear build core ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 65.1 tp . . . . . 0 C--O 1.223 -0.297 0 N-CA-C 111.982 0.364 . . . . 0.0 111.982 . . . . . . . . . 0 0 . 1 . 007 nuclear build core ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 6.7 m-20 -58.09 -51.2 70.69 Favored 'General case' 0 N--CA 1.452 -0.369 0 C-N-CA 123.306 0.643 . . . . 0.0 111.392 179.276 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 3.2 mp0 -60.44 -46.93 88.28 Favored 'General case' 0 N--CA 1.457 -0.116 0 N-CA-C 109.983 -0.377 . . . . 0.0 109.983 177.955 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 94.5 mt -56.73 -46.19 81.49 Favored 'General case' 0 C--O 1.225 -0.236 0 N-CA-C 109.946 -0.39 . . . . 0.0 109.946 178.66 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 50' ' ' PHE . . . . . . . . . . . . . 68.7 t80 -57.23 -51.88 67.58 Favored 'General case' 0 N--CA 1.45 -0.446 0 C-N-CA 124.034 0.934 . . . . 0.0 110.457 179.561 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 53.5 mm-40 -57.39 -48.2 79.7 Favored 'General case' 0 CA--C 1.532 0.275 0 CA-C-O 120.594 0.235 . . . . 0.0 110.98 176.559 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 47.5 tp10 -55.3 -44.4 75.7 Favored 'General case' 0 CA--C 1.53 0.204 0 C-N-CA 123.759 0.824 . . . . 0.0 110.865 179.43 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 85.2 mt -69.32 -46.64 66.59 Favored 'General case' 0 N--CA 1.449 -0.5 0 C-N-CA 123.213 0.605 . . . . 0.0 110.923 179.902 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 55.2 t0 . . . . . 0 CA--C 1.535 0.402 0 C-N-CA 123.548 0.739 . . . . 0.0 110.57 179.309 . . . . . . . . 0 0 . 1 . 007 nuclear build core ' A' A ' 60' ' ' GLU . . . . . . . . . . . . 0.343 0.2 OUTLIER . . . . . 0 CA--C 1.537 0.469 0 N-CA-C 110.735 -0.098 . . . . 0.0 110.735 . . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 61' ' ' VAL . . . . . . . . . . . . . 13.6 t -77.23 122.53 32.02 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.42 0 N-CA-C 113.921 1.082 . . . . 0.0 113.921 -164.096 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -77.96 152.09 33.34 Favored 'General case' 0 CA--C 1.536 0.406 0 C-N-CA 123.838 0.855 . . . . 0.0 110.942 174.053 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 63' ' ' PHE . . . . . . . . . . . . . 59.7 t80 -53.81 -31.24 48.38 Favored 'General case' 0 N--CA 1.47 0.566 0 N-CA-C 113.862 1.06 . . . . 0.0 113.862 176.771 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 28.8 mp0 -68.65 -63.52 1.04 Allowed 'General case' 0 N--CA 1.453 -0.318 0 O-C-N 121.581 -0.7 . . . . 0.0 109.112 -179.977 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 18.5 pt-20 -62.27 -28.37 69.67 Favored 'General case' 0 CA--C 1.539 0.522 0 O-C-N 121.274 -0.891 . . . . 0.0 111.828 -179.631 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 12.7 t80 -50.01 -27.54 5.64 Favored 'General case' 0 CA--C 1.534 0.342 0 C-N-CA 123.662 0.785 . . . . 0.0 112.622 169.304 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 67' ' ' GLN . . . . . . . . . . . . . 71.6 mm-40 -55.4 -22.09 18.43 Favored 'General case' 0 CA--C 1.543 0.706 0 CA-C-N 119.812 1.187 . . . . 0.0 112.901 173.925 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 72.5 t -53.23 -29.15 15.65 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.589 0 O-C-N 120.98 -1.075 . . . . 0.0 111.175 169.889 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 18.7 tp -70.91 -42.06 70.42 Favored 'General case' 0 N--CA 1.452 -0.331 0 N-CA-C 107.872 -1.158 . . . . 0.0 107.872 177.438 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 70' ' ' VAL . . . . . . . . . . . . . 24.2 t . . . . . 0 N--CA 1.456 -0.169 0 N-CA-C 109.863 -0.421 . . . . 0.0 109.863 177.077 . . . . . . . . 0 0 . 1 . 008 nuclear build core ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 88.1 Cg_exo . . . . . 0 N--CA 1.456 -0.685 0 CA-C-O 120.24 0.017 . . . . 0.0 112.107 . . . . . . . . . 0 0 . 1 . 008 nuclear build core ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 40.0 tt0 -63.62 -47.03 83.02 Favored 'General case' 0 N--CA 1.456 -0.164 0 C-N-CA 123.327 0.651 . . . . 0.0 111.293 177.129 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 25.9 mt-10 -60.46 -47.53 85.74 Favored 'General case' 0 N--CA 1.454 -0.241 0 N-CA-C 108.48 -0.933 . . . . 0.0 108.48 176.997 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 17.9 mt -57.75 -37.7 74.08 Favored 'General case' 0 N--CA 1.45 -0.462 0 C-N-CA 123.639 0.776 . . . . 0.0 111.947 178.127 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 21.1 tptm -62.4 -51.84 65.96 Favored 'General case' 0 C--N 1.332 -0.188 0 CA-C-N 118.728 0.695 . . . . 0.0 111.089 171.986 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . -53.95 -50.61 54.16 Favored Glycine 0 CA--C 1.531 1.035 0 N-CA-C 110.136 -1.186 . . . . 0.0 110.136 -179.811 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 9' ' ' ILE . . . . . . . . . . . . . 69.3 mt -55.01 -53.63 32.1 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.385 0 C-N-CA 125.772 1.629 . . . . 0.0 110.27 174.053 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 10' ' ' PHE . . . . . . . . . . . . . 41.0 t80 -49.17 -52.76 24.55 Favored 'General case' 0 N--CA 1.45 -0.457 0 N-CA-C 109.208 -0.664 . . . . 0.0 109.208 179.153 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 50.0 mt-10 -58.91 -50.9 72.3 Favored 'General case' 0 N--CA 1.453 -0.292 0 C-N-CA 122.898 0.479 . . . . 0.0 110.289 -179.468 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 41.0 tttm -48.63 -59.76 3.26 Favored 'General case' 0 CA--C 1.532 0.268 0 C-N-CA 123.462 0.705 . . . . 0.0 111.243 176.879 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 57.8 m-85 -76.57 -30.01 56.87 Favored 'General case' 0 C--O 1.224 -0.26 0 O-C-N 121.913 -0.492 . . . . 0.0 110.946 -169.955 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -66.2 -46.52 77.01 Favored 'General case' 0 N--CA 1.453 -0.275 0 O-C-N 121.932 -0.48 . . . . 0.0 110.259 173.878 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.333 -0.128 0 C-N-CA 123.545 0.738 . . . . 0.0 111.572 176.987 . . . . . . . . 0 0 . 1 . 008 nuclear build core ' A' A ' 20' ' ' PRO . . . . . . . . . . . . . 13.3 Cg_endo . . . . . 0 CA--C 1.535 0.525 0 N-CA-C 114.893 1.074 . . . . 0.0 114.893 . . . . . . . . . 0 0 . 1 . 008 nuclear build core ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 46.4 m-80 -90.39 -2.29 57.96 Favored 'General case' 0 N--CA 1.452 -0.358 0 C-N-CA 123.9 0.88 . . . . 0.0 112.583 -177.257 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 43.6 tt0 -155.79 122.67 5.32 Favored 'General case' 0 CA--C 1.539 0.553 0 CA-C-N 119.799 1.181 . . . . 0.0 113.432 -167.677 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 56.8 mt -89.05 133.16 34.46 Favored 'General case' 0 CA--C 1.532 0.281 0 C-N-CA 124.252 1.021 . . . . 0.0 112.055 -178.682 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 45.1 p -78.27 172.46 13.55 Favored 'General case' 0 CA--C 1.535 0.377 0 C-N-CA 123.534 0.734 . . . . 0.0 109.413 167.676 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 98.0 mttt -57.97 -45.91 85.99 Favored 'General case' 0 C--O 1.226 -0.177 0 O-C-N 121.746 -0.596 . . . . 0.0 109.752 174.34 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 26' ' ' GLU . . . . . 0.421 ' H ' ' CD ' ' A' ' 26' ' ' GLU . 2.0 mp0 -62.57 -48.29 80.12 Favored 'General case' 0 CA--C 1.516 -0.345 0 CA-C-O 121.194 0.521 . . . . 0.0 109.948 -177.311 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 34.2 mt-10 -56.29 -47.37 78.79 Favored 'General case' 0 N--CA 1.449 -0.487 0 CA-C-N 115.467 -0.788 . . . . 0.0 109.661 177.104 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 11.0 mt -55.16 -44.83 75.55 Favored 'General case' 0 CA--C 1.512 -0.496 0 N-CA-C 113.051 0.76 . . . . 0.0 113.051 170.003 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 62.5 tttm -61.73 -48.9 78.64 Favored 'General case' 0 C--N 1.324 -0.533 0 CA-C-N 118.732 0.697 . . . . 0.0 110.019 -176.093 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 4.2 mm? -61.53 -46.07 91.52 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.375 -0.375 . . . . 0.0 111.056 178.142 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 6.0 tt -49.87 -59.17 4.1 Favored 'General case' 0 C--N 1.333 -0.127 0 C-N-CA 123.648 0.779 . . . . 0.0 109.332 173.859 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 49.4 mt -55.78 -58.26 8.58 Favored 'General case' 0 N--CA 1.454 -0.265 0 C-N-CA 123.563 0.745 . . . . 0.0 109.817 -177.738 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 30.0 tt0 -50.97 -52.2 45.03 Favored 'General case' 0 N--CA 1.452 -0.349 0 C-N-CA 124.361 1.064 . . . . 0.0 111.438 -177.807 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 16.3 m -74.54 -49.31 22.4 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.235 -0.439 . . . . 0.0 110.861 -171.26 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 70.8 mm-40 -89.5 -31.99 17.4 Favored 'General case' 0 N--CA 1.449 -0.483 0 C-N-CA 122.7 0.4 . . . . 0.0 111.77 -169.4 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 76.4 m-85 . . . . . 0 CA--C 1.535 0.366 0 C-N-CA 124.268 1.027 . . . . 0.0 110.235 -175.541 . . . . . . . . 0 0 . 1 . 008 nuclear build core ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 62.6 tp . . . . . 0 C--O 1.227 -0.084 0 N-CA-C 112.606 0.595 . . . . 0.0 112.606 . . . . . . . . . 0 0 . 1 . 008 nuclear build core ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 5.9 m-20 -57.87 -56.62 19.66 Favored 'General case' 0 N--CA 1.451 -0.415 0 CA-C-O 121.408 0.623 . . . . 0.0 110.129 178.899 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 70.0 mm-40 -54.23 -47.35 72.28 Favored 'General case' 0 N--CA 1.453 -0.323 0 CA-C-N 115.911 -0.586 . . . . 0.0 110.222 178.555 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 6.2 tp -52.8 -53.5 47.55 Favored 'General case' 0 C--O 1.224 -0.283 0 C-N-CA 123.096 0.558 . . . . 0.0 109.921 176.172 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 50' ' ' PHE . . . . . . . . . . . . . 63.1 t80 -52.6 -51.35 60.34 Favored 'General case' 0 N--CA 1.453 -0.299 0 C-N-CA 124.232 1.013 . . . . 0.0 110.486 -179.194 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 2.2 mp0 -56.18 -50.03 72.35 Favored 'General case' 0 CA--C 1.533 0.31 0 CA-C-O 120.529 0.204 . . . . 0.0 111.18 174.89 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 34.6 mt-10 -55.62 -41.75 73.95 Favored 'General case' 0 CA--C 1.531 0.217 0 C-N-CA 123.024 0.53 . . . . 0.0 111.673 179.983 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 76.4 mt -67.04 -54.9 17.16 Favored 'General case' 0 N--CA 1.449 -0.523 0 C-N-CA 122.921 0.488 . . . . 0.0 110.339 177.689 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 11.4 t70 . . . . . 0 N--CA 1.453 -0.296 0 CA-C-O 121.627 0.727 . . . . 0.0 109.332 -179.136 . . . . . . . . 0 0 . 1 . 008 nuclear build core ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 39.7 mt-10 . . . . . 0 N--CA 1.455 -0.204 0 N-CA-C 107.615 -1.254 . . . . 0.0 107.615 . . . . . . . . . 0 0 . 1 . 008 nuclear build core ' A' A ' 61' ' ' VAL . . . . . . . . . . . . . 3.8 t -88.77 111.24 22.35 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.308 0 N-CA-C 112.754 0.65 . . . . 0.0 112.754 -163.913 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 34.3 m -79.45 162.36 25.51 Favored 'General case' 0 CA--C 1.533 0.326 0 C-N-CA 123.094 0.558 . . . . 0.0 111.989 169.876 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 63' ' ' PHE . . . . . . . . . . . . . 57.7 t80 -54.2 -37.89 65.05 Favored 'General case' 0 N--CA 1.464 0.257 0 N-CA-C 113.388 0.885 . . . . 0.0 113.388 -169.568 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 25.3 mp0 -65.39 -57.69 7.72 Favored 'General case' 0 N--CA 1.451 -0.404 0 N-CA-C 109.081 -0.711 . . . . 0.0 109.081 -176.565 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 17.1 pt-20 -61.43 -36.49 80.5 Favored 'General case' 0 CA--C 1.541 0.623 0 O-C-N 121.823 -0.548 . . . . 0.0 111.347 177.478 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 14.6 t80 -52.76 -26.12 13.29 Favored 'General case' 0 CA--C 1.537 0.474 0 C-N-CA 123.943 0.897 . . . . 0.0 112.335 169.922 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 67' ' ' GLN . . . . . . . . . . . . . 60.3 mm-40 -54.82 -23.17 17.06 Favored 'General case' 0 CA--C 1.534 0.337 0 CA-C-N 119.83 1.195 . . . . 0.0 113.077 173.356 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 98.6 t -55.89 -33.76 35.77 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.516 0 CA-C-N 119.341 0.973 . . . . 0.0 110.528 171.526 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 22.5 tp -74.12 -49.92 21.77 Favored 'General case' 0 N--CA 1.455 -0.203 0 N-CA-C 107.754 -1.202 . . . . 0.0 107.754 177.264 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 70' ' ' VAL . . . . . . . . . . . . . 58.9 t . . . . . 0 CA--C 1.536 0.408 0 C-N-CA 123.642 0.777 . . . . 0.0 110.472 179.63 . . . . . . . . 0 0 . 1 . 009 nuclear build core ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 76.3 Cg_exo . . . . . 0 N--CA 1.453 -0.856 0 N-CA-C 111.821 -0.107 . . . . 0.0 111.821 . . . . . . . . . 0 0 . 1 . 009 nuclear build core ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 44.9 mt-10 -62.46 -53.07 60.31 Favored 'General case' 0 CA--C 1.531 0.234 0 C-N-CA 123.807 0.843 . . . . 0.0 111.327 176.77 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 28.7 mt-10 -55.28 -46.85 76.18 Favored 'General case' 0 C--N 1.335 -0.057 0 CA-C-O 121.599 0.714 . . . . 0.0 109.19 176.37 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 58.9 mt -60.65 -35.75 76.98 Favored 'General case' 0 N--CA 1.446 -0.626 0 C-N-CA 124.118 0.967 . . . . 0.0 112.757 178.344 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER -62.24 -47.95 82.11 Favored 'General case' 0 N--CA 1.454 -0.254 0 CA-C-N 119.031 0.832 . . . . 0.0 109.633 170.629 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . -53.75 -52.02 45.07 Favored Glycine 0 CA--C 1.532 1.106 0 N-CA-C 110.698 -0.961 . . . . 0.0 110.698 177.316 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 9' ' ' ILE . . . . . . . . . . . . . 24.0 mm -55.45 -54.45 25.18 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.235 0 C-N-CA 125.341 1.457 . . . . 0.0 109.775 175.152 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 10' ' ' PHE . . . . . . . . . . . . . 34.4 t80 -47.56 -50.75 23.08 Favored 'General case' 0 N--CA 1.45 -0.45 0 C-N-CA 123.445 0.698 . . . . 0.0 109.878 178.872 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 57.7 mt-10 -61.97 -53.14 59.73 Favored 'General case' 0 CA--C 1.53 0.173 0 C-N-CA 122.59 0.356 . . . . 0.0 110.781 178.385 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 39.4 tttm -44.0 -49.64 8.56 Favored 'General case' 0 CA--C 1.527 0.092 0 C-N-CA 124.986 1.314 . . . . 0.0 111.022 178.624 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 57.6 m-85 -78.38 -52.41 8.62 Favored 'General case' 0 N--CA 1.45 -0.437 0 CA-C-O 119.409 -0.329 . . . . 0.0 110.613 -177.64 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -48.01 -60.65 2.45 Favored 'General case' 0 C--N 1.331 -0.199 0 C-N-CA 124.083 0.953 . . . . 0.0 111.043 -179.444 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.529 0.167 0 C-N-CA 125.148 1.379 . . . . 0.0 113.051 -177.411 . . . . . . . . 0 0 . 1 . 009 nuclear build core ' A' A ' 20' ' ' PRO . . . . . . . . . . . . . 12.0 Cg_endo . . . . . 0 CA--C 1.536 0.583 0 N-CA-C 114.533 0.936 . . . . 0.0 114.533 . . . . . . . . . 0 0 . 1 . 009 nuclear build core ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 51.8 m-80 -88.58 2.9 52.17 Favored 'General case' 0 CA--C 1.536 0.429 0 C-N-CA 124.77 1.228 . . . . 0.0 113.105 -179.611 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -149.38 116.43 6.01 Favored 'General case' 0 CA--C 1.541 0.619 0 CA-C-N 119.187 0.903 . . . . 0.0 112.683 -169.039 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 77.9 mt -88.2 134.3 33.82 Favored 'General case' 0 CA--C 1.532 0.288 0 C-N-CA 124.563 1.145 . . . . 0.0 111.095 173.654 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 27.5 p -80.38 178.73 8.1 Favored 'General case' 0 CA--C 1.534 0.341 0 N-CA-C 108.543 -0.91 . . . . 0.0 108.543 166.389 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 64.4 mttp -57.98 -38.95 77.01 Favored 'General case' 0 N--CA 1.455 -0.218 0 N-CA-C 109.806 -0.442 . . . . 0.0 109.806 170.127 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 1.8 mp0 -67.95 -50.74 54.13 Favored 'General case' 0 N--CA 1.45 -0.433 0 C-N-CA 122.883 0.473 . . . . 0.0 110.035 -175.755 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 3.0 mp0 -55.79 -44.77 78.1 Favored 'General case' 0 N--CA 1.452 -0.361 0 C-N-CA 119.826 -0.75 . . . . 0.0 110.236 174.87 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 12.7 mt -56.85 -43.43 81.13 Favored 'General case' 0 CA--C 1.513 -0.454 0 CA-C-N 119.067 0.849 . . . . 0.0 113.153 171.798 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 64.5 tttm -60.31 -48.76 80.38 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-N 118.505 0.593 . . . . 0.0 109.679 -178.444 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 87.2 mt -60.16 -47.47 85.8 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.179 -0.464 . . . . 0.0 111.375 178.166 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 7.6 tt -51.99 -57.64 8.87 Favored 'General case' 0 N--CA 1.456 -0.143 0 C-N-CA 124.175 0.99 . . . . 0.0 109.497 175.721 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 47.6 mt -56.0 -54.24 47.21 Favored 'General case' 0 C--O 1.223 -0.298 0 N-CA-C 108.717 -0.845 . . . . 0.0 108.717 -178.54 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 28.3 tt0 -53.65 -49.77 67.21 Favored 'General case' 0 N--CA 1.451 -0.387 0 C-N-CA 123.777 0.831 . . . . 0.0 111.652 -176.296 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 2.1 m -73.75 -52.76 12.1 Favored 'General case' 0 CA--C 1.531 0.223 0 C-N-CA 120.684 -0.407 . . . . 0.0 110.984 -175.546 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 57.3 mm-40 -87.22 -31.91 20.06 Favored 'General case' 0 N--CA 1.448 -0.555 0 C-N-CA 123.183 0.593 . . . . 0.0 112.426 -166.595 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 74.5 m-85 . . . . . 0 CA--C 1.534 0.335 0 C-N-CA 123.425 0.69 . . . . 0.0 111.604 -172.341 . . . . . . . . 0 0 . 1 . 009 nuclear build core ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 19.5 mt . . . . . 0 CA--C 1.517 -0.316 0 N-CA-C 108.658 -0.867 . . . . 0.0 108.658 . . . . . . . . . 0 0 . 1 . 009 nuclear build core ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 3.4 m-20 -50.3 -44.89 54.23 Favored 'General case' 0 N--CA 1.453 -0.29 0 C-N-CA 125.261 1.425 . . . . 0.0 111.528 -176.219 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 5.9 mp0 -59.57 -48.21 82.53 Favored 'General case' 0 C--N 1.328 -0.327 0 C-N-CA 123.702 0.801 . . . . 0.0 110.468 176.907 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 1.3 tt -58.64 -50.96 71.94 Favored 'General case' 0 CA--C 1.534 0.335 0 CA-C-O 121.824 0.821 . . . . 0.0 109.264 177.573 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 50' ' ' PHE . . . . . . . . . . . . . 52.4 t80 -51.55 -50.55 59.83 Favored 'General case' 0 N--CA 1.452 -0.336 0 C-N-CA 124.778 1.231 . . . . 0.0 110.537 178.246 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 27.0 tp10 -60.81 -43.54 98.06 Favored 'General case' 0 N--CA 1.454 -0.253 0 C-N-CA 122.879 0.472 . . . . 0.0 110.587 177.528 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 12.8 tm-20 -54.61 -43.27 72.05 Favored 'General case' 0 CA--C 1.533 0.316 0 C-N-CA 122.763 0.425 . . . . 0.0 110.756 177.079 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 92.1 mt -68.28 -64.42 0.87 Allowed 'General case' 0 N--CA 1.452 -0.341 0 C-N-CA 122.698 0.399 . . . . 0.0 110.918 175.486 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 18.2 t0 . . . . . 0 N--CA 1.455 -0.202 0 C-N-CA 124.466 1.106 . . . . 0.0 109.438 178.935 . . . . . . . . 0 0 . 1 . 009 nuclear build core ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 31.7 mt-10 . . . . . 0 N--CA 1.456 -0.14 0 N-CA-C 106.722 -1.584 . . . . 0.0 106.722 . . . . . . . . . 0 0 . 1 . 009 nuclear build core ' A' A ' 61' ' ' VAL . . . . . . . . . . . . . 65.5 t -109.92 103.05 14.87 Favored 'Isoleucine or valine' 0 CA--C 1.529 0.137 0 CA-C-N 118.184 0.447 . . . . 0.0 110.231 -169.164 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 11.9 t -78.81 170.96 15.86 Favored 'General case' 0 CA--C 1.535 0.374 0 CA-C-O 121.16 0.505 . . . . 0.0 111.383 172.52 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 63' ' ' PHE . . . . . . . . . . . . . 57.3 t80 -63.85 -39.58 94.54 Favored 'General case' 0 C--O 1.232 0.137 0 C-N-CA 122.713 0.405 . . . . 0.0 111.332 -173.062 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 50.2 mt-10 -61.4 -58.39 8.41 Favored 'General case' 0 N--CA 1.452 -0.359 0 O-C-N 122.088 -0.383 . . . . 0.0 110.025 -178.745 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 10.8 pt-20 -61.27 -36.4 79.94 Favored 'General case' 0 CA--C 1.537 0.458 0 O-C-N 121.707 -0.621 . . . . 0.0 111.547 178.574 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 24.7 t80 -52.97 -26.68 15.98 Favored 'General case' 0 CA--C 1.54 0.562 0 O-C-N 121.313 -0.867 . . . . 0.0 112.585 169.777 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 67' ' ' GLN . . . . . . . . . . . . . 40.2 mm-40 -54.81 -25.64 29.67 Favored 'General case' 0 CA--C 1.537 0.463 0 CA-C-N 119.819 1.191 . . . . 0.0 112.926 173.051 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 96.5 t -54.58 -32.69 25.53 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.605 0 CA-C-N 118.685 0.675 . . . . 0.0 110.458 172.238 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -77.16 -50.28 13.34 Favored 'General case' 0 N--CA 1.455 -0.211 0 C-N-CA 124.684 1.193 . . . . 0.0 108.696 172.931 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 70' ' ' VAL . . . . . . . . . . . . . 98.0 t . . . . . 0 N--CA 1.465 0.314 0 O-C-N 121.861 -0.525 . . . . 0.0 111.702 -177.674 . . . . . . . . 0 0 . 1 . 010 nuclear build core ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 88.6 Cg_exo . . . . . 0 N--CA 1.458 -0.587 0 N-CA-C 112.58 0.185 . . . . 0.0 112.58 . . . . . . . . . 0 0 . 1 . 010 nuclear build core ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 48.4 mt-10 -60.93 -50.23 74.24 Favored 'General case' 0 C--O 1.232 0.177 0 C-N-CA 123.335 0.654 . . . . 0.0 110.841 177.357 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 45.1 mm-40 -59.58 -46.01 90.18 Favored 'General case' 0 N--CA 1.453 -0.281 0 N-CA-C 108.794 -0.817 . . . . 0.0 108.794 178.008 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 6' ' ' LEU . . . . . 0.422 HD13 HG22 ' A' ' 70' ' ' VAL . 25.6 mt -57.9 -40.1 79.5 Favored 'General case' 0 N--CA 1.445 -0.703 0 CA-C-O 118.653 -0.689 . . . . 0.0 112.333 178.235 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 20.6 tptm -59.5 -52.33 66.02 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 119.506 1.048 . . . . 0.0 110.168 171.94 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . -49.89 -53.84 20.63 Favored Glycine 0 CA--C 1.536 1.372 0 N-CA-C 111.699 -0.561 . . . . 0.0 111.699 177.927 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 9' ' ' ILE . . . . . . . . . . . . . 1.6 mm -53.7 -56.4 9.08 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.163 0 C-N-CA 127.007 2.123 . . . . 0.0 108.825 175.826 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 10' ' ' PHE . . . . . . . . . . . . . 24.0 t80 -49.36 -50.53 39.56 Favored 'General case' 0 N--CA 1.444 -0.732 0 C-N-CA 123.406 0.683 . . . . 0.0 109.374 -179.27 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 53.1 mt-10 -62.41 -48.07 81.31 Favored 'General case' 0 N--CA 1.453 -0.29 0 C-N-CA 123.196 0.598 . . . . 0.0 110.833 -179.147 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 37.1 tttm -44.2 -51.45 8.18 Favored 'General case' 0 CA--C 1.529 0.163 0 C-N-CA 124.006 0.923 . . . . 0.0 111.002 177.207 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 85.1 m-85 -79.38 -49.28 12.61 Favored 'General case' 0 CA--C 1.535 0.376 0 CA-C-O 120.546 0.212 . . . . 0.0 111.12 -177.245 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -55.67 -39.02 70.39 Favored 'General case' 0 N--CA 1.464 0.243 0 C-N-CA 124.532 1.133 . . . . 0.0 112.558 -177.428 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.532 0.279 0 C-N-CA 123.411 0.684 . . . . 0.0 111.807 175.794 . . . . . . . . 0 0 . 1 . 010 nuclear build core ' A' A ' 20' ' ' PRO . . . . . . . . . . . . . 32.8 Cg_endo . . . . . 0 N--CA 1.456 -0.725 0 N-CA-C 112.414 0.121 . . . . 0.0 112.414 . . . . . . . . . 0 0 . 1 . 010 nuclear build core ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 41.9 m-80 -85.42 -5.02 59.33 Favored 'General case' 0 N--CA 1.452 -0.331 0 C-N-CA 124.526 1.13 . . . . 0.0 113.205 -174.167 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 27.8 tt0 -142.91 126.34 16.72 Favored 'General case' 0 CA--C 1.543 0.679 0 CA-C-N 119.513 1.051 . . . . 0.0 113.823 -169.553 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 70.4 mt -103.94 138.27 40.75 Favored 'General case' 0 C--N 1.345 0.393 0 C-N-CA 125.451 1.5 . . . . 0.0 112.15 -179.413 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 77.9 p -80.56 172.76 13.34 Favored 'General case' 0 C--O 1.234 0.259 0 C-N-CA 123.966 0.906 . . . . 0.0 109.722 168.021 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 98.3 mttt -55.41 -45.07 76.71 Favored 'General case' 0 C--O 1.226 -0.172 0 N-CA-C 110.169 -0.308 . . . . 0.0 110.169 172.045 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 22.9 mt-10 -65.85 -46.99 76.45 Favored 'General case' 0 CA--C 1.516 -0.336 0 CA-C-O 120.785 0.326 . . . . 0.0 110.559 -175.96 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -61.67 -39.92 93.12 Favored 'General case' 0 C--N 1.327 -0.374 0 C-N-CA 120.062 -0.655 . . . . 0.0 110.056 177.844 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 13.5 mt -57.47 -47.59 81.45 Favored 'General case' 0 C--O 1.218 -0.593 0 CA-C-N 119.346 0.975 . . . . 0.0 111.897 168.554 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 38.4 ttpt -58.08 -47.26 83.75 Favored 'General case' 0 C--N 1.323 -0.582 0 CA-C-N 119.002 0.819 . . . . 0.0 110.077 -175.95 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 3.7 mm? -59.59 -48.04 83.2 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.351 -0.386 . . . . 0.0 111.475 175.498 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 7.9 tt -51.23 -57.49 8.67 Favored 'General case' 0 N--CA 1.456 -0.136 0 C-N-CA 123.563 0.745 . . . . 0.0 109.896 176.061 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 48.0 mt -57.93 -51.2 70.62 Favored 'General case' 0 C--O 1.223 -0.292 0 N-CA-C 109.546 -0.539 . . . . 0.0 109.546 -179.247 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 17.5 tt0 -54.67 -44.15 73.05 Favored 'General case' 0 N--CA 1.452 -0.344 0 O-C-N 121.744 -0.597 . . . . 0.0 111.755 -176.598 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 2.1 m -77.85 -49.03 15.07 Favored 'General case' 0 CA--C 1.534 0.36 0 C-N-CA 120.92 -0.312 . . . . 0.0 111.316 -177.611 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 67.1 mm-40 -96.79 -27.9 14.52 Favored 'General case' 0 N--CA 1.451 -0.383 0 N-CA-C 114.015 1.117 . . . . 0.0 114.015 -165.716 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 97.9 m-85 . . . . . 0 CA--C 1.538 0.513 0 C-N-CA 124.559 1.144 . . . . 0.0 112.2 -176.592 . . . . . . . . 0 0 . 1 . 010 nuclear build core ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 66.9 tp . . . . . 0 C--O 1.225 -0.192 0 N-CA-C 112.274 0.472 . . . . 0.0 112.274 . . . . . . . . . 0 0 . 1 . 010 nuclear build core ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 6.2 m-20 -59.21 -51.51 69.66 Favored 'General case' 0 N--CA 1.45 -0.431 0 C-N-CA 123.017 0.527 . . . . 0.0 110.829 -179.54 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 38.1 mm-40 -61.41 -43.96 97.96 Favored 'General case' 0 N--CA 1.453 -0.317 0 CA-C-N 116.291 -0.413 . . . . 0.0 110.394 -179.905 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 67.0 tp -56.99 -50.65 72.05 Favored 'General case' 0 N--CA 1.451 -0.38 0 N-CA-C 109.431 -0.581 . . . . 0.0 109.431 175.724 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 50' ' ' PHE . . . . . . . . . . . . . 65.4 t80 -54.06 -50.85 65.82 Favored 'General case' 0 N--CA 1.45 -0.439 0 C-N-CA 123.806 0.842 . . . . 0.0 110.508 -178.982 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 59.0 mm-40 -58.22 -47.51 83.27 Favored 'General case' 0 CA--C 1.532 0.267 0 CA-C-O 120.629 0.252 . . . . 0.0 111.151 175.683 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 40.7 tt0 -55.28 -40.3 70.87 Favored 'General case' 0 CA--C 1.531 0.238 0 C-N-CA 123.526 0.73 . . . . 0.0 111.338 179.279 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 84.3 mt -77.18 -49.28 15.52 Favored 'General case' 0 N--CA 1.448 -0.567 0 C-N-CA 122.99 0.516 . . . . 0.0 111.492 -179.341 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 43.8 t0 . . . . . 0 CA--C 1.536 0.409 0 C-N-CA 123.828 0.851 . . . . 0.0 111.586 -175.799 . . . . . . . . 0 0 . 1 . 010 nuclear build core ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 42.0 mt-10 . . . . . 0 N--CA 1.452 -0.338 0 N-CA-C 106.137 -1.801 . . . . 0.0 106.137 . . . . . . . . . 0 0 . 1 . 010 nuclear build core ' A' A ' 61' ' ' VAL . . . . . . . . . . . . . 16.1 t -102.32 116.22 45.61 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.149 0 N-CA-C 108.807 -0.812 . . . . 0.0 108.807 -179.028 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 78.3 p -79.99 156.67 27.08 Favored 'General case' 0 CA--C 1.537 0.458 0 C-N-CA 122.934 0.493 . . . . 0.0 111.248 174.966 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 63' ' ' PHE . . . . . . . . . . . . . 77.2 t80 -56.11 -32.88 64.59 Favored 'General case' 0 N--CA 1.467 0.383 0 N-CA-C 113.31 0.856 . . . . 0.0 113.31 -178.361 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 13.0 tp10 -65.42 -62.45 1.52 Allowed 'General case' 0 N--CA 1.453 -0.288 0 O-C-N 121.882 -0.511 . . . . 0.0 109.624 178.495 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 12.0 pt-20 -64.97 -27.15 68.64 Favored 'General case' 0 CA--C 1.54 0.578 0 O-C-N 121.182 -0.948 . . . . 0.0 111.553 -177.023 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 15.5 t80 -50.97 -27.53 7.86 Favored 'General case' 0 CA--C 1.534 0.33 0 C-N-CA 123.499 0.72 . . . . 0.0 112.176 168.828 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 67' ' ' GLN . . . . . . . . . . . . . 66.8 mm-40 -53.88 -24.29 15.45 Favored 'General case' 0 CA--C 1.54 0.559 0 CA-C-N 119.814 1.188 . . . . 0.0 113.058 173.314 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 97.2 t -57.06 -31.26 36.46 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.631 0 O-C-N 121.043 -1.036 . . . . 0.0 111.24 171.796 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 7.5 tt -71.93 -44.22 63.99 Favored 'General case' 0 N--CA 1.457 -0.094 0 N-CA-C 107.721 -1.214 . . . . 0.0 107.721 177.959 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 70' ' ' VAL . . . . . 0.422 HG22 HD13 ' A' ' 6' ' ' LEU . 18.2 t . . . . . 0 CA--C 1.532 0.286 0 N-CA-C 109.804 -0.443 . . . . 0.0 109.804 178.07 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 84.8 Cg_exo . . . . . 0 N--CA 1.456 -0.71 0 N-CA-C 112.364 0.102 . . . . 0.0 112.364 . . . . . . . . . 0 0 . 1 . 011 nuclear build core ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 44.7 mt-10 -62.71 -48.94 77.06 Favored 'General case' 0 CA--C 1.529 0.162 0 C-N-CA 123.657 0.783 . . . . 0.0 111.395 176.652 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 29.0 mt-10 -60.11 -46.46 89.55 Favored 'General case' 0 C--N 1.332 -0.164 0 N-CA-C 109.148 -0.686 . . . . 0.0 109.148 177.18 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 27.4 mt -60.29 -39.34 86.55 Favored 'General case' 0 N--CA 1.447 -0.585 0 C-N-CA 123.031 0.532 . . . . 0.0 111.953 179.087 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 19.7 tptm -58.86 -49.12 78.92 Favored 'General case' 0 C--N 1.332 -0.175 0 O-C-N 121.678 -0.639 . . . . 0.0 110.046 170.029 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . -51.66 -50.68 41.87 Favored Glycine 0 CA--C 1.529 0.941 0 N-CA-C 110.401 -1.08 . . . . 0.0 110.401 178.686 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 9' ' ' ILE . . . . . . . . . . . . . 24.4 mm -57.6 -54.95 24.52 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.252 0 C-N-CA 125.324 1.45 . . . . 0.0 109.894 175.795 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 10' ' ' PHE . . . . . . . . . . . . . 25.6 t80 -48.36 -50.84 28.97 Favored 'General case' 0 N--CA 1.446 -0.673 0 O-C-N 121.747 -0.596 . . . . 0.0 109.673 179.815 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 43.6 mt-10 -64.4 -46.69 82.21 Favored 'General case' 0 N--CA 1.453 -0.298 0 CA-C-O 118.687 -0.673 . . . . 0.0 111.429 179.596 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 29.2 ttmt -43.37 -53.3 5.41 Favored 'General case' 0 N--CA 1.464 0.24 0 C-N-CA 124.072 0.949 . . . . 0.0 110.469 175.947 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 80.3 m-85 -78.86 -47.84 15.82 Favored 'General case' 0 N--CA 1.451 -0.392 0 CA-C-N 116.544 -0.298 . . . . 0.0 110.829 -175.346 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -56.75 -45.48 81.99 Favored 'General case' 0 CA--C 1.533 0.32 0 CA-C-O 121.654 0.74 . . . . 0.0 112.1 -177.919 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.53 0.193 0 C-N-CA 123.96 0.904 . . . . 0.0 111.777 175.967 . . . . . . . . 0 0 . 1 . 011 nuclear build core ' A' A ' 20' ' ' PRO . . . . . . . . . . . . . 29.3 Cg_endo . . . . . 0 N--CA 1.456 -0.702 0 N-CA-C 113.124 0.394 . . . . 0.0 113.124 . . . . . . . . . 0 0 . 1 . 011 nuclear build core ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 43.1 m-80 -89.81 -6.14 56.22 Favored 'General case' 0 CA--C 1.531 0.228 0 C-N-CA 124.539 1.136 . . . . 0.0 113.601 -170.571 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 30.0 tt0 -148.09 126.35 12.24 Favored 'General case' 0 CA--C 1.541 0.606 0 CA-C-N 119.39 0.995 . . . . 0.0 112.492 -168.138 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 51.2 mt -103.31 135.88 44.13 Favored 'General case' 0 C--N 1.344 0.361 0 C-N-CA 125.295 1.438 . . . . 0.0 111.117 -178.649 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 7.0 p -88.6 178.06 6.61 Favored 'General case' 0 C--O 1.236 0.376 0 N-CA-C 108.475 -0.935 . . . . 0.0 108.475 167.162 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 99.1 mttt -54.16 -43.65 70.77 Favored 'General case' 0 N--CA 1.454 -0.231 0 C-N-CA 122.991 0.516 . . . . 0.0 111.299 -179.754 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 34.3 tt0 -65.84 -46.38 78.73 Favored 'General case' 0 N--CA 1.456 -0.14 0 O-C-N 121.995 -0.441 . . . . 0.0 110.602 -175.636 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 4.1 mp0 -58.39 -45.31 88.57 Favored 'General case' 0 N--CA 1.453 -0.322 0 N-CA-C 109.474 -0.565 . . . . 0.0 109.474 176.609 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 18.9 mt -57.39 -42.02 81.37 Favored 'General case' 0 CA--C 1.512 -0.489 0 C-N-CA 120.288 -0.565 . . . . 0.0 112.262 173.279 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 25.3 ttpp -61.71 -50.96 70.34 Favored 'General case' 0 N--CA 1.447 -0.582 0 CA-C-N 118.725 0.693 . . . . 0.0 109.479 -178.113 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 83.3 mt -59.83 -46.02 90.56 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-O 120.847 0.356 . . . . 0.0 111.398 178.972 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 8.0 tt -53.31 -55.92 20.78 Favored 'General case' 0 C--N 1.332 -0.168 0 C-N-CA 124.002 0.921 . . . . 0.0 109.518 174.695 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 38.4 mt -54.14 -54.39 40.24 Favored 'General case' 0 C--O 1.226 -0.178 0 C-N-CA 123.517 0.727 . . . . 0.0 109.689 -179.412 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 41.2 mt-30 -51.32 -51.84 50.68 Favored 'General case' 0 N--CA 1.457 -0.087 0 C-N-CA 122.954 0.502 . . . . 0.0 111.432 179.249 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 7.0 m -70.19 -53.95 14.93 Favored 'General case' 0 N--CA 1.455 -0.205 0 CA-C-N 116.485 -0.325 . . . . 0.0 111.149 -172.483 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 42.5 mm-40 -94.05 -34.84 12.85 Favored 'General case' 0 N--CA 1.45 -0.438 0 N-CA-C 113.134 0.79 . . . . 0.0 113.134 -167.671 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 17.3 m-85 . . . . . 0 CA--C 1.53 0.209 0 C-N-CA 122.626 0.37 . . . . 0.0 111.82 -170.571 . . . . . . . . 0 0 . 1 . 011 nuclear build core ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 56.8 tp . . . . . 0 C--O 1.224 -0.265 0 CA-C-O 120.781 0.324 . . . . 0.0 110.254 . . . . . . . . . 0 0 . 1 . 011 nuclear build core ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 5.5 m-20 -56.88 -55.48 33.92 Favored 'General case' 0 N--CA 1.452 -0.325 0 C-N-CA 124.271 1.028 . . . . 0.0 111.313 177.571 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 31.1 mm-40 -59.08 -42.83 91.38 Favored 'General case' 0 C--N 1.331 -0.213 0 O-C-N 122.222 -0.299 . . . . 0.0 111.119 178.692 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 59.1 tp -59.19 -47.42 85.37 Favored 'General case' 0 CA--C 1.531 0.233 0 CA-C-O 121.207 0.527 . . . . 0.0 110.055 176.485 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 50' ' ' PHE . . . . . . . . . . . . . 59.7 t80 -55.03 -49.35 71.78 Favored 'General case' 0 N--CA 1.452 -0.371 0 C-N-CA 123.914 0.885 . . . . 0.0 109.888 178.989 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 78.3 mm-40 -59.2 -46.07 89.4 Favored 'General case' 0 N--CA 1.455 -0.209 0 CA-C-O 120.443 0.163 . . . . 0.0 111.42 175.11 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 36.8 tt0 -52.14 -45.08 64.87 Favored 'General case' 0 CA--C 1.531 0.224 0 C-N-CA 122.735 0.414 . . . . 0.0 111.016 177.651 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 96.4 mt -68.68 -59.58 3.01 Favored 'General case' 0 N--CA 1.451 -0.393 0 C-N-CA 122.982 0.513 . . . . 0.0 110.846 177.655 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 12.0 t0 . . . . . 0 N--CA 1.455 -0.202 0 C-N-CA 125.648 1.579 . . . . 0.0 110.136 178.209 . . . . . . . . 0 0 . 1 . 011 nuclear build core ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 25.6 mt-10 . . . . . 0 N--CA 1.453 -0.299 0 N-CA-C 105.829 -1.915 . . . . 0.0 105.829 . . . . . . . . . 0 0 . 1 . 011 nuclear build core ' A' A ' 61' ' ' VAL . . . . . . . . . . . . . 98.7 t -113.68 110.2 31.27 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.248 0 N-CA-C 108.924 -0.769 . . . . 0.0 108.924 -179.248 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 4.6 m -79.23 163.21 25.16 Favored 'General case' 0 CA--C 1.535 0.39 0 C-N-CA 124.699 1.2 . . . . 0.0 110.648 174.126 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 63' ' ' PHE . . . . . . . . . . . . . 64.9 t80 -58.48 -34.63 71.1 Favored 'General case' 0 N--CA 1.466 0.33 0 N-CA-C 113.084 0.772 . . . . 0.0 113.084 -177.563 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 12.7 tp10 -65.17 -60.63 2.79 Favored 'General case' 0 CA--C 1.533 0.32 0 O-C-N 121.931 -0.481 . . . . 0.0 109.896 178.255 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 9.9 pt-20 -61.83 -30.9 71.14 Favored 'General case' 0 CA--C 1.539 0.52 0 O-C-N 121.376 -0.827 . . . . 0.0 111.679 -178.506 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 20.6 t80 -51.35 -30.53 18.97 Favored 'General case' 0 CA--C 1.535 0.396 0 O-C-N 121.462 -0.774 . . . . 0.0 112.476 169.019 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 67' ' ' GLN . . . . . . . . . . . . . 77.9 mm-40 -55.52 -23.52 26.77 Favored 'General case' 0 CA--C 1.537 0.461 0 CA-C-N 119.723 1.147 . . . . 0.0 112.769 174.224 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 90.7 t -60.35 -33.09 52.67 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.563 0 CA-C-N 119.512 1.051 . . . . 0.0 110.789 172.068 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 3.2 tm? -72.71 -49.69 29.57 Favored 'General case' 0 N--CA 1.457 -0.085 0 N-CA-C 106.997 -1.483 . . . . 0.0 106.997 -179.35 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 70' ' ' VAL . . . . . . . . . . . . . 22.0 t . . . . . 0 CA--C 1.536 0.406 0 C-N-CA 122.845 0.458 . . . . 0.0 109.982 176.705 . . . . . . . . 0 0 . 1 . 012 nuclear build core ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 86.2 Cg_exo . . . . . 0 N--CA 1.458 -0.616 0 CA-C-O 120.571 0.155 . . . . 0.0 112.015 . . . . . . . . . 0 0 . 1 . 012 nuclear build core ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 48.9 mt-10 -62.2 -49.43 75.81 Favored 'General case' 0 N--CA 1.455 -0.191 0 C-N-CA 123.534 0.734 . . . . 0.0 111.105 177.578 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 2.4 tm-20 -62.4 -43.33 99.08 Favored 'General case' 0 CA--C 1.531 0.215 0 N-CA-C 108.414 -0.958 . . . . 0.0 108.414 -179.483 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 31.7 mt -59.99 -39.85 87.15 Favored 'General case' 0 N--CA 1.45 -0.475 0 C-N-CA 124.245 1.018 . . . . 0.0 111.732 176.827 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 54.8 tptt -59.35 -50.46 73.87 Favored 'General case' 0 C--N 1.333 -0.14 0 CA-C-N 118.986 0.812 . . . . 0.0 110.157 170.575 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . -49.22 -53.65 18.57 Favored Glycine 0 CA--C 1.532 1.127 0 N-CA-C 111.246 -0.742 . . . . 0.0 111.246 177.346 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 9' ' ' ILE . . . . . . . . . . . . . 1.6 mm -56.52 -54.49 27.93 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.226 0 C-N-CA 125.81 1.644 . . . . 0.0 109.209 176.565 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 10' ' ' PHE . . . . . . . . . . . . . 19.6 t80 -48.03 -51.35 24.47 Favored 'General case' 0 N--CA 1.447 -0.607 0 C-N-CA 123.304 0.642 . . . . 0.0 109.562 179.574 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 52.8 mt-10 -62.41 -49.89 73.67 Favored 'General case' 0 N--CA 1.455 -0.196 0 C-N-CA 123.374 0.67 . . . . 0.0 110.727 -179.749 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 45.4 tttp -43.78 -50.9 7.63 Favored 'General case' 0 CA--C 1.528 0.098 0 C-N-CA 124.094 0.958 . . . . 0.0 110.87 177.606 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 75.4 m-85 -79.56 -47.92 14.7 Favored 'General case' 0 CA--C 1.528 0.13 0 N-CA-C 111.836 0.31 . . . . 0.0 111.836 -177.937 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -57.07 -31.21 64.98 Favored 'General case' 0 N--CA 1.466 0.354 0 C-N-CA 124.902 1.281 . . . . 0.0 112.859 -178.628 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.421 0 O-C-N 121.872 -0.517 . . . . 0.0 111.472 174.767 . . . . . . . . 0 0 . 1 . 012 nuclear build core ' A' A ' 20' ' ' PRO . . . . . . . . . . . . . 22.9 Cg_endo . . . . . 0 CA--C 1.536 0.593 0 N-CA-C 113.35 0.481 . . . . 0.0 113.35 . . . . . . . . . 0 0 . 1 . 012 nuclear build core ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 41.9 m-80 -94.05 3.28 55.55 Favored 'General case' 0 CA--C 1.533 0.315 0 C-N-CA 125.303 1.441 . . . . 0.0 113.205 -178.487 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 51.0 tt0 -139.59 124.12 18.25 Favored 'General case' 0 CA--C 1.539 0.555 0 CA-C-N 119.109 0.868 . . . . 0.0 112.134 -176.891 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 60.4 mt -100.16 136.55 39.89 Favored 'General case' 0 C--N 1.343 0.311 0 C-N-CA 123.908 0.883 . . . . 0.0 110.667 175.768 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 99.0 p -88.07 175.44 7.74 Favored 'General case' 0 CA--C 1.535 0.371 0 C-N-CA 123.75 0.82 . . . . 0.0 108.956 167.107 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 98.7 mttt -56.28 -46.17 79.85 Favored 'General case' 0 C--O 1.226 -0.148 0 O-C-N 121.968 -0.457 . . . . 0.0 111.288 179.556 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 29.0 tp10 -64.74 -45.14 87.76 Favored 'General case' 0 N--CA 1.455 -0.177 0 CA-C-O 121.034 0.445 . . . . 0.0 110.719 -177.312 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 58.8 mt-10 -56.88 -47.59 80.12 Favored 'General case' 0 N--CA 1.451 -0.42 0 N-CA-C 109.725 -0.472 . . . . 0.0 109.725 176.069 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 16.1 mt -55.86 -43.85 77.51 Favored 'General case' 0 CA--C 1.513 -0.474 0 N-CA-C 112.783 0.66 . . . . 0.0 112.783 170.994 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 63.3 tttp -59.09 -52.27 66.45 Favored 'General case' 0 C--N 1.323 -0.563 0 CA-C-N 118.839 0.745 . . . . 0.0 109.624 -177.145 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 81.2 mt -58.72 -48.97 79.32 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 115.816 -0.629 . . . . 0.0 110.748 178.866 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 9.6 tt -50.64 -55.12 17.86 Favored 'General case' 0 C--O 1.233 0.216 0 C-N-CA 124.007 0.923 . . . . 0.0 110.17 175.914 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 38.3 mt -56.81 -56.85 16.3 Favored 'General case' 0 N--CA 1.456 -0.174 0 C-N-CA 124.061 0.944 . . . . 0.0 110.086 -178.601 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -57.93 -50.37 73.59 Favored 'General case' 0 N--CA 1.455 -0.217 0 C-N-CA 122.552 0.341 . . . . 0.0 110.635 -175.568 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 9.1 m -65.11 -52.49 55.09 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.477 -0.329 . . . . 0.0 111.232 -175.036 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 76.1 mm-40 -103.58 -24.44 13.4 Favored 'General case' 0 N--CA 1.452 -0.348 0 N-CA-C 114.906 1.447 . . . . 0.0 114.906 -165.361 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 46.5 m-85 . . . . . 0 C--O 1.235 0.332 0 CA-C-N 119.263 0.938 . . . . 0.0 112.624 -171.795 . . . . . . . . 0 0 . 1 . 012 nuclear build core ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 18.5 mt . . . . . 0 N--CA 1.451 -0.394 0 N-CA-C 108.152 -1.055 . . . . 0.0 108.152 . . . . . . . . . 0 0 . 1 . 012 nuclear build core ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 5.5 m-20 -54.99 -56.38 20.4 Favored 'General case' 0 N--CA 1.451 -0.424 0 C-N-CA 124.527 1.131 . . . . 0.0 111.633 177.425 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 32.5 mt-10 -55.15 -48.1 74.2 Favored 'General case' 0 C--N 1.334 -0.089 0 C-N-CA 122.097 0.159 . . . . 0.0 110.706 176.377 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 55.9 tp -57.66 -47.6 81.83 Favored 'General case' 0 CA--C 1.532 0.263 0 CA-C-O 121.385 0.612 . . . . 0.0 110.47 179.649 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 50' ' ' PHE . . . . . . . . . . . . . 50.0 t80 -57.04 -48.93 77.34 Favored 'General case' 0 N--CA 1.452 -0.368 0 C-N-CA 124.467 1.107 . . . . 0.0 109.864 -179.874 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 33.9 tt0 -61.76 -40.44 95.17 Favored 'General case' 0 N--CA 1.453 -0.284 0 C-N-CA 122.788 0.435 . . . . 0.0 111.16 177.93 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 70.2 tt0 -59.0 -46.51 87.98 Favored 'General case' 0 C--N 1.331 -0.203 0 C-N-CA 123.092 0.557 . . . . 0.0 110.422 176.384 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 84.4 mt -66.38 -56.29 11.77 Favored 'General case' 0 N--CA 1.452 -0.345 0 C-N-CA 123.465 0.706 . . . . 0.0 111.133 -179.52 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 14.2 t0 . . . . . 0 N--CA 1.453 -0.307 0 C-N-CA 124.376 1.07 . . . . 0.0 108.985 -176.367 . . . . . . . . 0 0 . 1 . 012 nuclear build core ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 42.6 mp0 . . . . . 0 N--CA 1.457 -0.098 0 N-CA-C 105.94 -1.874 . . . . 0.0 105.94 . . . . . . . . . 0 0 . 1 . 012 nuclear build core ' A' A ' 61' ' ' VAL . . . . . . . . . . . . . 39.9 t -118.28 103.79 15.19 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.241 0 N-CA-C 109.136 -0.69 . . . . 0.0 109.136 176.678 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 18.6 t -79.2 167.37 21.07 Favored 'General case' 0 CA--C 1.532 0.282 0 C-N-CA 123.01 0.524 . . . . 0.0 111.345 172.335 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 63' ' ' PHE . . . . . . . . . . . . . 63.1 t80 -60.41 -34.8 74.47 Favored 'General case' 0 CA--C 1.53 0.211 0 C-N-CA 123.204 0.602 . . . . 0.0 112.518 -172.733 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 7.6 tm-20 -64.17 -61.77 2.05 Favored 'General case' 0 CA--C 1.533 0.327 0 N-CA-C 109.476 -0.565 . . . . 0.0 109.476 178.11 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 14.7 pt-20 -59.86 -33.44 71.81 Favored 'General case' 0 CA--C 1.537 0.463 0 O-C-N 121.62 -0.675 . . . . 0.0 111.741 -179.472 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 19.6 t80 -53.03 -25.76 13.48 Favored 'General case' 0 CA--C 1.536 0.415 0 C-N-CA 123.902 0.881 . . . . 0.0 112.897 169.668 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 67' ' ' GLN . . . . . . . . . . . . . 73.2 mm-40 -55.81 -24.75 37.92 Favored 'General case' 0 CA--C 1.538 0.492 0 O-C-N 120.785 -1.197 . . . . 0.0 112.435 171.795 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 74.0 t -61.01 -33.98 58.02 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.547 0 O-C-N 121.086 -1.009 . . . . 0.0 110.339 170.467 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 14.1 tp -73.07 -39.82 65.55 Favored 'General case' 0 C--O 1.225 -0.223 0 O-C-N 120.885 -1.134 . . . . 0.0 108.15 176.494 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 70' ' ' VAL . . . . . . . . . . . . . 40.9 t . . . . . 0 CA--C 1.539 0.544 0 O-C-N 121.939 -0.475 . . . . 0.0 110.54 173.159 . . . . . . . . 0 0 . 1 . 013 nuclear build core ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 82.2 Cg_exo . . . . . 0 N--CA 1.456 -0.726 0 N-CA-C 111.621 -0.184 . . . . 0.0 111.621 . . . . . . . . . 0 0 . 1 . 013 nuclear build core ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 3.1 mp0 -59.39 -50.83 72.43 Favored 'General case' 0 N--CA 1.454 -0.229 0 C-N-CA 123.817 0.847 . . . . 0.0 112.154 176.236 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 15.3 tp10 -57.96 -46.89 84.4 Favored 'General case' 0 N--CA 1.454 -0.239 0 N-CA-C 108.211 -1.033 . . . . 0.0 108.211 178.502 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 25.8 mt -59.59 -37.83 79.6 Favored 'General case' 0 N--CA 1.445 -0.712 0 C-N-CA 124.216 1.007 . . . . 0.0 111.831 179.266 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 1.2 tmtm? -61.86 -48.0 82.51 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 118.843 0.747 . . . . 0.0 109.949 171.94 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . -54.77 -54.67 31.76 Favored Glycine 0 CA--C 1.528 0.867 0 N-CA-C 110.49 -1.044 . . . . 0.0 110.49 178.758 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 9' ' ' ILE . . . . . . . . . . . . . 72.9 mt -50.98 -54.26 11.1 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.184 0 C-N-CA 125.278 1.431 . . . . 0.0 109.967 172.781 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 10' ' ' PHE . . . . . . . . . . . . . 29.5 t80 -51.97 -49.79 62.54 Favored 'General case' 0 N--CA 1.447 -0.609 0 O-C-N 121.715 -0.616 . . . . 0.0 109.719 -176.863 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 54.8 mt-10 -61.85 -53.05 61.18 Favored 'General case' 0 N--CA 1.457 -0.082 0 N-CA-C 110.292 -0.262 . . . . 0.0 110.292 178.847 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 48.9 tttp -44.24 -53.71 6.36 Favored 'General case' 0 C--O 1.227 -0.124 0 C-N-CA 124.52 1.128 . . . . 0.0 110.586 178.064 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 41.8 m-85 -77.4 -41.28 40.63 Favored 'General case' 0 N--CA 1.454 -0.273 0 CA-C-O 119.629 -0.224 . . . . 0.0 111.491 -173.909 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -58.7 -58.73 7.29 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-O 120.848 0.356 . . . . 0.0 110.847 179.036 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.531 0.222 0 C-N-CA 125.121 1.368 . . . . 0.0 113.111 -169.941 . . . . . . . . 0 0 . 1 . 013 nuclear build core ' A' A ' 20' ' ' PRO . . . . . . . . . . . . . 12.9 Cg_endo . . . . . 0 CA--C 1.537 0.657 0 N-CA-C 114.145 0.787 . . . . 0.0 114.145 . . . . . . . . . 0 0 . 1 . 013 nuclear build core ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 44.1 m-80 -88.38 -5.67 58.16 Favored 'General case' 0 CA--C 1.535 0.381 0 C-N-CA 124.912 1.285 . . . . 0.0 113.186 -177.214 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 37.4 tt0 -148.64 119.57 7.64 Favored 'General case' 0 CA--C 1.539 0.556 0 CA-C-N 118.797 0.726 . . . . 0.0 112.82 -169.446 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 69.5 mt -88.98 133.91 34.16 Favored 'General case' 0 C--N 1.343 0.312 0 C-N-CA 124.139 0.976 . . . . 0.0 112.544 -175.529 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 27.9 p -77.83 171.71 14.56 Favored 'General case' 0 C--O 1.235 0.29 0 C-N-CA 123.626 0.77 . . . . 0.0 109.457 168.268 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 97.8 mttt -57.99 -46.76 84.67 Favored 'General case' 0 N--CA 1.454 -0.237 0 N-CA-C 110.156 -0.313 . . . . 0.0 110.156 174.245 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 27.4 tp10 -65.08 -44.45 88.86 Favored 'General case' 0 N--CA 1.453 -0.283 0 CA-C-O 120.89 0.376 . . . . 0.0 110.34 -176.895 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 21.1 mt-10 -56.1 -49.51 73.64 Favored 'General case' 0 CA--C 1.536 0.433 0 N-CA-C 109.443 -0.577 . . . . 0.0 109.443 175.289 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 10.2 mt -55.75 -41.88 74.62 Favored 'General case' 0 CA--C 1.514 -0.405 0 N-CA-C 113.324 0.861 . . . . 0.0 113.324 171.661 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 89.1 tttt -59.81 -53.29 59.65 Favored 'General case' 0 C--N 1.323 -0.566 0 CA-C-N 118.737 0.699 . . . . 0.0 109.8 -178.637 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 82.9 mt -58.27 -46.78 85.39 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.968 178.875 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 6.4 tt -51.15 -57.65 8.19 Favored 'General case' 0 C--N 1.332 -0.156 0 C-N-CA 123.836 0.854 . . . . 0.0 109.9 175.415 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 40.0 mt -54.73 -55.13 33.21 Favored 'General case' 0 C--N 1.331 -0.196 0 C-N-CA 124.27 1.028 . . . . 0.0 109.724 -178.433 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 24.2 mt-30 -53.13 -50.95 63.46 Favored 'General case' 0 N--CA 1.454 -0.245 0 C-N-CA 123.484 0.714 . . . . 0.0 111.343 -177.556 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 1.6 m -73.54 -51.15 17.99 Favored 'General case' 0 CA--C 1.532 0.264 0 C-N-CA 120.174 -0.61 . . . . 0.0 111.322 -173.898 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 45.0 mm-40 -94.4 -29.62 14.89 Favored 'General case' 0 N--CA 1.449 -0.5 0 N-CA-C 113.622 0.971 . . . . 0.0 113.622 -166.123 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 75.4 m-85 . . . . . 0 CA--C 1.534 0.365 0 N-CA-C 113.053 0.76 . . . . 0.0 113.053 -173.249 . . . . . . . . 0 0 . 1 . 013 nuclear build core ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 18.8 mt . . . . . 0 N--CA 1.451 -0.375 0 N-CA-C 108.275 -1.009 . . . . 0.0 108.275 . . . . . . . . . 0 0 . 1 . 013 nuclear build core ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 5.7 m-20 -58.38 -49.07 78.57 Favored 'General case' 0 N--CA 1.447 -0.595 0 CA-C-N 115.006 -0.997 . . . . 0.0 111.39 178.503 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 51.0 mt-10 -57.9 -50.64 72.65 Favored 'General case' 0 C--N 1.333 -0.125 0 CA-C-N 117.379 0.081 . . . . 0.0 110.931 175.962 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 81.6 mt -57.64 -48.34 79.73 Favored 'General case' 0 CA--C 1.531 0.22 0 CA-C-O 121.376 0.608 . . . . 0.0 109.926 -179.936 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 50' ' ' PHE . . . . . . . . . . . . . 54.6 t80 -55.03 -53.29 57.75 Favored 'General case' 0 N--CA 1.45 -0.466 0 C-N-CA 123.882 0.873 . . . . 0.0 109.879 178.965 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 42.8 tt0 -57.51 -45.74 84.62 Favored 'General case' 0 N--CA 1.454 -0.264 0 C-N-CA 122.895 0.478 . . . . 0.0 110.771 179.503 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 8.5 tm-20 -55.99 -45.97 78.83 Favored 'General case' 0 N--CA 1.454 -0.264 0 C-N-CA 122.998 0.519 . . . . 0.0 110.308 179.433 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 95.8 mt -78.25 -38.21 43.38 Favored 'General case' 0 CA--C 1.533 0.299 0 N-CA-C 112.592 0.59 . . . . 0.0 112.592 -175.364 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 27.5 t0 . . . . . 0 C--N 1.33 -0.274 0 C-N-CA 126.876 2.07 . . . . 0.0 109.674 177.607 . . . . . . . . 0 0 . 1 . 013 nuclear build core ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 62.4 mt-10 . . . . . 0 N--CA 1.456 -0.157 0 N-CA-C 108.906 -0.775 . . . . 0.0 108.906 . . . . . . . . . 0 0 . 1 . 013 nuclear build core ' A' A ' 61' ' ' VAL . . . . . . . . . . . . . 2.8 t -83.87 109.77 17.76 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.203 0 O-C-N 122.221 -0.3 . . . . 0.0 111.585 -165.814 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 1.7 m -77.78 153.47 32.82 Favored 'General case' 0 CA--C 1.534 0.352 0 C-N-CA 124.123 0.969 . . . . 0.0 110.741 -177.586 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 63' ' ' PHE . . . . . . . . . . . . . 69.1 t80 -55.31 -38.69 69.0 Favored 'General case' 0 N--CA 1.468 0.472 0 N-CA-C 113.072 0.767 . . . . 0.0 113.072 -174.336 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 12.5 tp10 -61.92 -59.92 4.4 Favored 'General case' 0 CA--C 1.534 0.33 0 O-C-N 121.994 -0.441 . . . . 0.0 110.012 179.865 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 16.6 pt-20 -59.35 -36.19 75.25 Favored 'General case' 0 CA--C 1.535 0.388 0 O-C-N 121.394 -0.816 . . . . 0.0 111.798 179.739 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 23.7 t80 -51.94 -26.24 9.97 Favored 'General case' 0 CA--C 1.54 0.578 0 C-N-CA 123.788 0.835 . . . . 0.0 112.408 171.682 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 67' ' ' GLN . . . . . . . . . . . . . 36.2 mm-40 -53.23 -27.84 24.12 Favored 'General case' 0 CA--C 1.54 0.567 0 O-C-N 120.985 -1.072 . . . . 0.0 113.117 172.625 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 85.8 t -56.22 -30.58 30.21 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.436 0 C-N-CA 122.966 0.506 . . . . 0.0 110.967 173.206 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 16.8 tp -78.17 -51.32 10.4 Favored 'General case' 0 N--CA 1.455 -0.178 0 N-CA-C 109.221 -0.659 . . . . 0.0 109.221 170.664 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 70' ' ' VAL . . . . . . . . . . . . . 84.4 t . . . . . 0 N--CA 1.463 0.22 0 C-N-CA 122.88 0.472 . . . . 0.0 111.591 -175.695 . . . . . . . . 0 0 . 1 . 014 nuclear build core ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 83.9 Cg_exo . . . . . 0 N--CA 1.456 -0.692 0 N-CA-C 112.322 0.085 . . . . 0.0 112.322 . . . . . . . . . 0 0 . 1 . 014 nuclear build core ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 3.1 mp0 -62.54 -48.66 78.52 Favored 'General case' 0 CA--C 1.53 0.202 0 C-N-CA 123.793 0.837 . . . . 0.0 111.917 175.966 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 9.6 tm-20 -60.33 -44.47 95.46 Favored 'General case' 0 CA--C 1.53 0.206 0 N-CA-C 108.739 -0.837 . . . . 0.0 108.739 178.074 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 6' ' ' LEU . . . . . 0.421 HD13 HG22 ' A' ' 70' ' ' VAL . 14.5 mt -60.98 -37.18 81.56 Favored 'General case' 0 N--CA 1.447 -0.6 0 C-N-CA 123.614 0.766 . . . . 0.0 112.568 175.803 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 54.5 tptt -59.24 -47.45 85.29 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 119.232 0.924 . . . . 0.0 109.724 169.752 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . -51.18 -54.21 24.27 Favored Glycine 0 CA--C 1.531 1.072 0 N-CA-C 110.696 -0.962 . . . . 0.0 110.696 176.793 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 9' ' ' ILE . . . . . . . . . . . . . 4.2 mm -54.56 -56.12 11.85 Favored 'Isoleucine or valine' 0 CA--C 1.529 0.166 0 C-N-CA 125.063 1.345 . . . . 0.0 109.321 175.99 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 10' ' ' PHE . . . . . . . . . . . . . 23.2 t80 -49.56 -49.33 46.75 Favored 'General case' 0 N--CA 1.444 -0.753 0 C-N-CA 123.612 0.765 . . . . 0.0 109.772 -178.65 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 52.1 mt-10 -63.35 -48.77 76.55 Favored 'General case' 0 N--CA 1.453 -0.288 0 C-N-CA 123.504 0.722 . . . . 0.0 110.613 179.638 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 64.6 tttt -44.39 -51.84 8.25 Favored 'General case' 0 CA--C 1.53 0.21 0 C-N-CA 123.893 0.877 . . . . 0.0 110.756 176.592 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 83.0 m-85 -80.68 -38.54 28.81 Favored 'General case' 0 CA--C 1.533 0.295 0 N-CA-C 112.379 0.511 . . . . 0.0 112.379 -176.723 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -69.05 -52.63 26.52 Favored 'General case' 0 C--N 1.333 -0.147 0 C-N-CA 123.552 0.741 . . . . 0.0 111.757 -176.908 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.332 -0.188 0 C-N-CA 124.124 0.97 . . . . 0.0 112.255 -178.57 . . . . . . . . 0 0 . 1 . 014 nuclear build core ' A' A ' 20' ' ' PRO . . . . . . . . . . . . . 11.1 Cg_endo . . . . . 0 CA--C 1.537 0.649 0 N-CA-C 114.538 0.938 . . . . 0.0 114.538 . . . . . . . . . 0 0 . 1 . 014 nuclear build core ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 49.2 m-80 -96.56 -1.17 47.6 Favored 'General case' 0 CA--C 1.533 0.3 0 C-N-CA 124.956 1.302 . . . . 0.0 113.314 -177.743 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 30.7 tt0 -141.51 116.98 10.21 Favored 'General case' 0 CA--C 1.538 0.514 0 C-N-CA 123.869 0.868 . . . . 0.0 112.579 -176.712 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 46.9 mt -90.56 136.74 32.87 Favored 'General case' 0 C--N 1.342 0.26 0 C-N-CA 124.564 1.145 . . . . 0.0 110.857 179.875 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 98.0 p -78.5 168.05 20.37 Favored 'General case' 0 CA--C 1.532 0.273 0 N-CA-C 108.572 -0.899 . . . . 0.0 108.572 167.133 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 1.1 ttmp? -59.11 -38.12 78.8 Favored 'General case' 0 CA--C 1.535 0.395 0 O-C-N 122.017 -0.427 . . . . 0.0 110.739 177.985 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 26.9 mt-10 -68.24 -47.49 67.64 Favored 'General case' 0 N--CA 1.454 -0.23 0 CA-C-O 121.162 0.506 . . . . 0.0 110.516 -179.576 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 60.2 mt-10 -58.06 -43.94 87.22 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.027 -0.533 . . . . 0.0 109.814 176.183 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 12.3 mt -54.59 -47.37 73.42 Favored 'General case' 0 CA--C 1.507 -0.676 0 CA-C-N 118.387 0.54 . . . . 0.0 112.233 169.608 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 61.9 tttp -58.83 -47.59 84.31 Favored 'General case' 0 C--N 1.324 -0.531 0 CA-C-N 118.706 0.684 . . . . 0.0 109.876 -177.353 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 90.5 mt -59.75 -49.06 79.21 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.532 -0.304 . . . . 0.0 111.686 177.286 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 6.9 tt -50.62 -58.28 6.21 Favored 'General case' 0 N--CA 1.456 -0.148 0 C-N-CA 124.204 1.002 . . . . 0.0 109.327 175.545 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 42.8 mt -57.98 -52.35 65.87 Favored 'General case' 0 N--CA 1.451 -0.39 0 C-N-CA 123.86 0.864 . . . . 0.0 109.079 -176.291 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 23.6 tt0 -53.85 -51.03 64.92 Favored 'General case' 0 N--CA 1.453 -0.287 0 C-N-CA 123.639 0.776 . . . . 0.0 111.075 -178.204 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 11.4 m -75.65 -45.36 37.6 Favored 'General case' 0 N--CA 1.451 -0.381 0 CA-C-N 115.992 -0.549 . . . . 0.0 110.958 -171.583 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 74.0 mm-40 -94.57 -34.97 12.44 Favored 'General case' 0 N--CA 1.452 -0.357 0 C-N-CA 123.797 0.839 . . . . 0.0 112.406 -169.355 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 73.9 m-85 . . . . . 0 CA--C 1.541 0.606 0 C-N-CA 123.832 0.853 . . . . 0.0 113.108 -169.875 . . . . . . . . 0 0 . 1 . 014 nuclear build core ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 57.4 tp . . . . . 0 CA--C 1.528 0.118 0 CA-C-O 120.984 0.421 . . . . 0.0 110.709 . . . . . . . . . 0 0 . 1 . 014 nuclear build core ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 4.8 m-20 -59.59 -54.04 51.15 Favored 'General case' 0 N--CA 1.45 -0.459 0 C-N-CA 123.905 0.882 . . . . 0.0 110.932 179.252 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 37.0 mt-10 -55.13 -48.52 73.55 Favored 'General case' 0 C--N 1.332 -0.191 0 CA-C-N 116.492 -0.322 . . . . 0.0 110.547 176.262 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 54.9 tp -56.39 -49.79 73.47 Favored 'General case' 0 C--N 1.331 -0.206 0 C-N-CA 123.035 0.534 . . . . 0.0 109.863 -179.904 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 50' ' ' PHE . . . . . . . . . . . . . 59.9 t80 -51.8 -50.42 60.82 Favored 'General case' 0 N--CA 1.453 -0.305 0 C-N-CA 124.041 0.936 . . . . 0.0 110.3 177.69 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 56.9 mm-40 -59.3 -47.5 85.14 Favored 'General case' 0 CA--C 1.534 0.364 0 CA-C-N 117.923 0.329 . . . . 0.0 111.627 175.373 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 39.8 mt-10 -54.81 -36.92 65.47 Favored 'General case' 0 CA--C 1.529 0.137 0 C-N-CA 123.375 0.67 . . . . 0.0 111.688 178.689 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 53.2 mt -75.21 -57.37 3.94 Favored 'General case' 0 N--CA 1.447 -0.611 0 CA-C-N 117.905 0.32 . . . . 0.0 110.626 174.808 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 33.2 t0 . . . . . 0 CA--C 1.536 0.436 0 C-N-CA 124.612 1.165 . . . . 0.0 110.89 -178.947 . . . . . . . . 0 0 . 1 . 014 nuclear build core ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 33.4 mt-10 . . . . . 0 N--CA 1.454 -0.231 0 N-CA-C 105.731 -1.952 . . . . 0.0 105.731 . . . . . . . . . 0 0 . 1 . 014 nuclear build core ' A' A ' 61' ' ' VAL . . . . . . . . . . . . . 25.4 t -109.94 114.63 47.53 Favored 'Isoleucine or valine' 0 N--CA 1.461 0.092 0 N-CA-C 109.419 -0.585 . . . . 0.0 109.419 -179.91 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 2.8 m -78.83 159.21 27.94 Favored 'General case' 0 CA--C 1.535 0.387 0 C-N-CA 123.519 0.728 . . . . 0.0 110.85 176.548 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 63' ' ' PHE . . . . . . . . . . . . . 73.8 t80 -59.17 -31.39 68.95 Favored 'General case' 0 CA--C 1.534 0.329 0 O-C-N 121.036 -1.04 . . . . 0.0 113.341 -176.996 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 29.3 mp0 -68.86 -62.95 1.16 Allowed 'General case' 0 N--CA 1.451 -0.403 0 N-CA-C 108.958 -0.756 . . . . 0.0 108.958 -177.595 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 1.5 pt-20 -59.68 -32.86 70.89 Favored 'General case' 0 CA--C 1.538 0.512 0 O-C-N 121.623 -0.673 . . . . 0.0 112.037 178.0 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 18.5 t80 -48.69 -29.84 4.86 Favored 'General case' 0 CA--C 1.537 0.467 0 O-C-N 121.429 -0.795 . . . . 0.0 112.741 169.194 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 67' ' ' GLN . . . . . . . . . . . . . 69.5 mm-40 -54.63 -22.29 13.09 Favored 'General case' 0 CA--C 1.539 0.543 0 CA-C-N 119.557 1.071 . . . . 0.0 112.872 174.685 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 76.2 t -55.49 -35.54 38.22 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.516 0 CA-C-N 119.751 1.159 . . . . 0.0 110.655 171.166 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 24.6 tp -71.95 -45.47 60.97 Favored 'General case' 0 N--CA 1.454 -0.26 0 N-CA-C 107.286 -1.376 . . . . 0.0 107.286 179.129 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 70' ' ' VAL . . . . . 0.421 HG22 HD13 ' A' ' 6' ' ' LEU . 23.4 t . . . . . 0 CA--C 1.534 0.341 0 C-N-CA 123.036 0.535 . . . . 0.0 110.37 178.708 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 86.7 Cg_exo . . . . . 0 N--CA 1.456 -0.68 0 CA-C-O 120.402 0.084 . . . . 0.0 111.982 . . . . . . . . . 0 0 . 1 . 015 nuclear build core ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 48.0 mt-10 -61.5 -49.54 76.34 Favored 'General case' 0 N--CA 1.456 -0.149 0 C-N-CA 123.587 0.755 . . . . 0.0 111.114 176.501 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 37.8 mm-40 -59.59 -47.18 86.59 Favored 'General case' 0 C--O 1.225 -0.204 0 N-CA-C 109.044 -0.724 . . . . 0.0 109.044 177.638 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 47.5 mt -58.29 -39.66 79.88 Favored 'General case' 0 N--CA 1.447 -0.589 0 C-N-CA 123.462 0.705 . . . . 0.0 111.802 178.857 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 21.8 tptm -61.62 -49.26 77.3 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 118.626 0.648 . . . . 0.0 110.744 171.673 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . -53.61 -52.17 43.57 Favored Glycine 0 CA--C 1.529 0.932 0 N-CA-C 110.272 -1.131 . . . . 0.0 110.272 -179.666 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 9' ' ' ILE . . . . . . . . . . . . . 80.3 mt -53.37 -56.41 8.49 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.245 0 C-N-CA 126.464 1.906 . . . . 0.0 109.704 172.442 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 10' ' ' PHE . . . . . . . . . . . . . 42.1 t80 -49.34 -49.66 43.24 Favored 'General case' 0 N--CA 1.447 -0.586 0 O-C-N 121.82 -0.55 . . . . 0.0 109.618 -178.144 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 52.4 mt-10 -63.65 -51.45 65.12 Favored 'General case' 0 CA--C 1.532 0.25 0 C-N-CA 123.165 0.586 . . . . 0.0 110.801 179.3 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 43.9 tttp -44.79 -51.23 9.64 Favored 'General case' 0 N--CA 1.461 0.113 0 C-N-CA 125.026 1.33 . . . . 0.0 110.909 177.163 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 57.2 m-85 -78.39 -47.37 17.74 Favored 'General case' 0 N--CA 1.448 -0.525 0 CA-C-N 116.362 -0.381 . . . . 0.0 110.355 -175.664 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -54.89 -38.14 67.19 Favored 'General case' 0 C--N 1.331 -0.204 0 C-N-CA 124.21 1.004 . . . . 0.0 112.418 179.218 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.533 0.289 0 O-C-N 121.737 -0.602 . . . . 0.0 111.835 174.157 . . . . . . . . 0 0 . 1 . 015 nuclear build core ' A' A ' 20' ' ' PRO . . . . . . . . . . . . . 32.5 Cg_endo . . . . . 0 N--CA 1.458 -0.578 0 N-CA-C 112.735 0.244 . . . . 0.0 112.735 . . . . . . . . . 0 0 . 1 . 015 nuclear build core ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 43.2 m-80 -83.13 -4.51 58.45 Favored 'General case' 0 N--CA 1.451 -0.39 0 C-N-CA 124.35 1.06 . . . . 0.0 112.884 -177.268 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 26.3 tt0 -145.58 132.4 20.09 Favored 'General case' 0 CA--C 1.54 0.561 0 CA-C-N 119.699 1.136 . . . . 0.0 113.182 -168.771 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 84.7 mt -104.06 133.86 48.29 Favored 'General case' 0 C--N 1.342 0.257 0 C-N-CA 125.591 1.557 . . . . 0.0 110.804 176.941 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 82.4 p -79.77 175.63 10.45 Favored 'General case' 0 N--CA 1.452 -0.356 0 C-N-CA 123.76 0.824 . . . . 0.0 109.017 168.481 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 97.8 mttt -55.46 -46.3 76.82 Favored 'General case' 0 N--CA 1.455 -0.189 0 O-C-N 122.059 -0.401 . . . . 0.0 110.023 170.168 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 19.3 tp10 -64.96 -46.79 80.09 Favored 'General case' 0 N--CA 1.451 -0.422 0 CA-C-O 120.7 0.286 . . . . 0.0 110.353 -175.961 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -58.6 -44.08 89.78 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-O 118.806 -0.616 . . . . 0.0 110.45 175.822 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 14.2 mt -56.27 -44.58 79.88 Favored 'General case' 0 CA--C 1.509 -0.6 0 CA-C-N 119.273 0.942 . . . . 0.0 112.539 170.484 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 61.7 tttm -59.96 -49.66 76.81 Favored 'General case' 0 N--CA 1.449 -0.525 0 CA-C-N 118.572 0.624 . . . . 0.0 109.555 -177.849 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 9.2 mp -57.83 -49.64 75.98 Favored 'General case' 0 C--N 1.329 -0.292 0 C-N-CA 122.312 0.245 . . . . 0.0 111.376 177.591 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 7.3 tt -50.23 -57.79 7.04 Favored 'General case' 0 C--N 1.332 -0.166 0 C-N-CA 123.957 0.903 . . . . 0.0 109.552 176.051 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 38.0 mt -59.35 -49.15 78.92 Favored 'General case' 0 C--O 1.222 -0.376 0 C-N-CA 123.513 0.725 . . . . 0.0 109.622 -176.747 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 24.6 tt0 -56.96 -45.84 82.57 Favored 'General case' 0 N--CA 1.452 -0.349 0 C-N-CA 124.222 1.009 . . . . 0.0 110.885 -176.911 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 2.6 m -75.77 -52.34 10.65 Favored 'General case' 0 CA--C 1.533 0.318 0 C-N-CA 120.961 -0.296 . . . . 0.0 110.879 -177.107 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 58.4 mm-40 -90.15 -28.18 19.1 Favored 'General case' 0 N--CA 1.449 -0.483 0 N-CA-C 113.093 0.775 . . . . 0.0 113.093 -166.687 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 76.9 m-85 . . . . . 0 CA--C 1.538 0.518 0 C-N-CA 123.965 0.906 . . . . 0.0 112.949 -173.252 . . . . . . . . 0 0 . 1 . 015 nuclear build core ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 62.9 tp . . . . . 0 N--CA 1.454 -0.247 0 CA-C-O 120.697 0.284 . . . . 0.0 111.078 . . . . . . . . . 0 0 . 1 . 015 nuclear build core ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 6.0 m-20 -57.81 -54.75 43.41 Favored 'General case' 0 N--CA 1.451 -0.416 0 C-N-CA 123.792 0.837 . . . . 0.0 111.008 178.279 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 46.0 mt-10 -54.31 -47.77 72.07 Favored 'General case' 0 C--N 1.332 -0.158 0 CA-C-N 116.802 -0.181 . . . . 0.0 110.868 177.739 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 48.7 tp -60.4 -48.26 82.51 Favored 'General case' 0 N--CA 1.453 -0.315 0 CA-C-O 121.348 0.594 . . . . 0.0 109.632 -179.411 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 50' ' ' PHE . . . . . . . . . . . . . 59.2 t80 -53.98 -49.31 69.1 Favored 'General case' 0 N--CA 1.449 -0.483 0 C-N-CA 123.331 0.653 . . . . 0.0 110.266 178.848 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 34.7 mt-10 -60.9 -43.34 98.67 Favored 'General case' 0 N--CA 1.455 -0.209 0 C-N-CA 122.719 0.408 . . . . 0.0 110.996 177.648 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 32.7 tt0 -52.74 -42.31 64.79 Favored 'General case' 0 CA--C 1.529 0.172 0 C-N-CA 122.933 0.493 . . . . 0.0 110.708 176.456 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 82.1 mt -75.36 -63.12 1.35 Allowed 'General case' 0 N--CA 1.45 -0.471 0 C-N-CA 123.062 0.545 . . . . 0.0 111.229 179.046 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 29.4 t70 . . . . . 0 C--N 1.332 -0.181 0 C-N-CA 125.406 1.482 . . . . 0.0 108.711 -179.207 . . . . . . . . 0 0 . 1 . 015 nuclear build core ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 45.7 mt-10 . . . . . 0 N--CA 1.454 -0.24 0 N-CA-C 106.637 -1.616 . . . . 0.0 106.637 . . . . . . . . . 0 0 . 1 . 015 nuclear build core ' A' A ' 61' ' ' VAL . . . . . . . . . . . . . 73.0 t -111.59 106.56 21.0 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.236 0 C-N-CA 122.742 0.417 . . . . 0.0 110.161 -169.541 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 53.8 p -82.56 160.73 22.49 Favored 'General case' 0 CA--C 1.539 0.544 0 C-N-CA 123.875 0.87 . . . . 0.0 111.343 173.557 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 63' ' ' PHE . . . . . . . . . . . . . 49.7 t80 -51.16 -49.93 59.93 Favored 'General case' 0 N--CA 1.468 0.426 0 O-C-N 121.422 -0.799 . . . . 0.0 111.417 -173.921 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 12.5 pt-20 -53.26 -28.57 28.28 Favored 'General case' 0 CA--C 1.534 0.342 0 C-N-CA 124.654 1.181 . . . . 0.0 114.145 -178.373 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 14.3 pt-20 -100.15 -30.25 12.04 Favored 'General case' 0 CA--C 1.529 0.167 0 C-N-CA 123.593 0.757 . . . . 0.0 110.432 177.88 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 5.3 t80 -52.62 -32.42 41.6 Favored 'General case' 0 CA--C 1.535 0.372 0 O-C-N 121.412 -0.805 . . . . 0.0 110.121 167.687 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 67' ' ' GLN . . . . . . . . . . . . . 2.1 mp0 -46.44 -34.66 4.9 Favored 'General case' 0 CA--C 1.538 0.507 0 N-CA-C 113.747 1.018 . . . . 0.0 113.747 169.15 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 77.1 t -61.23 -29.54 46.04 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.541 0 CA-C-N 119.104 0.865 . . . . 0.0 110.667 175.945 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 1.4 tt -71.98 -50.69 26.65 Favored 'General case' 0 N--CA 1.455 -0.188 0 N-CA-C 106.447 -1.686 . . . . 0.0 106.447 178.14 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 70' ' ' VAL . . . . . . . . . . . . . 18.3 t . . . . . 0 CA--C 1.535 0.389 0 C-N-CA 122.819 0.448 . . . . 0.0 110.175 177.701 . . . . . . . . 0 0 . 1 . 016 nuclear build core ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 80.0 Cg_exo . . . . . 0 N--CA 1.456 -0.702 0 N-CA-C 112.378 0.107 . . . . 0.0 112.378 . . . . . . . . . 0 0 . 1 . 016 nuclear build core ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 2.8 mp0 -59.82 -49.35 78.07 Favored 'General case' 0 N--CA 1.456 -0.136 0 C-N-CA 123.956 0.902 . . . . 0.0 111.981 176.055 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 30.1 mt-10 -60.16 -45.44 93.06 Favored 'General case' 0 C--N 1.332 -0.188 0 N-CA-C 109.109 -0.7 . . . . 0.0 109.109 176.886 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 16.1 mt -61.52 -36.19 79.85 Favored 'General case' 0 N--CA 1.447 -0.579 0 C-N-CA 123.014 0.526 . . . . 0.0 112.28 179.17 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 55.8 tptt -61.31 -49.47 76.89 Favored 'General case' 0 C--N 1.329 -0.286 0 O-C-N 121.737 -0.602 . . . . 0.0 110.074 169.942 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . -50.65 -51.43 33.14 Favored Glycine 0 CA--C 1.531 1.067 0 N-CA-C 110.724 -0.95 . . . . 0.0 110.724 176.639 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 9' ' ' ILE . . . . . . . . . . . . . 3.4 mm -57.11 -55.53 20.0 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.197 0 C-N-CA 125.859 1.663 . . . . 0.0 109.417 176.628 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 10' ' ' PHE . . . . . . . . . . . . . 56.1 t80 -46.48 -52.22 13.66 Favored 'General case' 0 N--CA 1.45 -0.45 0 C-N-CA 123.49 0.716 . . . . 0.0 109.763 178.436 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 51.9 mt-10 -62.43 -50.87 69.78 Favored 'General case' 0 N--CA 1.454 -0.256 0 C-N-CA 123.214 0.606 . . . . 0.0 110.772 -179.614 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 18.1 ttmm -43.81 -53.76 5.73 Favored 'General case' 0 C--N 1.339 0.146 0 C-N-CA 124.657 1.183 . . . . 0.0 110.686 177.446 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 66.0 m-85 -78.24 -47.55 17.69 Favored 'General case' 0 N--CA 1.453 -0.32 0 C-N-CA 120.814 -0.355 . . . . 0.0 110.753 -175.922 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -52.84 -42.55 65.28 Favored 'General case' 0 C--N 1.329 -0.309 0 C-N-CA 123.493 0.717 . . . . 0.0 111.976 -179.116 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.332 -0.169 0 N-CA-C 113.367 0.877 . . . . 0.0 113.367 178.616 . . . . . . . . 0 0 . 1 . 016 nuclear build core ' A' A ' 20' ' ' PRO . . . . . . . . . . . . . 19.5 Cg_endo . . . . . 0 CA--C 1.535 0.555 0 N-CA-C 114.315 0.852 . . . . 0.0 114.315 . . . . . . . . . 0 0 . 1 . 016 nuclear build core ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 50.7 m-80 -84.9 -6.35 59.34 Favored 'General case' 0 CA--C 1.533 0.321 0 CA-C-O 118.321 -0.847 . . . . 0.0 112.833 -178.654 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 17.6 tt0 -152.11 118.69 5.68 Favored 'General case' 0 CA--C 1.537 0.444 0 CA-C-N 119.66 1.118 . . . . 0.0 113.664 -167.929 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 52.0 mt -83.72 131.34 34.93 Favored 'General case' 0 N--CA 1.453 -0.292 0 C-N-CA 123.935 0.894 . . . . 0.0 111.186 177.764 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 92.2 p -79.71 175.63 10.45 Favored 'General case' 0 CA--C 1.536 0.431 0 N-CA-C 108.339 -0.986 . . . . 0.0 108.339 167.06 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 63.4 mttp -57.14 -41.92 79.98 Favored 'General case' 0 C--N 1.34 0.161 0 O-C-N 121.772 -0.58 . . . . 0.0 110.017 170.932 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 1.7 mp0 -63.67 -52.19 61.8 Favored 'General case' 0 N--CA 1.452 -0.366 0 C-N-CA 123.142 0.577 . . . . 0.0 110.214 -177.317 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -58.44 -41.59 85.44 Favored 'General case' 0 CA--C 1.536 0.406 0 CA-C-N 115.8 -0.636 . . . . 0.0 109.642 177.881 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 12.1 mt -56.2 -43.7 78.75 Favored 'General case' 0 C--O 1.219 -0.515 0 CA-C-N 119.174 0.897 . . . . 0.0 112.859 169.286 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 59.2 tttp -61.99 -45.93 91.47 Favored 'General case' 0 C--N 1.322 -0.593 0 CA-C-N 119.075 0.852 . . . . 0.0 110.19 -177.192 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 4.4 mm? -60.17 -50.92 71.79 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.148 -0.478 . . . . 0.0 111.159 175.556 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 7.7 tt -51.17 -55.21 19.08 Favored 'General case' 0 C--N 1.333 -0.111 0 C-N-CA 123.575 0.75 . . . . 0.0 109.711 176.876 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 47.2 mt -55.7 -56.29 22.15 Favored 'General case' 0 N--CA 1.451 -0.385 0 C-N-CA 124.346 1.058 . . . . 0.0 109.67 -177.647 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 27.5 mt-30 -55.28 -51.54 66.34 Favored 'General case' 0 N--CA 1.457 -0.086 0 CA-C-N 117.943 0.338 . . . . 0.0 111.232 -177.868 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 5.7 m -72.81 -45.8 56.52 Favored 'General case' 0 N--CA 1.451 -0.402 0 CA-C-N 116.15 -0.477 . . . . 0.0 111.077 -170.016 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 69.6 mm-40 -98.99 -39.05 8.74 Favored 'General case' 0 N--CA 1.451 -0.423 0 C-N-CA 123.757 0.823 . . . . 0.0 112.886 -169.365 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 16.8 m-85 . . . . . 0 CA--C 1.531 0.235 0 C-N-CA 123.167 0.587 . . . . 0.0 111.505 -170.867 . . . . . . . . 0 0 . 1 . 016 nuclear build core ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 19.8 mt . . . . . 0 N--CA 1.453 -0.307 0 N-CA-C 108.773 -0.825 . . . . 0.0 108.773 . . . . . . . . . 0 0 . 1 . 016 nuclear build core ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 5.9 m-20 -60.25 -48.88 79.87 Favored 'General case' 0 N--CA 1.449 -0.523 0 CA-C-N 115.081 -0.963 . . . . 0.0 111.014 -179.448 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 7.9 tm-20 -64.79 -43.26 93.77 Favored 'General case' 0 N--CA 1.453 -0.317 0 N-CA-C 109.839 -0.43 . . . . 0.0 109.839 179.328 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 59.8 tp -57.34 -49.73 75.19 Favored 'General case' 0 C--N 1.333 -0.141 0 N-CA-C 109.657 -0.497 . . . . 0.0 109.657 176.829 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 50' ' ' PHE . . . . . . . . . . . . . 57.3 t80 -52.2 -46.24 65.54 Favored 'General case' 0 N--CA 1.452 -0.367 0 C-N-CA 124.043 0.937 . . . . 0.0 109.595 176.223 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 26.6 tt0 -56.66 -49.34 75.35 Favored 'General case' 0 N--CA 1.453 -0.299 0 CA-C-O 119.735 -0.174 . . . . 0.0 111.383 174.739 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 50.4 mt-10 -51.99 -47.92 64.65 Favored 'General case' 0 N--CA 1.465 0.3 0 CA-C-N 118.159 0.436 . . . . 0.0 111.353 177.582 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 80.8 mt -64.6 -55.51 19.86 Favored 'General case' 0 N--CA 1.452 -0.365 0 CA-C-O 121.269 0.557 . . . . 0.0 110.631 179.777 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 13.0 t70 . . . . . 0 N--CA 1.452 -0.333 0 C-N-CA 126.954 2.102 . . . . 0.0 108.992 -171.093 . . . . . . . . 0 0 . 1 . 016 nuclear build core ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 53.6 mt-10 . . . . . 0 N--CA 1.453 -0.325 0 N-CA-C 106.764 -1.569 . . . . 0.0 106.764 . . . . . . . . . 0 0 . 1 . 016 nuclear build core ' A' A ' 61' ' ' VAL . . . . . . . . . . . . . 90.1 t -109.54 102.12 13.55 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.273 0 N-CA-C 109.794 -0.447 . . . . 0.0 109.794 -170.634 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 98.7 p -77.99 170.73 16.11 Favored 'General case' 0 CA--C 1.539 0.556 0 C-N-CA 123.196 0.598 . . . . 0.0 110.609 173.193 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 63' ' ' PHE . . . . . . . . . . . . . 54.9 t80 -59.61 -41.56 90.64 Favored 'General case' 0 CA--C 1.531 0.227 0 O-C-N 121.661 -0.65 . . . . 0.0 112.572 -172.313 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 1.9 pp20? -59.08 -57.65 12.13 Favored 'General case' 0 CA--C 1.534 0.362 0 O-C-N 121.942 -0.474 . . . . 0.0 110.918 179.782 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 10.8 pt-20 -62.42 -35.13 78.26 Favored 'General case' 0 CA--C 1.535 0.372 0 O-C-N 121.694 -0.629 . . . . 0.0 111.599 179.296 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 14.2 t80 -49.81 -34.02 18.34 Favored 'General case' 0 CA--C 1.536 0.442 0 O-C-N 121.343 -0.848 . . . . 0.0 112.47 169.53 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 67' ' ' GLN . . . . . . . . . . . . . 98.9 mm-40 -60.39 -23.26 64.19 Favored 'General case' 0 CA--C 1.537 0.459 0 O-C-N 120.697 -1.252 . . . . 0.0 112.68 176.311 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 58.5 t -62.77 -29.43 47.03 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.502 0 O-C-N 120.918 -1.114 . . . . 0.0 110.215 170.69 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 1.8 tt -72.38 -46.3 55.92 Favored 'General case' 0 N--CA 1.457 -0.095 0 N-CA-C 106.769 -1.567 . . . . 0.0 106.769 177.571 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 70' ' ' VAL . . . . . . . . . . . . . 36.3 t . . . . . 0 CA--C 1.538 0.502 0 O-C-N 121.952 -0.468 . . . . 0.0 110.525 175.499 . . . . . . . . 0 0 . 1 . 017 nuclear build core ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 83.4 Cg_exo . . . . . 0 N--CA 1.458 -0.572 0 N-CA-C 113.001 0.346 . . . . 0.0 113.001 . . . . . . . . . 0 0 . 1 . 017 nuclear build core ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 3.0 mp0 -59.35 -47.87 83.78 Favored 'General case' 0 N--CA 1.455 -0.216 0 C-N-CA 123.934 0.894 . . . . 0.0 111.93 176.164 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 36.9 mt-10 -62.95 -43.97 97.35 Favored 'General case' 0 N--CA 1.453 -0.304 0 N-CA-C 109.349 -0.611 . . . . 0.0 109.349 178.41 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 47.7 mt -60.88 -39.7 90.22 Favored 'General case' 0 N--CA 1.45 -0.466 0 C-N-CA 123.386 0.674 . . . . 0.0 111.528 177.921 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 27.5 tptp -59.38 -46.17 89.43 Favored 'General case' 0 C--N 1.331 -0.215 0 O-C-N 121.806 -0.559 . . . . 0.0 110.348 170.05 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . -54.66 -53.51 38.61 Favored Glycine 0 CA--C 1.529 0.933 0 N-CA-C 110.338 -1.105 . . . . 0.0 110.338 179.129 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 9' ' ' ILE . . . . . . . . . . . . . 46.5 mt -51.33 -56.51 4.99 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.145 0 C-N-CA 125.641 1.576 . . . . 0.0 109.88 172.206 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 10' ' ' PHE . . . . . . . . . . . . . 49.1 t80 -49.24 -50.71 37.38 Favored 'General case' 0 N--CA 1.446 -0.673 0 N-CA-C 109.925 -0.398 . . . . 0.0 109.925 -178.438 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 57.3 mt-10 -61.99 -52.94 61.98 Favored 'General case' 0 CA--C 1.531 0.219 0 C-N-CA 122.444 0.298 . . . . 0.0 110.712 179.249 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 24.7 ttpt -43.32 -53.82 5.02 Favored 'General case' 0 C--N 1.339 0.126 0 C-N-CA 124.92 1.288 . . . . 0.0 110.736 178.645 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 66.6 m-85 -77.78 -47.63 18.5 Favored 'General case' 0 N--CA 1.45 -0.443 0 CA-C-N 116.578 -0.283 . . . . 0.0 110.408 -175.839 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -58.87 -37.18 75.95 Favored 'General case' 0 C--N 1.33 -0.275 0 O-C-N 121.417 -0.802 . . . . 0.0 112.743 -175.857 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.454 -0.269 0 N-CA-C 112.211 0.448 . . . . 0.0 112.211 176.464 . . . . . . . . 0 0 . 1 . 017 nuclear build core ' A' A ' 20' ' ' PRO . . . . . . . . . . . . . 16.5 Cg_endo . . . . . 0 CA--C 1.539 0.726 0 N-CA-C 113.519 0.546 . . . . 0.0 113.519 . . . . . . . . . 0 0 . 1 . 017 nuclear build core ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 37.0 m-80 -92.01 -4.1 54.95 Favored 'General case' 0 N--CA 1.454 -0.275 0 C-N-CA 124.694 1.197 . . . . 0.0 111.937 -178.025 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 7.4 tt0 -155.13 116.66 4.05 Favored 'General case' 0 CA--C 1.539 0.533 0 CA-C-N 118.838 0.744 . . . . 0.0 112.485 -168.392 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 26.0 mt -78.29 131.49 37.09 Favored 'General case' 0 N--CA 1.455 -0.191 0 C-N-CA 123.127 0.571 . . . . 0.0 111.352 -172.642 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -77.77 158.86 29.39 Favored 'General case' 0 CA--C 1.54 0.56 0 C-N-CA 126.377 1.871 . . . . 0.0 108.867 168.766 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 31.7 ttmt -60.28 -46.02 91.29 Favored 'General case' 0 CA--C 1.534 0.342 0 O-C-N 121.546 -0.721 . . . . 0.0 112.098 -170.471 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 57.6 mm-40 -65.61 -41.35 92.85 Favored 'General case' 0 N--CA 1.454 -0.241 0 CA-C-O 121.729 0.776 . . . . 0.0 110.199 -179.216 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 4.6 mp0 -57.79 -48.08 80.73 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-N 115.527 -0.76 . . . . 0.0 109.219 175.756 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 5.0 mt -52.91 -45.33 67.55 Favored 'General case' 0 C--O 1.219 -0.546 0 N-CA-C 113.097 0.777 . . . . 0.0 113.097 168.24 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 5.7 ttpm? -58.51 -50.96 71.85 Favored 'General case' 0 C--N 1.324 -0.505 0 CA-C-N 118.883 0.765 . . . . 0.0 110.636 -178.947 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 4.1 mm? -59.58 -46.78 87.92 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.169 -0.469 . . . . 0.0 111.212 177.766 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 6.8 tt -51.45 -58.17 6.99 Favored 'General case' 0 N--CA 1.455 -0.212 0 C-N-CA 124.031 0.933 . . . . 0.0 109.064 174.787 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 38.7 mt -54.02 -58.55 6.88 Favored 'General case' 0 C--N 1.33 -0.259 0 C-N-CA 123.708 0.803 . . . . 0.0 109.421 -178.021 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 5.7 tm0? -52.56 -53.55 44.8 Favored 'General case' 0 N--CA 1.453 -0.288 0 C-N-CA 123.514 0.726 . . . . 0.0 111.2 -177.401 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 11.1 m -73.24 -47.56 42.17 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.657 -0.247 . . . . 0.0 110.997 -171.105 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 69.3 mm-40 -90.69 -37.93 13.41 Favored 'General case' 0 N--CA 1.448 -0.548 0 C-N-CA 123.647 0.779 . . . . 0.0 112.021 -169.033 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 87.0 m-85 . . . . . 0 CA--C 1.531 0.247 0 C-N-CA 123.855 0.862 . . . . 0.0 111.784 -170.614 . . . . . . . . 0 0 . 1 . 017 nuclear build core ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 50.5 tp . . . . . 0 N--CA 1.454 -0.265 0 N-CA-C 109.909 -0.404 . . . . 0.0 109.909 . . . . . . . . . 0 0 . 1 . 017 nuclear build core ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 6.1 m-20 -57.28 -53.74 54.66 Favored 'General case' 0 N--CA 1.448 -0.563 0 C-N-CA 123.907 0.883 . . . . 0.0 111.08 177.28 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 14.7 tp10 -55.93 -49.17 74.24 Favored 'General case' 0 C--N 1.332 -0.193 0 N-CA-C 110.123 -0.325 . . . . 0.0 110.123 178.741 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 43.5 tp -59.41 -47.95 83.51 Favored 'General case' 0 CA--C 1.532 0.254 0 CA-C-O 121.304 0.573 . . . . 0.0 110.152 -179.882 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 50' ' ' PHE . . . . . . . . . . . . . 74.3 t80 -55.53 -49.05 73.66 Favored 'General case' 0 N--CA 1.451 -0.378 0 C-N-CA 124.165 0.986 . . . . 0.0 110.534 178.423 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 32.9 mt-10 -59.06 -49.29 78.44 Favored 'General case' 0 N--CA 1.455 -0.208 0 C-N-CA 123.217 0.607 . . . . 0.0 110.591 177.34 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 30.5 tp10 -53.92 -44.88 70.95 Favored 'General case' 0 N--CA 1.456 -0.167 0 C-N-CA 123.463 0.705 . . . . 0.0 110.977 178.544 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 95.1 mt -72.37 -47.53 48.72 Favored 'General case' 0 N--CA 1.45 -0.453 0 CA-C-O 120.802 0.334 . . . . 0.0 111.495 -179.767 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 37.7 t0 . . . . . 0 CA--C 1.533 0.303 0 C-N-CA 124.412 1.085 . . . . 0.0 110.267 -179.942 . . . . . . . . 0 0 . 1 . 017 nuclear build core ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 51.2 mt-10 . . . . . 0 CA--C 1.534 0.348 0 N-CA-C 106.15 -1.796 . . . . 0.0 106.15 . . . . . . . . . 0 0 . 1 . 017 nuclear build core ' A' A ' 61' ' ' VAL . . . . . . . . . . . . . 26.5 t -108.8 115.67 50.0 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.455 0 CA-C-N 118.706 0.685 . . . . 0.0 110.896 -175.833 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -78.92 150.85 32.0 Favored 'General case' 0 CA--C 1.537 0.45 0 C-N-CA 124.863 1.265 . . . . 0.0 111.362 179.411 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 63' ' ' PHE . . . . . . . . . . . . . 66.7 t80 -51.53 -44.7 62.71 Favored 'General case' 0 N--CA 1.468 0.427 0 O-C-N 121.446 -0.784 . . . . 0.0 112.586 -173.746 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 2.9 pm0 -59.77 -31.15 69.39 Favored 'General case' 0 N--CA 1.449 -0.524 0 N-CA-C 113.092 0.775 . . . . 0.0 113.092 -179.395 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 21.6 pt-20 -95.04 -27.65 15.51 Favored 'General case' 0 CA--C 1.531 0.222 0 CA-C-N 118.679 0.672 . . . . 0.0 110.797 179.001 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 9.5 t80 -53.21 -25.66 14.78 Favored 'General case' 0 CA--C 1.536 0.426 0 C-N-CA 123.6 0.76 . . . . 0.0 110.201 166.992 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 67' ' ' GLN . . . . . . . . . . . . . 66.4 mm-40 -51.58 -25.04 6.13 Favored 'General case' 0 CA--C 1.538 0.5 0 N-CA-C 113.633 0.975 . . . . 0.0 113.633 169.869 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 99.4 t -60.86 -33.06 53.9 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.556 0 CA-C-N 119.653 1.115 . . . . 0.0 110.735 172.136 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 10.5 tt -72.16 -46.16 57.53 Favored 'General case' 0 N--CA 1.457 -0.117 0 N-CA-C 107.056 -1.461 . . . . 0.0 107.056 176.694 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 70' ' ' VAL . . . . . . . . . . . . . 21.6 t . . . . . 0 CA--C 1.537 0.457 0 N-CA-C 110.272 -0.27 . . . . 0.0 110.272 176.775 . . . . . . . . 0 0 . 1 . 018 nuclear build core ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 82.6 Cg_exo . . . . . 0 CA--C 1.536 0.625 0 CA-C-O 120.688 0.203 . . . . 0.0 112.14 . . . . . . . . . 0 0 . 1 . 018 nuclear build core ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 42.3 tt0 -58.31 -53.84 53.74 Favored 'General case' 0 N--CA 1.455 -0.175 0 C-N-CA 123.777 0.831 . . . . 0.0 111.189 177.022 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 47.0 mm-40 -62.84 -40.95 99.01 Favored 'General case' 0 N--CA 1.452 -0.367 0 N-CA-C 109.149 -0.686 . . . . 0.0 109.149 -179.265 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 40.8 mt -59.49 -38.16 80.14 Favored 'General case' 0 N--CA 1.448 -0.558 0 C-N-CA 124.286 1.035 . . . . 0.0 111.896 176.609 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 23.2 tptm -60.66 -49.92 75.58 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-N 119.069 0.85 . . . . 0.0 110.712 169.982 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . -53.45 -52.96 37.82 Favored Glycine 0 CA--C 1.531 1.039 0 N-CA-C 110.519 -1.032 . . . . 0.0 110.519 -179.542 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 9' ' ' ILE . . . . . . . . . . . . . 78.3 mt -51.89 -57.25 3.83 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.259 0 C-N-CA 126.081 1.752 . . . . 0.0 109.935 172.044 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 10' ' ' PHE . . . . . . . . . . . . . 44.4 t80 -48.84 -50.03 36.47 Favored 'General case' 0 N--CA 1.446 -0.663 0 N-CA-C 109.239 -0.652 . . . . 0.0 109.239 -177.389 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 51.0 mt-10 -61.61 -53.25 58.67 Favored 'General case' 0 CA--C 1.532 0.268 0 C-N-CA 123.047 0.539 . . . . 0.0 110.717 178.709 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 1.4 ttpm? -45.14 -50.74 11.05 Favored 'General case' 0 C--N 1.34 0.167 0 C-N-CA 124.197 0.999 . . . . 0.0 110.979 178.075 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 54.6 m-85 -77.74 -52.87 8.26 Favored 'General case' 0 N--CA 1.448 -0.561 0 N-CA-C 110.072 -0.344 . . . . 0.0 110.072 -175.397 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -50.41 -37.67 38.99 Favored 'General case' 0 C--N 1.33 -0.253 0 C-N-CA 125.278 1.431 . . . . 0.0 112.762 -179.79 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.535 0.379 0 C-N-CA 123.309 0.644 . . . . 0.0 111.874 173.832 . . . . . . . . 0 0 . 1 . 018 nuclear build core ' A' A ' 20' ' ' PRO . . . . . . . . . . . . . 29.4 Cg_endo . . . . . 0 N--CA 1.461 -0.437 0 N-CA-C 113.365 0.486 . . . . 0.0 113.365 . . . . . . . . . 0 0 . 1 . 018 nuclear build core ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 42.7 m-80 -79.85 -4.92 54.29 Favored 'General case' 0 N--CA 1.45 -0.435 0 CA-C-O 117.849 -1.072 . . . . 0.0 112.74 -178.194 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 28.1 tt0 -147.57 135.08 20.83 Favored 'General case' 0 CA--C 1.539 0.536 0 CA-C-N 119.758 1.163 . . . . 0.0 113.385 -168.717 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 81.9 mt -104.17 133.12 49.63 Favored 'General case' 0 C--N 1.343 0.317 0 C-N-CA 125.171 1.389 . . . . 0.0 111.154 177.524 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 78.8 p -80.4 174.78 11.27 Favored 'General case' 0 CA--C 1.533 0.304 0 C-N-CA 123.876 0.87 . . . . 0.0 108.929 168.297 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 60.1 mttp -56.43 -40.97 75.64 Favored 'General case' 0 C--N 1.34 0.16 0 O-C-N 122.043 -0.411 . . . . 0.0 110.215 169.97 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 26.4 mt-10 -68.56 -47.1 67.7 Favored 'General case' 0 CA--C 1.517 -0.299 0 CA-C-O 120.813 0.339 . . . . 0.0 110.242 -175.764 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -56.97 -46.91 81.86 Favored 'General case' 0 N--CA 1.453 -0.312 0 CA-C-N 115.986 -0.552 . . . . 0.0 109.751 174.815 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 12.1 mt -56.27 -43.77 79.08 Favored 'General case' 0 CA--C 1.512 -0.518 0 CA-C-N 119.035 0.834 . . . . 0.0 112.988 171.827 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 65.1 tttm -61.58 -48.31 81.52 Favored 'General case' 0 C--N 1.323 -0.573 0 CA-C-N 118.672 0.669 . . . . 0.0 109.697 -176.726 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 92.0 mt -61.51 -46.7 88.86 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.232 -0.44 . . . . 0.0 111.3 177.763 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 7.1 tt -50.1 -58.16 6.13 Favored 'General case' 0 CA--C 1.521 -0.147 0 C-N-CA 124.213 1.005 . . . . 0.0 109.443 174.577 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 45.1 mt -57.68 -53.09 62.07 Favored 'General case' 0 N--CA 1.45 -0.433 0 N-CA-C 109.091 -0.707 . . . . 0.0 109.091 -178.332 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 25.5 tt0 -52.74 -47.13 67.62 Favored 'General case' 0 N--CA 1.453 -0.309 0 O-C-N 121.651 -0.656 . . . . 0.0 111.879 -177.41 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 2.5 m -75.46 -51.27 13.42 Favored 'General case' 0 CA--C 1.534 0.358 0 C-N-CA 121.058 -0.257 . . . . 0.0 111.144 -176.21 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 38.8 mm-40 -90.69 -31.25 16.67 Favored 'General case' 0 N--CA 1.451 -0.425 0 C-N-CA 123.6 0.76 . . . . 0.0 112.828 -166.724 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 82.2 m-85 . . . . . 0 CA--C 1.537 0.45 0 C-N-CA 124.863 1.265 . . . . 0.0 111.581 -172.801 . . . . . . . . 0 0 . 1 . 018 nuclear build core ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 20.3 mt . . . . . 0 C--O 1.223 -0.309 0 N-CA-C 108.645 -0.872 . . . . 0.0 108.645 . . . . . . . . . 0 0 . 1 . 018 nuclear build core ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 5.1 m-20 -52.28 -60.59 3.03 Favored 'General case' 0 N--CA 1.449 -0.504 0 C-N-CA 124.311 1.044 . . . . 0.0 110.32 176.161 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 34.2 tt0 -53.64 -46.54 70.56 Favored 'General case' 0 N--CA 1.455 -0.205 0 O-C-N 122.425 -0.172 . . . . 0.0 110.806 179.863 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 87.9 mt -56.38 -49.68 73.76 Favored 'General case' 0 C--O 1.224 -0.277 0 C-N-CA 121.069 -0.252 . . . . 0.0 110.384 176.632 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 50' ' ' PHE . . . . . . . . . . . . . 55.0 t80 -54.67 -51.61 64.94 Favored 'General case' 0 C--N 1.329 -0.319 0 C-N-CA 124.567 1.147 . . . . 0.0 110.45 -178.927 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 1.8 mp0 -56.13 -48.25 76.58 Favored 'General case' 0 CA--C 1.531 0.245 0 CA-C-O 120.641 0.258 . . . . 0.0 110.548 174.784 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 37.0 tt0 -55.23 -43.77 74.85 Favored 'General case' 0 N--CA 1.456 -0.155 0 C-N-CA 123.047 0.539 . . . . 0.0 111.437 -179.745 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 48.3 mt -65.64 -56.59 11.36 Favored 'General case' 0 N--CA 1.448 -0.573 0 N-CA-C 109.838 -0.43 . . . . 0.0 109.838 176.028 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 47.2 t0 . . . . . 0 CA--C 1.532 0.255 0 C-N-CA 123.856 0.862 . . . . 0.0 110.909 -174.601 . . . . . . . . 0 0 . 1 . 018 nuclear build core ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 50.9 mt-10 . . . . . 0 CA--C 1.529 0.149 0 N-CA-C 107.99 -1.115 . . . . 0.0 107.99 . . . . . . . . . 0 0 . 1 . 018 nuclear build core ' A' A ' 61' ' ' VAL . . . . . . . . . . . . . 5.5 t -112.18 106.13 20.15 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.295 0 CA-C-N 118.129 0.422 . . . . 0.0 111.017 -169.621 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 59.9 p -78.87 167.72 20.75 Favored 'General case' 0 CA--C 1.539 0.531 0 C-N-CA 122.995 0.518 . . . . 0.0 111.322 173.578 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 63' ' ' PHE . . . . . . . . . . . . . 57.2 t80 -60.93 -38.15 84.81 Favored 'General case' 0 CA--C 1.533 0.294 0 O-C-N 121.447 -0.783 . . . . 0.0 112.754 -172.81 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 1.9 pp20? -63.95 -56.66 13.52 Favored 'General case' 0 CA--C 1.536 0.408 0 O-C-N 121.8 -0.562 . . . . 0.0 111.061 -178.926 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 9.1 pt-20 -60.55 -36.86 79.46 Favored 'General case' 0 CA--C 1.537 0.443 0 O-C-N 121.425 -0.797 . . . . 0.0 111.408 176.805 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 21.5 t80 -52.32 -26.87 13.31 Favored 'General case' 0 CA--C 1.538 0.489 0 O-C-N 121.551 -0.718 . . . . 0.0 112.209 170.938 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 67' ' ' GLN . . . . . . . . . . . . . 58.6 mm-40 -55.04 -23.21 18.83 Favored 'General case' 0 CA--C 1.535 0.37 0 CA-C-N 119.768 1.167 . . . . 0.0 113.43 172.821 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 92.7 t -58.59 -32.95 47.19 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.555 0 CA-C-N 119.861 1.21 . . . . 0.0 110.468 171.428 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 22.1 tp -73.81 -48.43 31.42 Favored 'General case' 0 N--CA 1.453 -0.304 0 N-CA-C 107.404 -1.332 . . . . 0.0 107.404 176.976 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 70' ' ' VAL . . . . . . . . . . . . . 38.4 t . . . . . 0 CA--C 1.537 0.476 0 C-N-CA 122.543 0.337 . . . . 0.0 110.67 179.501 . . . . . . . . 0 0 . 1 . 019 nuclear build core ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 90.3 Cg_exo . . . . . 0 N--CA 1.455 -0.765 0 N-CA-C 112.972 0.335 . . . . 0.0 112.972 . . . . . . . . . 0 0 . 1 . 019 nuclear build core ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 19.0 mt-10 -67.58 -49.0 65.23 Favored 'General case' 0 N--CA 1.455 -0.18 0 CA-C-O 121.302 0.572 . . . . 0.0 110.273 -178.145 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 5.6 mp0 -65.51 -43.18 90.9 Favored 'General case' 0 N--CA 1.452 -0.353 0 N-CA-C 107.835 -1.172 . . . . 0.0 107.835 178.821 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 14.7 mt -57.2 -37.81 72.73 Favored 'General case' 0 N--CA 1.452 -0.341 0 N-CA-C 112.321 0.489 . . . . 0.0 112.321 177.012 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 55.7 tptt -61.83 -51.15 69.44 Favored 'General case' 0 C--N 1.332 -0.152 0 CA-C-N 118.873 0.76 . . . . 0.0 110.967 170.366 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . -52.51 -50.76 46.8 Favored Glycine 0 CA--C 1.531 1.051 0 N-CA-C 110.521 -1.032 . . . . 0.0 110.521 179.869 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 9' ' ' ILE . . . . . . . . . . . . . 88.0 mt -54.79 -54.75 20.26 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.298 0 C-N-CA 126.663 1.985 . . . . 0.0 109.923 173.745 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 10' ' ' PHE . . . . . . . . . . . . . 52.0 t80 -48.63 -52.8 21.29 Favored 'General case' 0 N--CA 1.453 -0.279 0 CA-C-N 118.29 0.495 . . . . 0.0 109.807 179.081 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 52.5 mt-10 -61.26 -52.69 63.7 Favored 'General case' 0 N--CA 1.455 -0.221 0 C-N-CA 123.075 0.55 . . . . 0.0 110.271 -177.986 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 25.9 ttpt -47.79 -57.74 5.23 Favored 'General case' 0 CA--C 1.53 0.191 0 C-N-CA 124.624 1.17 . . . . 0.0 110.838 177.409 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 38.6 m-85 -75.28 -34.62 61.35 Favored 'General case' 0 N--CA 1.45 -0.474 0 CA-C-O 119.193 -0.432 . . . . 0.0 110.522 -170.105 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -57.31 -63.95 1.05 Allowed 'General case' 0 N--CA 1.453 -0.299 0 N-CA-C 109.422 -0.585 . . . . 0.0 109.422 170.87 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.529 0.143 0 C-N-CA 125.311 1.445 . . . . 0.0 112.682 -177.154 . . . . . . . . 0 0 . 1 . 019 nuclear build core ' A' A ' 20' ' ' PRO . . . . . . . . . . . . . 11.9 Cg_endo . . . . . 0 CA--C 1.535 0.574 0 N-CA-C 114.824 1.048 . . . . 0.0 114.824 . . . . . . . . . 0 0 . 1 . 019 nuclear build core ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 58.0 m-80 -84.2 3.76 33.73 Favored 'General case' 0 CA--C 1.531 0.222 0 C-N-CA 124.008 0.923 . . . . 0.0 112.017 -178.021 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 0.7 OUTLIER -151.02 127.51 10.73 Favored 'General case' 0 N--CA 1.452 -0.368 0 O-C-N 121.395 -0.816 . . . . 0.0 112.629 -169.223 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 80.8 mt -93.44 129.43 39.61 Favored 'General case' 0 N--CA 1.452 -0.372 0 C-N-CA 122.883 0.473 . . . . 0.0 111.11 171.222 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 41.3 p -78.92 174.12 11.85 Favored 'General case' 0 CA--C 1.534 0.343 0 C-N-CA 124.255 1.022 . . . . 0.0 108.577 166.952 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 98.4 mttt -57.9 -44.84 87.0 Favored 'General case' 0 C--O 1.226 -0.153 0 O-C-N 121.837 -0.539 . . . . 0.0 110.483 172.408 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 24.3 mt-10 -66.73 -42.66 85.94 Favored 'General case' 0 N--CA 1.454 -0.253 0 CA-C-O 121.282 0.563 . . . . 0.0 110.168 -176.713 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 26.6 mt-10 -58.39 -49.42 77.31 Favored 'General case' 0 N--CA 1.451 -0.4 0 CA-C-N 115.738 -0.664 . . . . 0.0 109.211 176.152 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 10.7 mt -54.08 -42.73 69.65 Favored 'General case' 0 CA--C 1.512 -0.483 0 N-CA-C 113.28 0.845 . . . . 0.0 113.28 169.868 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 5.9 ttpm? -60.46 -53.04 62.33 Favored 'General case' 0 C--N 1.323 -0.554 0 CA-C-N 118.637 0.653 . . . . 0.0 109.845 -177.641 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 10.5 mp -59.16 -44.85 92.14 Favored 'General case' 0 C--O 1.235 0.301 0 CA-C-O 120.647 0.261 . . . . 0.0 111.294 178.433 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 6.5 tt -51.14 -57.89 7.56 Favored 'General case' 0 N--CA 1.456 -0.125 0 C-N-CA 123.682 0.793 . . . . 0.0 109.6 174.242 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 43.3 mt -54.86 -54.05 47.45 Favored 'General case' 0 N--CA 1.455 -0.203 0 C-N-CA 124.052 0.941 . . . . 0.0 109.956 -178.887 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 42.7 mt-30 -50.25 -53.11 30.61 Favored 'General case' 0 N--CA 1.457 -0.096 0 C-N-CA 123.098 0.559 . . . . 0.0 111.363 179.732 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 2.0 m -73.22 -49.64 26.83 Favored 'General case' 0 N--CA 1.454 -0.264 0 C-N-CA 120.28 -0.568 . . . . 0.0 111.259 -172.015 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 62.0 mm-40 -95.78 -31.02 13.39 Favored 'General case' 0 N--CA 1.449 -0.509 0 N-CA-C 113.382 0.882 . . . . 0.0 113.382 -166.644 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 67.9 m-85 . . . . . 0 CA--C 1.536 0.415 0 N-CA-C 113.198 0.814 . . . . 0.0 113.198 -171.577 . . . . . . . . 0 0 . 1 . 019 nuclear build core ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 20.9 mt . . . . . 0 N--CA 1.452 -0.35 0 N-CA-C 107.961 -1.126 . . . . 0.0 107.961 . . . . . . . . . 0 0 . 1 . 019 nuclear build core ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 5.3 m-20 -53.26 -57.07 11.82 Favored 'General case' 0 N--CA 1.449 -0.509 0 C-N-CA 124.812 1.245 . . . . 0.0 111.345 177.294 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 29.9 mm-40 -55.48 -45.88 76.95 Favored 'General case' 0 C--N 1.333 -0.135 0 O-C-N 122.438 -0.164 . . . . 0.0 110.924 177.447 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 1.1 tt -57.02 -50.0 74.08 Favored 'General case' 0 CA--C 1.537 0.46 0 CA-C-O 121.827 0.822 . . . . 0.0 109.854 178.306 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 50' ' ' PHE . . . . . . . . . . . . . 55.6 t80 -55.5 -50.64 69.39 Favored 'General case' 0 N--CA 1.45 -0.463 0 C-N-CA 125.078 1.351 . . . . 0.0 110.222 -179.195 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 74.6 mm-40 -59.38 -43.16 92.93 Favored 'General case' 0 N--CA 1.454 -0.229 0 CA-C-O 120.6 0.238 . . . . 0.0 111.317 176.185 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 7.7 tm-20 -54.26 -44.36 71.76 Favored 'General case' 0 CA--C 1.531 0.242 0 C-N-CA 122.374 0.27 . . . . 0.0 110.614 177.255 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 85.0 mt -69.43 -62.04 1.54 Allowed 'General case' 0 N--CA 1.453 -0.32 0 C-N-CA 122.436 0.295 . . . . 0.0 111.251 176.86 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 12.6 t0 . . . . . 0 N--CA 1.455 -0.192 0 C-N-CA 124.961 1.304 . . . . 0.0 109.39 178.999 . . . . . . . . 0 0 . 1 . 019 nuclear build core ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 33.2 mt-10 . . . . . 0 CA--C 1.529 0.135 0 N-CA-C 106.233 -1.766 . . . . 0.0 106.233 . . . . . . . . . 0 0 . 1 . 019 nuclear build core ' A' A ' 61' ' ' VAL . . . . . . . . . . . . . 46.6 t -112.1 108.63 25.99 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.318 0 CA-C-N 118.118 0.417 . . . . 0.0 110.591 -171.905 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 1.8 m -76.27 158.85 31.15 Favored 'General case' 0 CA--C 1.536 0.429 0 C-N-CA 125.517 1.527 . . . . 0.0 110.552 170.785 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 63' ' ' PHE . . . . . . . . . . . . . 54.7 t80 -53.12 -48.14 68.1 Favored 'General case' 0 CA--C 1.533 0.29 0 O-C-N 121.665 -0.647 . . . . 0.0 111.914 -174.47 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 2.8 pm0 -61.32 -25.46 67.15 Favored 'General case' 0 CA--C 1.537 0.458 0 N-CA-C 113.871 1.063 . . . . 0.0 113.871 -177.324 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 9.0 pt-20 -90.73 -37.81 13.45 Favored 'General case' 0 CA--C 1.532 0.279 0 CA-C-N 118.81 0.732 . . . . 0.0 109.225 174.977 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 9.5 t80 -51.5 -33.31 30.95 Favored 'General case' 0 CA--C 1.538 0.481 0 O-C-N 121.609 -0.682 . . . . 0.0 110.716 167.391 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 67' ' ' GLN . . . . . . . . . . . . . 23.0 mm100 -54.09 -23.04 12.47 Favored 'General case' 0 CA--C 1.538 0.503 0 O-C-N 120.841 -1.162 . . . . 0.0 113.495 174.145 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 92.1 t -62.72 -34.46 65.65 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.584 0 CA-C-N 120.039 1.29 . . . . 0.0 110.304 171.454 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 9.1 tt -71.96 -42.29 66.74 Favored 'General case' 0 N--CA 1.456 -0.152 0 N-CA-C 107.402 -1.333 . . . . 0.0 107.402 177.505 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 70' ' ' VAL . . . . . . . . . . . . . 64.4 t . . . . . 0 CA--C 1.532 0.271 0 O-C-N 121.908 -0.495 . . . . 0.0 111.148 173.942 . . . . . . . . 0 0 . 1 . 020 nuclear build core ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 53.4 Cg_exo . . . . . 0 N--CA 1.459 -0.508 0 N-CA-C 114.989 1.111 . . . . 0.0 114.989 . . . . . . . . . 0 0 . 1 . 020 nuclear build core ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 46.3 mt-10 -60.75 -41.3 95.14 Favored 'General case' 0 CA--C 1.532 0.265 0 CA-C-O 121.323 0.582 . . . . 0.0 111.293 179.989 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 10.4 mp0 -69.41 -42.24 75.32 Favored 'General case' 0 N--CA 1.451 -0.414 0 N-CA-C 107.633 -1.247 . . . . 0.0 107.633 -178.688 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 18.7 mt -58.24 -38.71 77.39 Favored 'General case' 0 N--CA 1.448 -0.539 0 CA-C-O 119.075 -0.488 . . . . 0.0 111.674 173.004 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 2.1 tmtt? -62.88 -48.67 77.99 Favored 'General case' 0 CA--C 1.533 0.297 0 CA-C-N 119.111 0.869 . . . . 0.0 109.955 173.844 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . -54.78 -51.51 52.41 Favored Glycine 0 CA--C 1.533 1.2 0 N-CA-C 111.092 -0.803 . . . . 0.0 111.092 177.946 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 9' ' ' ILE . . . . . . . . . . . . . 3.2 mm -56.27 -50.23 72.4 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.262 0 C-N-CA 125.714 1.606 . . . . 0.0 109.359 175.549 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 10' ' ' PHE . . . . . . . . . . . . . 25.6 t80 -51.66 -49.94 61.35 Favored 'General case' 0 N--CA 1.444 -0.745 0 O-C-N 121.689 -0.632 . . . . 0.0 109.3 178.126 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 68.8 mt-10 -60.6 -50.77 72.21 Favored 'General case' 0 CA--C 1.531 0.241 0 CA-C-O 119.065 -0.493 . . . . 0.0 111.36 178.836 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 20.3 tptm -39.79 -53.98 2.17 Favored 'General case' 0 N--CA 1.464 0.238 0 C-N-CA 124.568 1.147 . . . . 0.0 110.941 175.466 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 79.0 m-85 -81.9 -46.85 13.51 Favored 'General case' 0 N--CA 1.454 -0.235 0 N-CA-C 111.655 0.242 . . . . 0.0 111.655 -176.172 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -54.25 -38.19 65.5 Favored 'General case' 0 C--N 1.329 -0.311 0 C-N-CA 124.413 1.085 . . . . 0.0 112.309 -179.333 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.534 0.362 0 C-N-CA 122.961 0.504 . . . . 0.0 111.697 174.132 . . . . . . . . 0 0 . 1 . 020 nuclear build core ' A' A ' 20' ' ' PRO . . . . . . . . . . . . . 30.0 Cg_endo . . . . . 0 N--CA 1.458 -0.61 0 N-CA-C 112.985 0.34 . . . . 0.0 112.985 . . . . . . . . . 0 0 . 1 . 020 nuclear build core ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 40.6 m-80 -87.36 -4.93 59.05 Favored 'General case' 0 N--CA 1.453 -0.307 0 C-N-CA 125.032 1.333 . . . . 0.0 113.27 -176.778 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 29.8 tt0 -140.75 134.11 29.78 Favored 'General case' 0 CA--C 1.541 0.61 0 CA-C-N 119.109 0.868 . . . . 0.0 112.754 -170.713 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 81.8 mt -108.8 136.36 48.49 Favored 'General case' 0 C--N 1.344 0.361 0 C-N-CA 125.339 1.455 . . . . 0.0 111.426 178.09 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 73.0 p -81.09 174.81 11.22 Favored 'General case' 0 CA--C 1.532 0.263 0 C-N-CA 124.29 1.036 . . . . 0.0 109.388 168.794 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 98.3 mttt -57.13 -46.6 82.54 Favored 'General case' 0 C--O 1.226 -0.156 0 O-C-N 122.088 -0.382 . . . . 0.0 110.129 172.143 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 45.2 tt0 -64.53 -46.2 83.93 Favored 'General case' 0 N--CA 1.452 -0.348 0 N-CA-C 110.2 -0.296 . . . . 0.0 110.2 -177.037 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -59.33 -44.63 92.58 Favored 'General case' 0 N--CA 1.45 -0.433 0 C-N-CA 120.256 -0.577 . . . . 0.0 109.872 176.97 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 11.3 mt -56.77 -43.57 80.96 Favored 'General case' 0 CA--C 1.511 -0.538 0 CA-C-N 119.168 0.894 . . . . 0.0 113.014 170.865 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 63.0 tttm -59.96 -52.3 66.0 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-N 118.754 0.706 . . . . 0.0 109.483 -178.425 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 10.3 mp -58.31 -47.83 82.45 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 116.36 -0.382 . . . . 0.0 110.92 179.237 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 7.4 tt -50.64 -58.4 5.94 Favored 'General case' 0 N--CA 1.455 -0.19 0 C-N-CA 123.531 0.732 . . . . 0.0 109.83 175.331 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 47.7 mt -54.94 -57.7 10.59 Favored 'General case' 0 C--N 1.332 -0.174 0 C-N-CA 123.654 0.782 . . . . 0.0 109.448 -177.708 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 53.0 tt0 -61.55 -45.41 94.28 Favored 'General case' 0 N--CA 1.449 -0.499 0 C-N-CA 124.729 1.212 . . . . 0.0 111.169 -170.888 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 17.9 m -76.41 -48.75 18.7 Favored 'General case' 0 N--CA 1.451 -0.377 0 CA-C-N 116.341 -0.39 . . . . 0.0 110.738 -175.191 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 71.7 mm-40 -93.26 -32.5 14.31 Favored 'General case' 0 N--CA 1.449 -0.496 0 N-CA-C 112.646 0.61 . . . . 0.0 112.646 -168.108 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 85.7 m-85 . . . . . 0 CA--C 1.53 0.203 0 C-N-CA 123.761 0.825 . . . . 0.0 110.668 -176.251 . . . . . . . . 0 0 . 1 . 020 nuclear build core ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 59.5 tp . . . . . 0 C--O 1.223 -0.307 0 N-CA-C 110.517 -0.179 . . . . 0.0 110.517 . . . . . . . . . 0 0 . 1 . 020 nuclear build core ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 5.4 m-20 -57.84 -56.5 21.22 Favored 'General case' 0 N--CA 1.452 -0.367 0 C-N-CA 124.16 0.984 . . . . 0.0 111.132 178.182 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 33.4 mt-10 -54.63 -45.7 73.79 Favored 'General case' 0 CA--C 1.53 0.187 0 CA-C-O 120.883 0.373 . . . . 0.0 110.93 176.614 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -57.88 -51.54 69.17 Favored 'General case' 0 CA--C 1.532 0.263 0 N-CA-C 109.17 -0.678 . . . . 0.0 109.17 179.596 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 50' ' ' PHE . . . . . . . . . . . . . 68.8 t80 -53.32 -50.41 65.03 Favored 'General case' 0 N--CA 1.453 -0.307 0 C-N-CA 125.143 1.377 . . . . 0.0 110.404 178.667 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 33.1 mt-10 -55.73 -48.91 74.41 Favored 'General case' 0 CA--C 1.531 0.222 0 C-N-CA 122.974 0.51 . . . . 0.0 110.658 176.799 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 33.4 tp10 -55.99 -45.43 78.98 Favored 'General case' 0 CA--C 1.531 0.214 0 C-N-CA 123.184 0.593 . . . . 0.0 111.375 177.284 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 32.0 mt -66.32 -45.09 81.51 Favored 'General case' 0 N--CA 1.45 -0.45 0 O-C-N 122.054 -0.404 . . . . 0.0 111.778 179.138 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 51.9 t0 . . . . . 0 CA--C 1.539 0.542 0 C-N-CA 124.961 1.305 . . . . 0.0 111.315 -174.185 . . . . . . . . 0 0 . 1 . 020 nuclear build core ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 50.4 mt-10 . . . . . 0 N--CA 1.453 -0.287 0 N-CA-C 106.859 -1.534 . . . . 0.0 106.859 . . . . . . . . . 0 0 . 1 . 020 nuclear build core ' A' A ' 61' ' ' VAL . . . . . . . . . . . . . 3.7 t -108.77 112.3 39.83 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.174 0 N-CA-C 109.767 -0.456 . . . . 0.0 109.767 -171.186 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 78.1 p -78.62 158.21 28.5 Favored 'General case' 0 CA--C 1.536 0.438 0 C-N-CA 122.804 0.441 . . . . 0.0 110.874 176.369 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 63' ' ' PHE . . . . . . . . . . . . . 69.6 t80 -55.21 -34.09 63.62 Favored 'General case' 0 N--CA 1.468 0.458 0 N-CA-C 113.248 0.833 . . . . 0.0 113.248 -177.81 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 45.7 mm-40 -65.2 -60.37 3.08 Favored 'General case' 0 N--CA 1.451 -0.424 0 O-C-N 121.85 -0.531 . . . . 0.0 109.822 179.735 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 12.8 pt-20 -66.1 -28.45 68.83 Favored 'General case' 0 CA--C 1.537 0.462 0 O-C-N 121.14 -0.975 . . . . 0.0 111.391 -177.421 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 15.9 t80 -51.85 -25.58 8.15 Favored 'General case' 0 CA--C 1.536 0.406 0 C-N-CA 123.8 0.84 . . . . 0.0 112.345 169.016 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 67' ' ' GLN . . . . . . . . . . . . . 59.3 mm-40 -54.09 -25.62 22.82 Favored 'General case' 0 CA--C 1.541 0.607 0 CA-C-N 119.532 1.06 . . . . 0.0 112.859 172.593 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 97.0 t -56.4 -33.93 39.62 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.543 0 O-C-N 121.369 -0.832 . . . . 0.0 110.853 171.626 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 25.1 tp -75.04 -47.65 27.93 Favored 'General case' 0 N--CA 1.457 -0.108 0 N-CA-C 107.993 -1.114 . . . . 0.0 107.993 175.159 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 70' ' ' VAL . . . . . . . . . . . . . 84.5 t . . . . . 0 CA--C 1.531 0.242 0 C-N-CA 122.46 0.304 . . . . 0.0 111.112 -179.793 . . . . . . . . 0 0 . 1 . 021 nuclear build core ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 96.0 Cg_exo . . . . . 0 N--CA 1.458 -0.618 0 N-CA-C 113.038 0.361 . . . . 0.0 113.038 . . . . . . . . . 0 0 . 1 . 021 nuclear build core ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 35.1 tt0 -62.67 -45.14 94.17 Favored 'General case' 0 N--CA 1.454 -0.266 0 C-N-CA 122.82 0.448 . . . . 0.0 111.464 178.839 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 6.9 mp0 -70.34 -40.86 73.85 Favored 'General case' 0 N--CA 1.451 -0.405 0 N-CA-C 108.35 -0.982 . . . . 0.0 108.35 179.532 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 7.3 mt -56.3 -38.35 71.14 Favored 'General case' 0 N--CA 1.452 -0.336 0 C-N-CA 122.786 0.434 . . . . 0.0 111.751 175.03 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 22.8 tptm -61.8 -54.31 44.07 Favored 'General case' 0 C--N 1.333 -0.144 0 CA-C-N 118.961 0.801 . . . . 0.0 111.083 170.508 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . -49.87 -48.71 37.05 Favored Glycine 0 CA--C 1.534 1.254 0 N-CA-C 111.202 -0.759 . . . . 0.0 111.202 178.846 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 9' ' ' ILE . . . . . . . . . . . . . 2.8 mm -59.59 -54.44 34.46 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.315 0 C-N-CA 127.156 2.182 . . . . 0.0 109.209 176.999 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 10' ' ' PHE . . . . . . . . . . . . . 55.8 t80 -46.96 -53.07 13.15 Favored 'General case' 0 N--CA 1.45 -0.45 0 N-CA-C 109.45 -0.574 . . . . 0.0 109.45 177.744 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 50.4 mt-10 -59.72 -52.67 64.48 Favored 'General case' 0 N--CA 1.454 -0.251 0 C-N-CA 123.015 0.526 . . . . 0.0 110.55 179.666 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 44.5 tttp -44.13 -52.82 6.97 Favored 'General case' 0 CA--C 1.528 0.12 0 C-N-CA 124.567 1.147 . . . . 0.0 111.307 178.375 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 69.9 m-85 -78.39 -46.41 20.0 Favored 'General case' 0 CA--C 1.532 0.287 0 C-N-CA 121.182 -0.207 . . . . 0.0 110.877 -175.88 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -56.59 -31.94 64.74 Favored 'General case' 0 CA--C 1.535 0.382 0 C-N-CA 125.019 1.327 . . . . 0.0 112.583 -179.778 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.452 -0.373 0 O-C-N 121.68 -0.638 . . . . 0.0 112.419 176.095 . . . . . . . . 0 0 . 1 . 021 nuclear build core ' A' A ' 20' ' ' PRO . . . . . . . . . . . . . 18.9 Cg_endo . . . . . 0 CA--C 1.534 0.499 0 N-CA-C 113.621 0.585 . . . . 0.0 113.621 . . . . . . . . . 0 0 . 1 . 021 nuclear build core ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 69.0 m-80 -79.83 -20.18 46.67 Favored 'General case' 0 N--CA 1.452 -0.367 0 C-N-CA 124.306 1.042 . . . . 0.0 113.075 -178.541 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 12.0 tt0 -154.13 124.32 6.9 Favored 'General case' 0 CA--C 1.538 0.481 0 CA-C-N 119.147 0.885 . . . . 0.0 112.631 -168.098 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 42.6 mt -81.65 141.2 33.87 Favored 'General case' 0 C--O 1.234 0.276 0 C-N-CA 124.083 0.953 . . . . 0.0 112.101 -177.775 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 90.5 p -86.57 173.08 9.8 Favored 'General case' 0 CA--C 1.537 0.442 0 C-N-CA 124.42 1.088 . . . . 0.0 109.373 167.312 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 92.9 mttt -55.0 -44.18 74.27 Favored 'General case' 0 C--O 1.225 -0.224 0 O-C-N 121.814 -0.554 . . . . 0.0 110.731 173.685 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 46.4 mp0 -66.02 -50.27 64.82 Favored 'General case' 0 N--CA 1.45 -0.443 0 CA-C-O 121.389 0.614 . . . . 0.0 109.769 -174.136 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 65.5 mt-10 -53.13 -48.88 67.54 Favored 'General case' 0 N--CA 1.451 -0.376 0 CA-C-N 114.874 -1.057 . . . . 0.0 109.867 174.131 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 11.5 mt -57.18 -40.67 77.81 Favored 'General case' 0 CA--C 1.514 -0.418 0 N-CA-C 113.386 0.884 . . . . 0.0 113.386 172.959 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 5.1 ttpm? -63.23 -49.72 73.05 Favored 'General case' 0 C--N 1.322 -0.601 0 CA-C-N 118.817 0.735 . . . . 0.0 109.836 -177.572 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 4.1 mm? -60.01 -48.52 81.38 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.752 177.369 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 8.6 tt -50.26 -56.81 9.59 Favored 'General case' 0 N--CA 1.456 -0.143 0 C-N-CA 123.869 0.867 . . . . 0.0 109.568 175.476 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 39.1 mt -55.73 -58.63 7.02 Favored 'General case' 0 C--N 1.331 -0.22 0 C-N-CA 123.696 0.798 . . . . 0.0 109.58 -178.809 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 23.0 tt0 -55.9 -47.48 77.38 Favored 'General case' 0 N--CA 1.452 -0.328 0 C-N-CA 123.231 0.612 . . . . 0.0 111.337 -174.171 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 12.7 m -76.98 -45.82 26.12 Favored 'General case' 0 N--CA 1.451 -0.381 0 CA-C-N 116.224 -0.444 . . . . 0.0 111.229 -172.538 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 71.3 mm-40 -97.35 -33.37 11.45 Favored 'General case' 0 N--CA 1.451 -0.42 0 N-CA-C 112.685 0.624 . . . . 0.0 112.685 -168.32 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 54.2 m-85 . . . . . 0 C--O 1.236 0.343 0 C-N-CA 123.521 0.728 . . . . 0.0 111.409 -174.408 . . . . . . . . 0 0 . 1 . 021 nuclear build core ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 52.0 tp . . . . . 0 C--O 1.224 -0.249 0 N-CA-C 110.058 -0.349 . . . . 0.0 110.058 . . . . . . . . . 0 0 . 1 . 021 nuclear build core ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 6.6 m-20 -53.16 -61.18 2.47 Favored 'General case' 0 N--CA 1.448 -0.563 0 C-N-CA 124.053 0.941 . . . . 0.0 110.588 175.7 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 25.5 mt-10 -51.33 -49.89 60.52 Favored 'General case' 0 C--N 1.332 -0.169 0 N-CA-C 111.308 0.114 . . . . 0.0 111.308 178.765 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 8.8 mp -55.87 -48.08 76.2 Favored 'General case' 0 C--N 1.334 -0.105 0 CA-C-O 120.747 0.308 . . . . 0.0 110.454 178.032 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 50' ' ' PHE . . . . . . . . . . . . . 63.8 t80 -58.34 -48.94 78.95 Favored 'General case' 0 N--CA 1.448 -0.533 0 C-N-CA 123.198 0.599 . . . . 0.0 110.481 -178.989 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 1.2 mp0 -56.77 -50.27 72.8 Favored 'General case' 0 N--CA 1.455 -0.224 0 N-CA-C 110.51 -0.182 . . . . 0.0 110.51 176.854 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 39.1 mt-10 -54.04 -47.18 71.86 Favored 'General case' 0 CA--C 1.529 0.166 0 CA-C-O 121.1 0.476 . . . . 0.0 110.972 178.597 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 90.8 mt -68.96 -42.38 76.71 Favored 'General case' 0 N--CA 1.451 -0.424 0 C-N-CA 123.509 0.724 . . . . 0.0 111.931 -177.05 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 52.5 t0 . . . . . 0 CA--C 1.537 0.461 0 C-N-CA 124.286 1.034 . . . . 0.0 111.31 -175.545 . . . . . . . . 0 0 . 1 . 021 nuclear build core ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 35.3 mt-10 . . . . . 0 CA--C 1.533 0.322 0 N-CA-C 106.809 -1.552 . . . . 0.0 106.809 . . . . . . . . . 0 0 . 1 . 021 nuclear build core ' A' A ' 61' ' ' VAL . . . . . . . . . . . . . 3.4 t -129.08 108.76 17.51 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.516 0 CA-C-N 118.469 0.577 . . . . 0.0 112.125 -172.418 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 75.7 m -77.82 163.76 25.79 Favored 'General case' 0 CA--C 1.538 0.483 0 C-N-CA 124.467 1.107 . . . . 0.0 111.512 173.813 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 63' ' ' PHE . . . . . . . . . . . . . 61.7 t80 -59.69 -38.26 81.08 Favored 'General case' 0 CA--C 1.534 0.353 0 N-CA-C 113.028 0.751 . . . . 0.0 113.028 -172.806 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 50.0 mt-10 -61.74 -59.57 4.97 Favored 'General case' 0 CA--C 1.532 0.256 0 O-C-N 121.902 -0.499 . . . . 0.0 110.167 -179.067 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 16.6 pt-20 -61.55 -35.94 79.19 Favored 'General case' 0 CA--C 1.539 0.536 0 O-C-N 121.458 -0.776 . . . . 0.0 111.644 178.561 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 18.5 t80 -52.74 -22.89 5.77 Favored 'General case' 0 CA--C 1.536 0.426 0 C-N-CA 123.703 0.801 . . . . 0.0 112.439 169.932 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 67' ' ' GLN . . . . . . . . . . . . . 34.2 mm-40 -53.69 -21.55 7.25 Favored 'General case' 0 CA--C 1.537 0.453 0 CA-C-N 119.789 1.177 . . . . 0.0 113.001 171.063 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 70.8 t -55.49 -36.7 42.49 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.651 0 CA-C-N 119.886 1.221 . . . . 0.0 110.464 169.454 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 12.4 tp -72.59 -44.22 62.31 Favored 'General case' 0 N--CA 1.457 -0.108 0 N-CA-C 108.061 -1.088 . . . . 0.0 108.061 177.662 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 70' ' ' VAL . . . . . . . . . . . . . 54.3 t . . . . . 0 CA--C 1.534 0.36 0 N-CA-C 110.157 -0.312 . . . . 0.0 110.157 175.946 . . . . . . . . 0 0 . 1 . 022 nuclear build core ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 85.1 Cg_exo . . . . . 0 N--CA 1.46 -0.495 0 N-CA-C 113.665 0.602 . . . . 0.0 113.665 . . . . . . . . . 0 0 . 1 . 022 nuclear build core ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 3.2 mp0 -58.13 -48.92 78.74 Favored 'General case' 0 N--CA 1.456 -0.135 0 C-N-CA 123.88 0.872 . . . . 0.0 111.531 176.893 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 58.5 mm-40 -66.38 -38.5 87.68 Favored 'General case' 0 N--CA 1.448 -0.565 0 N-CA-C 109.085 -0.709 . . . . 0.0 109.085 179.343 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 48.2 mt -62.32 -35.62 79.62 Favored 'General case' 0 N--CA 1.451 -0.415 0 C-N-CA 123.436 0.694 . . . . 0.0 112.536 174.877 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 23.4 tptm -61.07 -49.18 78.39 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 118.88 0.764 . . . . 0.0 109.599 169.045 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . -49.7 -51.57 27.94 Favored Glycine 0 CA--C 1.534 1.22 0 N-CA-C 111.092 -0.803 . . . . 0.0 111.092 176.055 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 9' ' ' ILE . . . . . . . . . . . . . 2.8 mm -58.12 -54.22 35.2 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.241 0 C-N-CA 126.28 1.832 . . . . 0.0 109.327 177.117 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 10' ' ' PHE . . . . . . . . . . . . . 50.6 t80 -47.9 -52.21 20.21 Favored 'General case' 0 N--CA 1.449 -0.476 0 C-N-CA 123.503 0.721 . . . . 0.0 109.219 178.693 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 52.0 mt-10 -61.22 -51.4 69.16 Favored 'General case' 0 CA--C 1.532 0.281 0 C-N-CA 123.063 0.545 . . . . 0.0 110.553 179.724 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 37.7 tttm -45.1 -53.26 8.19 Favored 'General case' 0 C--N 1.338 0.108 0 C-N-CA 124.42 1.088 . . . . 0.0 111.124 177.981 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 68.2 m-85 -78.6 -43.78 25.58 Favored 'General case' 0 N--CA 1.454 -0.24 0 C-N-CA 121.041 -0.264 . . . . 0.0 110.97 -175.832 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -58.55 -28.73 65.76 Favored 'General case' 0 CA--C 1.532 0.284 0 C-N-CA 124.181 0.992 . . . . 0.0 112.228 179.779 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.452 -0.342 0 C-N-CA 122.999 0.519 . . . . 0.0 112.191 174.106 . . . . . . . . 0 0 . 1 . 022 nuclear build core ' A' A ' 20' ' ' PRO . . . . . . . . . . . . . 12.8 Cg_endo . . . . . 0 CA--C 1.537 0.656 0 N-CA-C 114.385 0.879 . . . . 0.0 114.385 . . . . . . . . . 0 0 . 1 . 022 nuclear build core ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -80.84 -25.26 37.85 Favored 'General case' 0 N--CA 1.451 -0.42 0 C-N-CA 125.591 1.556 . . . . 0.0 111.814 -174.685 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 59.1 tt0 -153.33 121.62 6.22 Favored 'General case' 0 N--CA 1.451 -0.409 0 N-CA-C 110.013 -0.366 . . . . 0.0 110.013 -165.9 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 50.0 mt -77.65 131.81 37.93 Favored 'General case' 0 N--CA 1.449 -0.511 0 N-CA-C 109.338 -0.616 . . . . 0.0 109.338 -174.798 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 50.9 p -75.2 167.02 22.71 Favored 'General case' 0 N--CA 1.448 -0.538 0 N-CA-C 108.448 -0.945 . . . . 0.0 108.448 169.038 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 30.9 ttmt -58.06 -37.84 75.18 Favored 'General case' 0 CA--C 1.538 0.505 0 O-C-N 121.984 -0.448 . . . . 0.0 110.104 173.963 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 24.6 mt-10 -67.68 -47.2 70.15 Favored 'General case' 0 N--CA 1.455 -0.212 0 O-C-N 121.529 -0.732 . . . . 0.0 110.667 179.008 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 23.7 mt-10 -57.49 -44.7 85.16 Favored 'General case' 0 CA--C 1.534 0.364 0 N-CA-C 109.525 -0.546 . . . . 0.0 109.525 177.455 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 15.3 mt -54.0 -48.23 70.64 Favored 'General case' 0 CA--C 1.508 -0.646 0 CA-C-N 118.317 0.508 . . . . 0.0 112.192 169.205 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 52.4 tttp -60.64 -43.12 97.91 Favored 'General case' 0 C--N 1.322 -0.593 0 CA-C-N 118.602 0.637 . . . . 0.0 110.268 -176.505 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 87.7 mt -60.88 -52.01 66.88 Favored 'General case' 0 C--N 1.328 -0.355 0 O-C-N 122.18 -0.325 . . . . 0.0 111.324 175.263 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 7.1 tt -48.15 -58.22 4.81 Favored 'General case' 0 C--N 1.334 -0.108 0 C-N-CA 124.38 1.072 . . . . 0.0 109.27 175.887 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 46.6 mt -59.14 -54.16 50.15 Favored 'General case' 0 N--CA 1.449 -0.512 0 C-N-CA 123.96 0.904 . . . . 0.0 109.868 -175.6 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 25.7 mt-30 -56.55 -48.91 76.31 Favored 'General case' 0 C--O 1.227 -0.13 0 CA-C-N 118.548 0.613 . . . . 0.0 110.996 -177.515 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 11.2 m -72.36 -47.52 48.88 Favored 'General case' 0 N--CA 1.453 -0.298 0 CA-C-N 116.325 -0.398 . . . . 0.0 110.691 -171.983 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 76.3 mm-40 -91.77 -33.4 15.01 Favored 'General case' 0 N--CA 1.451 -0.425 0 C-N-CA 123.553 0.741 . . . . 0.0 112.295 -169.438 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 79.8 m-85 . . . . . 0 CA--C 1.539 0.54 0 C-N-CA 123.969 0.907 . . . . 0.0 112.857 -171.105 . . . . . . . . 0 0 . 1 . 022 nuclear build core ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 49.3 tp . . . . . 0 N--CA 1.454 -0.27 0 CA-C-O 120.964 0.412 . . . . 0.0 111.833 . . . . . . . . . 0 0 . 1 . 022 nuclear build core ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 13.5 m-20 -59.48 -49.41 77.91 Favored 'General case' 0 N--CA 1.45 -0.458 0 C-N-CA 123.104 0.561 . . . . 0.0 109.908 -177.627 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 47.8 mt-10 -51.94 -53.13 44.78 Favored 'General case' 0 N--CA 1.454 -0.253 0 CA-C-N 116.357 -0.383 . . . . 0.0 110.644 174.413 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 6.0 mp -53.6 -52.44 59.81 Favored 'General case' 0 CA--C 1.527 0.068 0 CA-C-O 121.256 0.551 . . . . 0.0 110.428 178.304 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 50' ' ' PHE . . . . . . . . . . . . . 39.3 t80 -55.76 -45.37 78.08 Favored 'General case' 0 N--CA 1.446 -0.647 0 O-C-N 122.015 -0.428 . . . . 0.0 110.584 -178.065 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 35.5 mt-10 -67.6 -40.76 84.74 Favored 'General case' 0 N--CA 1.456 -0.17 0 CA-C-N 118.237 0.471 . . . . 0.0 112.069 179.67 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 30.8 mt-10 -53.15 -46.95 69.09 Favored 'General case' 0 N--CA 1.456 -0.128 0 C-N-CA 122.964 0.506 . . . . 0.0 110.147 174.326 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 76.2 mt -80.85 -55.89 4.5 Favored 'General case' 0 N--CA 1.45 -0.426 0 C-N-CA 122.849 0.46 . . . . 0.0 111.462 -173.358 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 14.3 t0 . . . . . 0 N--CA 1.448 -0.538 0 C-N-CA 126.173 1.789 . . . . 0.0 107.624 -179.156 . . . . . . . . 0 0 . 1 . 022 nuclear build core ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 7.3 mm-40 . . . . . 0 CA--C 1.535 0.376 0 N-CA-C 102.94 -2.985 . . . . 0.0 102.94 . . . . . . . . . 0 0 . 1 . 022 nuclear build core ' A' A ' 61' ' ' VAL . . . . . . . . . . . . . 91.8 t -96.21 111.56 26.67 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.432 0 CA-C-N 120.365 1.439 . . . . 0.0 112.992 -167.791 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 60.4 p -80.41 161.46 24.94 Favored 'General case' 0 CA--C 1.541 0.606 0 O-C-N 121.428 -0.795 . . . . 0.0 112.173 175.866 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 63' ' ' PHE . . . . . . . . . . . . . 63.6 t80 -58.65 -40.29 83.0 Favored 'General case' 0 N--CA 1.464 0.246 0 C-N-CA 123.026 0.53 . . . . 0.0 112.428 -172.885 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 20.8 pm0 -61.82 -50.64 71.47 Favored 'General case' 0 N--CA 1.448 -0.535 0 O-C-N 121.865 -0.522 . . . . 0.0 111.355 -178.267 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 10.5 pt-20 -71.38 -31.55 67.43 Favored 'General case' 0 CA--C 1.53 0.195 0 O-C-N 121.398 -0.814 . . . . 0.0 110.948 178.232 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 25.0 t80 -51.83 -27.93 14.14 Favored 'General case' 0 CA--C 1.54 0.591 0 CA-C-N 118.526 0.603 . . . . 0.0 111.747 169.472 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 67' ' ' GLN . . . . . . . . . . . . . 46.7 mm-40 -54.54 -29.79 51.97 Favored 'General case' 0 N--CA 1.469 0.492 0 O-C-N 120.742 -1.224 . . . . 0.0 113.022 171.393 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 82.9 t -61.38 -32.8 54.24 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.405 0 O-C-N 121.173 -0.954 . . . . 0.0 110.028 172.575 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 1.2 tt -71.78 -48.75 44.44 Favored 'General case' 0 N--CA 1.454 -0.243 0 N-CA-C 106.206 -1.776 . . . . 0.0 106.206 177.788 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 70' ' ' VAL . . . . . . . . . . . . . 42.9 t . . . . . 0 CA--C 1.535 0.373 0 C-N-CA 122.176 0.19 . . . . 0.0 110.494 175.922 . . . . . . . . 0 0 . 1 . 023 nuclear build core ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 79.8 Cg_exo . . . . . 0 N--CA 1.456 -0.702 0 N-CA-C 112.284 0.071 . . . . 0.0 112.284 . . . . . . . . . 0 0 . 1 . 023 nuclear build core ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 48.2 mt-10 -63.74 -49.68 72.1 Favored 'General case' 0 CA--C 1.529 0.166 0 C-N-CA 123.59 0.756 . . . . 0.0 110.923 177.209 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 46.9 mm-40 -58.65 -45.76 88.64 Favored 'General case' 0 N--CA 1.455 -0.204 0 N-CA-C 108.959 -0.756 . . . . 0.0 108.959 176.016 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 66.9 mt -60.83 -37.96 83.83 Favored 'General case' 0 N--CA 1.447 -0.579 0 C-N-CA 124.141 0.976 . . . . 0.0 112.56 179.848 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 2.6 tppp? -57.99 -53.85 53.55 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 119.249 0.932 . . . . 0.0 109.575 168.832 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . -49.17 -52.99 20.94 Favored Glycine 0 CA--C 1.536 1.344 0 N-CA-C 111.651 -0.58 . . . . 0.0 111.651 178.005 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 9' ' ' ILE . . . . . . . . . . . . . 1.9 mm -56.83 -51.38 68.34 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.231 0 C-N-CA 127.056 2.142 . . . . 0.0 109.265 176.205 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 10' ' ' PHE . . . . . . . . . . . . . 21.7 t80 -51.62 -48.95 63.1 Favored 'General case' 0 N--CA 1.445 -0.68 0 O-C-N 121.365 -0.834 . . . . 0.0 108.955 179.659 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 49.8 mt-10 -63.77 -49.39 73.16 Favored 'General case' 0 CA--C 1.531 0.237 0 CA-C-O 118.679 -0.677 . . . . 0.0 111.281 179.344 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 48.2 tptt -39.09 -51.47 1.87 Allowed 'General case' 0 N--CA 1.467 0.41 0 C-N-CA 124.74 1.216 . . . . 0.0 110.662 174.072 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 80.8 m-85 -81.43 -57.69 3.37 Favored 'General case' 0 N--CA 1.451 -0.4 0 C-N-CA 121.074 -0.25 . . . . 0.0 111.532 -177.632 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -48.63 -43.63 36.57 Favored 'General case' 0 C--N 1.331 -0.204 0 C-N-CA 124.665 1.186 . . . . 0.0 112.374 -177.242 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.53 0.183 0 C-N-CA 124.272 1.029 . . . . 0.0 112.921 -179.821 . . . . . . . . 0 0 . 1 . 023 nuclear build core ' A' A ' 20' ' ' PRO . . . . . . . . . . . . . 68.8 Cg_endo . . . . . 0 N--CA 1.456 -0.72 0 N-CA-C 112.855 0.29 . . . . 0.0 112.855 . . . . . . . . . 0 0 . 1 . 023 nuclear build core ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 35.7 m120 -91.24 -5.2 55.16 Favored 'General case' 0 C--O 1.234 0.267 0 C-N-CA 125.207 1.403 . . . . 0.0 113.763 -168.716 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 49.2 tt0 -141.42 129.6 22.19 Favored 'General case' 0 CA--C 1.541 0.599 0 C-N-CA 123.674 0.79 . . . . 0.0 111.69 -169.684 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 63.0 mt -102.42 137.39 40.73 Favored 'General case' 0 C--N 1.344 0.359 0 C-N-CA 125.107 1.363 . . . . 0.0 111.958 -179.358 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 78.1 p -79.51 172.95 13.09 Favored 'General case' 0 C--O 1.234 0.25 0 C-N-CA 124.609 1.164 . . . . 0.0 109.368 168.542 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 58.7 mttm -56.66 -47.58 79.48 Favored 'General case' 0 N--CA 1.456 -0.161 0 O-C-N 122.124 -0.36 . . . . 0.0 110.031 172.007 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 41.5 tt0 -64.2 -46.39 84.14 Favored 'General case' 0 N--CA 1.45 -0.433 0 N-CA-C 110.286 -0.264 . . . . 0.0 110.286 -175.911 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 1.1 mp0 -61.6 -41.69 97.8 Favored 'General case' 0 N--CA 1.45 -0.47 0 CA-C-O 118.532 -0.746 . . . . 0.0 110.098 177.671 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 12.8 mt -57.0 -44.89 83.19 Favored 'General case' 0 CA--C 1.512 -0.519 0 CA-C-N 119.746 1.157 . . . . 0.0 112.611 169.476 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 4.8 ttpm? -61.7 -47.55 84.77 Favored 'General case' 0 C--N 1.323 -0.549 0 CA-C-N 118.495 0.589 . . . . 0.0 109.905 -176.113 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 9.8 mp -60.53 -48.23 82.68 Favored 'General case' 0 C--N 1.329 -0.289 0 C-N-CA 122.539 0.336 . . . . 0.0 111.198 176.715 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 7.4 tt -50.38 -58.25 6.12 Favored 'General case' 0 C--N 1.333 -0.138 0 C-N-CA 123.7 0.8 . . . . 0.0 109.552 175.441 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 42.0 mt -57.45 -53.46 57.85 Favored 'General case' 0 N--CA 1.452 -0.339 0 CA-C-N 115.656 -0.702 . . . . 0.0 109.295 -177.527 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 22.2 tt0 -54.6 -49.31 70.75 Favored 'General case' 0 N--CA 1.453 -0.301 0 C-N-CA 123.683 0.793 . . . . 0.0 111.659 -177.281 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 2.7 m -72.8 -50.4 24.5 Favored 'General case' 0 CA--C 1.532 0.269 0 C-N-CA 120.968 -0.293 . . . . 0.0 110.869 -175.416 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 65.5 mm-40 -92.67 -30.02 15.79 Favored 'General case' 0 N--CA 1.45 -0.453 0 N-CA-C 113.254 0.835 . . . . 0.0 113.254 -165.966 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 80.8 m-85 . . . . . 0 CA--C 1.535 0.368 0 C-N-CA 124.019 0.928 . . . . 0.0 111.413 -175.256 . . . . . . . . 0 0 . 1 . 023 nuclear build core ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 65.6 tp . . . . . 0 C--O 1.227 -0.115 0 CA-C-O 121.063 0.458 . . . . 0.0 111.923 . . . . . . . . . 0 0 . 1 . 023 nuclear build core ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 16.0 m-20 -60.02 -51.9 67.68 Favored 'General case' 0 N--CA 1.447 -0.624 0 CA-C-O 120.918 0.39 . . . . 0.0 111.305 -179.839 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 44.0 tt0 -56.05 -48.26 76.35 Favored 'General case' 0 N--CA 1.451 -0.419 0 CA-C-N 115.998 -0.546 . . . . 0.0 109.759 177.157 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 62.1 tp -56.02 -50.94 69.5 Favored 'General case' 0 N--CA 1.452 -0.362 0 C-N-CA 122.893 0.477 . . . . 0.0 110.216 178.943 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 50' ' ' PHE . . . . . . . . . . . . . 64.3 t80 -54.77 -50.44 68.44 Favored 'General case' 0 N--CA 1.45 -0.444 0 C-N-CA 123.649 0.78 . . . . 0.0 110.217 179.54 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 35.4 mt-10 -59.21 -47.26 86.0 Favored 'General case' 0 N--CA 1.454 -0.252 0 CA-C-O 120.677 0.275 . . . . 0.0 110.905 179.552 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 35.3 mm-40 -62.34 -37.0 83.95 Favored 'General case' 0 C--N 1.332 -0.17 0 C-N-CA 123.025 0.53 . . . . 0.0 111.75 179.962 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 79.9 mt -72.97 -44.95 60.51 Favored 'General case' 0 N--CA 1.449 -0.478 0 O-C-N 122.038 -0.414 . . . . 0.0 111.53 178.176 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 27.4 t70 . . . . . 0 C--O 1.235 0.298 0 CA-C-O 121.023 0.439 . . . . 0.0 111.795 -170.01 . . . . . . . . 0 0 . 1 . 023 nuclear build core ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 36.4 mt-10 . . . . . 0 CA--C 1.53 0.188 0 CA-C-O 121.211 0.529 . . . . 0.0 110.062 . . . . . . . . . 0 0 . 1 . 023 nuclear build core ' A' A ' 61' ' ' VAL . . . . . . . . . . . . . 3.6 t -80.42 117.69 26.78 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.251 0 C-N-CA 123.827 0.851 . . . . 0.0 110.955 -166.361 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 87.0 p -76.71 157.01 32.06 Favored 'General case' 0 CA--C 1.532 0.267 0 CA-C-N 118.161 0.437 . . . . 0.0 110.466 177.484 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 63' ' ' PHE . . . . . . . . . . . . . 79.3 t80 -55.22 -32.13 62.01 Favored 'General case' 0 CA--C 1.533 0.291 0 O-C-N 121.762 -0.586 . . . . 0.0 112.394 177.087 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 44.3 mt-10 -64.95 -61.63 2.05 Favored 'General case' 0 N--CA 1.451 -0.404 0 O-C-N 121.803 -0.56 . . . . 0.0 110.12 178.329 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 8.4 pt-20 -66.21 -27.53 68.05 Favored 'General case' 0 CA--C 1.538 0.508 0 O-C-N 121.143 -0.973 . . . . 0.0 111.522 -177.824 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 18.0 t80 -52.22 -25.26 8.8 Favored 'General case' 0 CA--C 1.537 0.468 0 C-N-CA 123.848 0.859 . . . . 0.0 111.931 168.449 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 67' ' ' GLN . . . . . . . . . . . . . 67.9 mm-40 -55.17 -23.95 24.26 Favored 'General case' 0 CA--C 1.538 0.482 0 CA-C-N 119.678 1.126 . . . . 0.0 113.01 171.435 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 91.6 t -60.86 -36.32 70.79 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.532 0 CA-C-N 119.575 1.08 . . . . 0.0 110.233 169.914 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 1.4 tt -72.38 -46.05 57.04 Favored 'General case' 0 N--CA 1.453 -0.283 0 N-CA-C 106.694 -1.595 . . . . 0.0 106.694 178.659 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 70' ' ' VAL . . . . . . . . . . . . . 40.3 t . . . . . 0 CA--C 1.536 0.408 0 O-C-N 122.092 -0.38 . . . . 0.0 110.743 175.193 . . . . . . . . 0 0 . 1 . 024 nuclear build core ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 92.8 Cg_exo . . . . . 0 N--CA 1.459 -0.505 0 N-CA-C 113.037 0.36 . . . . 0.0 113.037 . . . . . . . . . 0 0 . 1 . 024 nuclear build core ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 3.0 mp0 -57.43 -50.71 72.12 Favored 'General case' 0 N--CA 1.455 -0.191 0 C-N-CA 123.957 0.903 . . . . 0.0 111.51 177.978 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 54.0 mm-40 -60.86 -44.46 97.0 Favored 'General case' 0 N--CA 1.451 -0.389 0 N-CA-C 108.667 -0.864 . . . . 0.0 108.667 177.693 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 21.0 mt -60.46 -35.75 76.62 Favored 'General case' 0 N--CA 1.447 -0.579 0 C-N-CA 123.492 0.717 . . . . 0.0 112.212 -179.023 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 23.9 tptm -61.09 -51.9 67.18 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 118.799 0.727 . . . . 0.0 110.731 169.369 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . -53.27 -52.16 42.39 Favored Glycine 0 CA--C 1.53 1.028 0 N-CA-C 110.412 -1.075 . . . . 0.0 110.412 -179.434 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 9' ' ' ILE . . . . . . . . . . . . . 77.5 mt -53.34 -54.61 17.05 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.345 0 C-N-CA 126.466 1.906 . . . . 0.0 110.1 173.289 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 10' ' ' PHE . . . . . . . . . . . . . 53.5 t80 -49.36 -53.34 22.89 Favored 'General case' 0 N--CA 1.45 -0.475 0 N-CA-C 108.84 -0.8 . . . . 0.0 108.84 -179.075 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 51.3 mt-10 -60.81 -52.93 63.0 Favored 'General case' 0 N--CA 1.455 -0.213 0 C-N-CA 122.623 0.369 . . . . 0.0 110.333 -178.273 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 17.2 ttpp -45.88 -54.84 7.51 Favored 'General case' 0 C--O 1.23 0.074 0 C-N-CA 125.142 1.377 . . . . 0.0 111.322 178.73 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 57.9 m-85 -77.18 -48.21 18.24 Favored 'General case' 0 N--CA 1.451 -0.415 0 N-CA-C 110.009 -0.367 . . . . 0.0 110.009 -175.191 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -47.91 -50.08 27.92 Favored 'General case' 0 N--CA 1.463 0.215 0 C-N-CA 124.641 1.176 . . . . 0.0 111.413 179.461 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.453 -0.279 0 C-N-CA 123.717 0.807 . . . . 0.0 112.526 177.279 . . . . . . . . 0 0 . 1 . 024 nuclear build core ' A' A ' 20' ' ' PRO . . . . . . . . . . . . . 4.8 Cg_endo . . . . . 0 CA--C 1.536 0.597 0 N-CA-C 116.576 1.722 . . . . 0.0 116.576 . . . . . . . . . 0 0 . 1 . 024 nuclear build core ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 53.1 m-80 -91.49 -5.66 53.85 Favored 'General case' 0 N--CA 1.449 -0.523 0 C-N-CA 123.695 0.798 . . . . 0.0 112.023 -171.969 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -152.43 127.52 9.75 Favored 'General case' 0 CA--C 1.538 0.493 0 CA-C-N 119.671 1.123 . . . . 0.0 112.852 -167.942 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 70.2 mt -94.54 124.82 38.8 Favored 'General case' 0 C--O 1.235 0.328 0 O-C-N 121.501 -0.749 . . . . 0.0 110.555 174.761 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 4.9 p -79.02 177.67 8.62 Favored 'General case' 0 C--O 1.238 0.463 0 N-CA-C 107.841 -1.17 . . . . 0.0 107.841 166.411 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 98.7 mttt -54.94 -39.77 69.22 Favored 'General case' 0 N--CA 1.451 -0.377 0 O-C-N 122.192 -0.318 . . . . 0.0 110.338 173.304 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 28.5 mt-10 -69.94 -45.61 67.1 Favored 'General case' 0 N--CA 1.454 -0.272 0 N-CA-C 109.65 -0.5 . . . . 0.0 109.65 -173.113 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 1.6 mp0 -55.17 -50.14 70.1 Favored 'General case' 0 N--CA 1.45 -0.464 0 N-CA-C 109.24 -0.652 . . . . 0.0 109.24 173.676 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 8.0 mt -56.33 -41.59 76.31 Favored 'General case' 0 CA--C 1.513 -0.473 0 N-CA-C 113.198 0.814 . . . . 0.0 113.198 174.365 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 64.7 tttm -62.6 -51.84 65.74 Favored 'General case' 0 C--N 1.321 -0.651 0 CA-C-N 118.485 0.584 . . . . 0.0 110.026 -177.383 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 4.0 mm? -60.41 -46.15 91.03 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.115 -0.493 . . . . 0.0 111.143 178.008 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 6.6 tt -51.23 -57.49 8.68 Favored 'General case' 0 C--N 1.333 -0.152 0 C-N-CA 124.217 1.007 . . . . 0.0 109.399 174.649 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 35.1 mt -55.07 -56.78 15.95 Favored 'General case' 0 C--N 1.331 -0.22 0 C-N-CA 123.23 0.612 . . . . 0.0 109.557 -178.065 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 23.5 mt-30 -52.25 -53.48 43.27 Favored 'General case' 0 N--CA 1.456 -0.135 0 C-N-CA 123.088 0.555 . . . . 0.0 111.671 -178.67 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 13.4 m -74.07 -47.73 34.64 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 116.266 -0.424 . . . . 0.0 110.822 -169.96 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 69.8 mm-40 -85.71 -34.59 21.21 Favored 'General case' 0 N--CA 1.449 -0.513 0 C-N-CA 123.207 0.603 . . . . 0.0 111.313 -170.986 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 82.5 m-85 . . . . . 0 CA--C 1.536 0.438 0 C-N-CA 123.67 0.788 . . . . 0.0 112.278 -171.562 . . . . . . . . 0 0 . 1 . 024 nuclear build core ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 58.2 tp . . . . . 0 C--O 1.225 -0.204 0 N-CA-C 109.739 -0.467 . . . . 0.0 109.739 . . . . . . . . . 0 0 . 1 . 024 nuclear build core ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 5.6 m-20 -56.77 -53.51 56.96 Favored 'General case' 0 N--CA 1.45 -0.472 0 C-N-CA 124.067 0.947 . . . . 0.0 110.868 177.285 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 76.5 tt0 -54.78 -50.55 68.2 Favored 'General case' 0 C--N 1.33 -0.254 0 C-N-CA 122.942 0.497 . . . . 0.0 110.528 177.929 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 59.5 tp -57.31 -48.36 79.13 Favored 'General case' 0 N--CA 1.455 -0.18 0 CA-C-O 121.27 0.557 . . . . 0.0 109.979 178.856 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 50' ' ' PHE . . . . . . . . . . . . . 80.3 t80 -56.18 -48.12 76.99 Favored 'General case' 0 N--CA 1.45 -0.469 0 C-N-CA 123.777 0.831 . . . . 0.0 110.43 179.492 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 33.6 mt-10 -59.6 -46.77 87.98 Favored 'General case' 0 N--CA 1.455 -0.207 0 C-N-CA 122.883 0.473 . . . . 0.0 110.612 177.641 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 44.5 tt0 -54.47 -49.22 70.62 Favored 'General case' 0 CA--C 1.53 0.182 0 C-N-CA 123.065 0.546 . . . . 0.0 110.589 177.416 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 72.8 mt -70.1 -44.49 68.89 Favored 'General case' 0 N--CA 1.45 -0.449 0 C-N-CA 123.229 0.612 . . . . 0.0 111.672 -177.102 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 52.1 t0 . . . . . 0 CA--C 1.535 0.371 0 C-N-CA 125.34 1.456 . . . . 0.0 109.655 177.108 . . . . . . . . 0 0 . 1 . 024 nuclear build core ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 37.3 mt-10 . . . . . 0 N--CA 1.455 -0.223 0 N-CA-C 107.087 -1.449 . . . . 0.0 107.087 . . . . . . . . . 0 0 . 1 . 024 nuclear build core ' A' A ' 61' ' ' VAL . . . . . . . . . . . . . 3.0 t -108.47 115.32 48.96 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.244 0 N-CA-C 109.865 -0.42 . . . . 0.0 109.865 -177.554 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 78.1 p -79.52 161.68 25.87 Favored 'General case' 0 CA--C 1.536 0.405 0 C-N-CA 123.842 0.857 . . . . 0.0 110.086 171.272 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 63' ' ' PHE . . . . . . . . . . . . . 60.4 t80 -59.15 -38.56 79.98 Favored 'General case' 0 N--CA 1.462 0.172 0 O-C-N 121.613 -0.679 . . . . 0.0 111.732 -176.064 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 22.0 mp0 -63.38 -57.29 10.81 Favored 'General case' 0 N--CA 1.447 -0.613 0 N-CA-C 109.163 -0.68 . . . . 0.0 109.163 -175.071 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 15.5 pt-20 -66.4 -32.81 74.43 Favored 'General case' 0 CA--C 1.537 0.464 0 O-C-N 121.545 -0.722 . . . . 0.0 111.459 179.007 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 18.6 t80 -53.22 -24.85 12.12 Favored 'General case' 0 CA--C 1.538 0.502 0 O-C-N 121.467 -0.771 . . . . 0.0 111.73 169.553 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 67' ' ' GLN . . . . . . . . . . . . . 33.8 mm-40 -54.05 -22.96 11.99 Favored 'General case' 0 CA--C 1.535 0.389 0 CA-C-N 119.569 1.077 . . . . 0.0 113.291 172.218 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 69.7 t -53.25 -37.92 29.71 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.487 0 CA-C-N 119.484 1.038 . . . . 0.0 110.38 170.073 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 19.9 tp -74.6 -48.55 25.9 Favored 'General case' 0 N--CA 1.456 -0.165 0 N-CA-C 108.3 -1.0 . . . . 0.0 108.3 177.53 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 70' ' ' VAL . . . . . . . . . . . . . 56.5 t . . . . . 0 C--O 1.225 -0.233 0 C-N-CA 122.574 0.35 . . . . 0.0 110.641 -179.718 . . . . . . . . 0 0 . 1 . 001 nuclear build full ' A' A ' 1' ' ' LYS . . . . . . . . . . . . . 7.9 mptt . . . . . 0 N--CA 1.449 -0.48 0 N-CA-C 107.377 -1.342 . . . . 0.0 107.377 . . . . . . . . . 0 0 . 1 . 001 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 87.3 p -63.7 154.91 78.81 Favored Pre-proline 0 CA--C 1.534 0.336 0 CA-C-O 118.981 -0.533 . . . . 0.0 109.974 179.628 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 95.4 Cg_exo -44.16 -40.41 12.43 Favored 'Trans proline' 0 N--CA 1.458 -0.614 0 C-N-CA 123.082 2.521 . . . . 0.0 112.657 170.068 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 2.9 mp0 -60.38 -48.74 80.47 Favored 'General case' 0 N--CA 1.455 -0.216 0 C-N-CA 124.005 0.922 . . . . 0.0 112.04 176.114 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 32.8 mt-10 -62.18 -44.41 96.66 Favored 'General case' 0 N--CA 1.453 -0.282 0 N-CA-C 109.19 -0.67 . . . . 0.0 109.19 177.802 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 40.9 mt -60.48 -38.01 82.88 Favored 'General case' 0 N--CA 1.449 -0.504 0 C-N-CA 123.455 0.702 . . . . 0.0 111.869 177.648 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 20.8 tptm -60.62 -49.72 76.39 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 118.442 0.564 . . . . 0.0 110.221 170.635 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . -50.84 -50.1 39.1 Favored Glycine 0 CA--C 1.531 1.061 0 N-CA-C 110.63 -0.988 . . . . 0.0 110.63 177.176 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 9' ' ' ILE . . . . . . . . . . . . . 19.5 mm -58.98 -54.76 29.63 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.235 0 C-N-CA 125.826 1.65 . . . . 0.0 109.958 176.904 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 10' ' ' PHE . . . . . . . . . . . . . 32.3 t80 -47.66 -52.78 16.97 Favored 'General case' 0 N--CA 1.451 -0.419 0 O-C-N 121.605 -0.685 . . . . 0.0 109.703 177.762 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 52.9 mt-10 -60.02 -51.19 70.71 Favored 'General case' 0 N--CA 1.453 -0.318 0 C-N-CA 123.668 0.787 . . . . 0.0 110.359 -179.578 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 58.4 tttt -44.27 -59.91 2.16 Favored 'General case' 0 C--N 1.339 0.115 0 C-N-CA 124.126 0.97 . . . . 0.0 110.214 175.913 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 63.0 m-85 -75.42 -38.73 59.63 Favored 'General case' 0 N--CA 1.452 -0.345 0 C-N-CA 120.449 -0.5 . . . . 0.0 110.88 -169.124 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -57.24 -58.85 6.44 Favored 'General case' 0 C--O 1.237 0.411 0 CA-C-O 122.013 0.911 . . . . 0.0 110.015 174.939 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -54.99 -35.92 64.85 Favored 'General case' 0 N--CA 1.454 -0.267 0 C-N-CA 124.282 1.033 . . . . 0.0 111.441 178.972 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 20.0 ttmm -55.09 -36.83 66.07 Favored 'General case' 0 CA--C 1.533 0.327 0 CA-C-N 118.139 0.427 . . . . 0.0 111.48 178.348 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 34.7 tt0 -76.09 -54.48 6.77 Favored 'General case' 0 C--N 1.34 0.188 0 N-CA-C 108.737 -0.838 . . . . 0.0 108.737 169.731 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 157.07 -54.25 0.4 Allowed Glycine 0 CA--C 1.521 0.418 0 N-CA-C 110.358 -1.097 . . . . 0.0 110.358 178.565 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 13.9 t0 -58.65 119.77 39.63 Favored Pre-proline 0 CA--C 1.532 0.269 0 N-CA-C 108.221 -1.029 . . . . 0.0 108.221 177.802 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 20' ' ' PRO . . . . . . . . . . . . . 72.2 Cg_endo -80.6 -28.93 2.52 Favored 'Trans proline' 0 N--CA 1.455 -0.793 0 C-N-CA 121.951 1.767 . . . . 0.0 112.781 -175.835 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 92.9 m-20 -97.69 -15.15 20.51 Favored 'General case' 0 N--CA 1.454 -0.242 0 C-N-CA 124.464 1.106 . . . . 0.0 113.325 -166.772 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 7.1 tp60 -138.67 127.23 23.27 Favored 'General case' 0 CA--C 1.537 0.443 0 C-N-CA 123.725 0.81 . . . . 0.0 109.992 -168.307 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 74.8 mt -95.07 129.32 42.21 Favored 'General case' 0 CA--C 1.531 0.241 0 C-N-CA 124.301 1.041 . . . . 0.0 110.782 178.666 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 1.5 p -79.16 176.02 10.06 Favored 'General case' 0 C--O 1.238 0.472 0 N-CA-C 108.301 -1.0 . . . . 0.0 108.301 167.103 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 58.1 mttp -54.24 -38.77 66.14 Favored 'General case' 0 N--CA 1.451 -0.39 0 CA-C-O 119.352 -0.356 . . . . 0.0 110.902 175.162 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 31.3 mm-40 -71.42 -47.4 56.21 Favored 'General case' 0 CA--C 1.518 -0.26 0 CA-C-N 118.436 0.562 . . . . 0.0 110.557 -171.243 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 2.2 mp0 -53.97 -48.96 69.81 Favored 'General case' 0 N--CA 1.451 -0.418 0 CA-C-N 115.87 -0.605 . . . . 0.0 109.549 172.368 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 13.1 mt -56.97 -43.52 81.71 Favored 'General case' 0 C--O 1.218 -0.554 0 C-N-CA 120.023 -0.671 . . . . 0.0 112.304 174.59 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 37.6 ttpt -61.67 -47.86 83.44 Favored 'General case' 0 C--N 1.32 -0.702 0 CA-C-N 118.5 0.591 . . . . 0.0 110.121 -176.641 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 11.8 tp -65.56 -43.8 88.76 Favored 'General case' 0 CA--C 1.533 0.326 0 CA-C-O 120.609 0.242 . . . . 0.0 110.877 179.823 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 7.1 tt -50.73 -58.71 5.25 Favored 'General case' 0 CA--C 1.522 -0.119 0 C-N-CA 124.146 0.979 . . . . 0.0 109.549 173.521 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 31.0 mt -58.93 -52.73 64.52 Favored 'General case' 0 C--O 1.219 -0.501 0 N-CA-C 108.782 -0.821 . . . . 0.0 108.782 -177.882 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 22.9 tt0 -49.5 -45.62 47.28 Favored 'General case' 0 C--N 1.332 -0.194 0 O-C-N 121.37 -0.831 . . . . 0.0 111.775 179.25 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 7.9 m -74.09 -54.74 7.18 Favored 'General case' 0 CA--C 1.533 0.325 0 CA-C-O 120.61 0.243 . . . . 0.0 111.612 -177.81 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 29.5 mm-40 -91.98 -33.4 14.86 Favored 'General case' 0 N--CA 1.452 -0.339 0 C-N-CA 124.008 0.923 . . . . 0.0 113.138 -166.36 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 79.6 m-85 -147.37 64.89 9.05 Favored Pre-proline 0 CA--C 1.536 0.439 0 C-N-CA 124.98 1.312 . . . . 0.0 111.525 -171.912 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 27.5 Cg_endo -60.79 -27.29 84.58 Favored 'Trans proline' 0 N--CA 1.458 -0.594 0 C-N-CA 122.524 2.15 . . . . 0.0 112.785 -170.575 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 2.5 p -56.67 -53.16 60.88 Favored 'General case' 0 N--CA 1.449 -0.485 0 C-N-CA 124.66 1.184 . . . . 0.0 110.378 175.91 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 72.0 mt -59.16 -17.5 27.7 Favored 'General case' 0 CA--C 1.532 0.271 0 C-N-CA 125.604 1.562 . . . . 0.0 113.635 -170.815 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 93.8 mt -49.41 -36.49 22.27 Favored 'General case' 0 CA--C 1.537 0.458 0 CA-C-N 118.413 0.551 . . . . 0.0 110.932 168.305 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 56.2 mtmt -109.61 -47.32 3.38 Favored 'General case' 0 N--CA 1.45 -0.467 0 C-N-CA 126.511 1.924 . . . . 0.0 110.681 177.138 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . -57.99 137.97 49.18 Favored Glycine 0 CA--C 1.525 0.691 0 C-N-CA 125.178 1.37 . . . . 0.0 111.97 -170.655 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 43' ' ' GLY . . . . . . . . . . . . . . . 78.59 -55.1 4.12 Favored Glycine 0 CA--C 1.527 0.789 0 N-CA-C 110.347 -1.101 . . . . 0.0 110.347 -178.936 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 44' ' ' SER . . . . . . . . . . . . . 4.5 m -160.35 145.03 14.5 Favored 'General case' 0 N--CA 1.442 -0.826 0 C-N-CA 124.97 1.308 . . . . 0.0 107.59 174.055 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 6.5 p -59.69 143.0 51.9 Favored 'General case' 0 N--CA 1.451 -0.415 0 N-CA-C 108.93 -0.767 . . . . 0.0 108.93 171.446 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 48.3 tp -39.34 -49.2 1.97 Allowed 'General case' 0 CA--C 1.519 -0.242 0 C-N-CA 127.02 2.128 . . . . 0.0 112.842 -169.169 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 7.4 m-20 -64.07 -43.38 95.64 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-N 115.843 -0.617 . . . . 0.0 111.1 -174.898 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 29.7 mm-40 -71.14 -42.24 69.42 Favored 'General case' 0 N--CA 1.45 -0.45 0 N-CA-C 109.263 -0.643 . . . . 0.0 109.263 177.219 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 56.5 tp -53.96 -47.64 71.13 Favored 'General case' 0 N--CA 1.452 -0.367 0 N-CA-C 109.539 -0.541 . . . . 0.0 109.539 177.448 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 50' ' ' PHE . . . . . . . . . . . . . 82.9 t80 -51.69 -53.73 35.93 Favored 'General case' 0 N--CA 1.454 -0.266 0 C-N-CA 123.657 0.783 . . . . 0.0 110.614 177.987 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 72.2 mm-40 -56.06 -49.12 74.64 Favored 'General case' 0 CA--C 1.532 0.283 0 CA-C-O 120.605 0.24 . . . . 0.0 110.968 177.429 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 50.2 mm-40 -57.73 -40.99 80.92 Favored 'General case' 0 CA--C 1.531 0.219 0 C-N-CA 122.779 0.432 . . . . 0.0 112.138 179.801 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 62.2 mt -71.44 -41.15 69.83 Favored 'General case' 0 N--CA 1.45 -0.464 0 C-N-CA 122.857 0.463 . . . . 0.0 111.011 179.16 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 19.6 t70 -70.14 57.2 0.16 Allowed 'General case' 0 CA--C 1.541 0.621 0 C-N-CA 125.966 1.707 . . . . 0.0 112.136 -178.386 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 30.7 mmmt -56.29 -36.33 68.52 Favored 'General case' 0 CA--C 1.53 0.201 0 O-C-N 120.758 -1.214 . . . . 0.0 112.295 -179.322 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 56' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -69.79 -15.4 63.11 Favored 'General case' 0 CA--C 1.537 0.444 0 N-CA-C 112.485 0.55 . . . . 0.0 112.485 179.167 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . 75.04 14.96 81.35 Favored Glycine 0 CA--C 1.53 0.971 0 CA-C-O 118.562 -1.132 . . . . 0.0 114.908 169.635 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -77.02 -34.22 57.39 Favored 'General case' 0 C--N 1.34 0.175 0 CA-C-N 119.901 1.85 . . . . 0.0 110.078 174.607 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . 133.92 -67.78 0.55 Allowed Glycine 0 N--CA 1.448 -0.552 0 N-CA-C 107.559 -2.216 . . . . 0.0 107.559 -176.555 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 56.5 mt-10 -78.21 155.13 30.51 Favored 'General case' 0 N--CA 1.452 -0.345 0 N-CA-C 109.42 -0.585 . . . . 0.0 109.42 -174.865 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 61' ' ' VAL . . . . . . . . . . . . . 3.7 t -103.91 120.94 54.81 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.422 0 C-N-CA 123.332 0.653 . . . . 0.0 111.354 -167.183 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 95.1 p -77.45 163.7 26.11 Favored 'General case' 0 N--CA 1.463 0.195 0 C-N-CA 123.196 0.598 . . . . 0.0 110.492 174.931 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 63' ' ' PHE . . . . . . . . . . . . . 68.9 t80 -59.38 -32.99 70.65 Favored 'General case' 0 CA--C 1.528 0.133 0 O-C-N 122.032 -0.418 . . . . 0.0 111.879 176.091 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 39.2 mm-40 -66.97 -59.1 3.78 Favored 'General case' 0 N--CA 1.446 -0.639 0 N-CA-C 109.363 -0.606 . . . . 0.0 109.363 -179.437 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 8.3 pt-20 -66.91 -29.58 69.49 Favored 'General case' 0 CA--C 1.54 0.578 0 O-C-N 121.5 -0.75 . . . . 0.0 111.313 -177.656 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 13.3 t80 -50.63 -28.53 9.01 Favored 'General case' 0 CA--C 1.536 0.417 0 C-N-CA 123.825 0.85 . . . . 0.0 111.891 168.779 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 67' ' ' GLN . . . . . . . . . . . . . 80.5 mm-40 -55.32 -23.32 23.08 Favored 'General case' 0 CA--C 1.535 0.401 0 CA-C-N 119.696 1.135 . . . . 0.0 112.962 174.668 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 88.4 t -55.25 -32.38 28.42 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.526 0 CA-C-N 119.472 1.033 . . . . 0.0 110.765 171.701 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 37.2 tp -71.33 -47.72 54.81 Favored 'General case' 0 N--CA 1.454 -0.257 0 N-CA-C 107.159 -1.423 . . . . 0.0 107.159 179.47 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 70' ' ' VAL . . . . . . . . . . . . . 18.5 t -59.62 -39.57 79.87 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.348 0 C-N-CA 122.88 0.472 . . . . 0.0 110.142 -179.983 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 53.5 tptt -55.21 -56.59 18.22 Favored 'General case' 0 N--CA 1.453 -0.289 0 C-N-CA 123.277 0.631 . . . . 0.0 109.978 171.189 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 2.1 mptm? -50.43 -45.47 55.83 Favored 'General case' 0 CA--C 1.537 0.46 0 N-CA-C 112.415 0.524 . . . . 0.0 112.415 175.264 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 73' ' ' ILE . . . . . . . . . . . . . 78.8 mt -56.79 -50.57 74.4 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.248 0 N-CA-C 109.446 -0.576 . . . . 0.0 109.446 175.47 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 74' ' ' SER . . . . . 0.528 ' O ' ' OXT' ' A' ' 75' ' ' GLN . 17.9 m -56.06 -42.15 76.21 Favored 'General case' 0 CA--C 1.529 0.161 0 C-N-CA 123.398 0.679 . . . . 0.0 110.854 179.783 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 75' ' ' GLN . . . . . 0.528 ' OXT' ' O ' ' A' ' 74' ' ' SER . 40.1 mt-30 . . . . . 0 C--O 1.27 2.169 0 N-CA-C 108.629 -0.878 . . . . 0.0 108.629 169.448 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 1' ' ' LYS . . . . . . . . . . . . . 32.9 mttp . . . . . 0 N--CA 1.451 -0.393 0 N-CA-C 108.72 -0.844 . . . . 0.0 108.72 . . . . . . . . . 0 0 . 1 . 002 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 88.2 p -69.31 159.44 83.32 Favored Pre-proline 0 CA--C 1.534 0.361 0 CA-C-O 119.247 -0.406 . . . . 0.0 110.564 179.872 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 86.9 Cg_exo -47.26 -40.11 27.57 Favored 'Trans proline' 0 N--CA 1.457 -0.664 0 C-N-CA 123.091 2.527 . . . . 0.0 112.338 168.86 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 40.3 tt0 -61.11 -49.37 77.56 Favored 'General case' 0 CA--C 1.529 0.17 0 C-N-CA 123.389 0.676 . . . . 0.0 111.103 177.534 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 29.7 mt-10 -60.75 -45.63 93.54 Favored 'General case' 0 N--CA 1.454 -0.272 0 N-CA-C 109.009 -0.738 . . . . 0.0 109.009 177.943 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 19.9 mt -58.41 -40.19 81.8 Favored 'General case' 0 N--CA 1.447 -0.611 0 C-N-CA 123.755 0.822 . . . . 0.0 111.192 179.142 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 21.4 tptm -60.12 -53.05 62.36 Favored 'General case' 0 C--N 1.333 -0.131 0 CA-C-N 118.798 0.726 . . . . 0.0 110.898 171.054 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . -50.5 -52.2 29.55 Favored Glycine 0 CA--C 1.533 1.192 0 N-CA-C 111.269 -0.732 . . . . 0.0 111.269 179.15 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 9' ' ' ILE . . . . . . . . . . . . . 2.4 mm -56.04 -55.04 20.43 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.305 0 C-N-CA 126.475 1.91 . . . . 0.0 108.944 175.818 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 10' ' ' PHE . . . . . . . . . . . . . 38.6 t80 -49.1 -49.89 39.63 Favored 'General case' 0 N--CA 1.448 -0.534 0 O-C-N 121.725 -0.609 . . . . 0.0 109.846 179.797 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 51.0 mt-10 -62.05 -50.99 69.77 Favored 'General case' 0 N--CA 1.455 -0.197 0 C-N-CA 123.081 0.553 . . . . 0.0 110.567 179.417 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 68.9 tttt -44.52 -51.62 8.7 Favored 'General case' 0 CA--C 1.53 0.21 0 C-N-CA 124.341 1.057 . . . . 0.0 110.9 177.167 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 63.1 m-85 -78.4 -46.31 20.21 Favored 'General case' 0 CA--C 1.53 0.206 0 O-C-N 122.341 -0.224 . . . . 0.0 111.296 -176.403 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -57.23 -42.35 81.26 Favored 'General case' 0 C--N 1.329 -0.318 0 O-C-N 121.384 -0.823 . . . . 0.0 111.659 -178.427 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -51.62 -29.77 18.8 Favored 'General case' 0 CA--C 1.533 0.308 0 C-N-CA 123.603 0.761 . . . . 0.0 111.921 173.772 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 29.5 ttmt -67.48 -33.76 75.78 Favored 'General case' 0 CA--C 1.534 0.334 0 C-N-CA 122.843 0.457 . . . . 0.0 110.761 179.64 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 46.6 mm-40 -69.46 -48.91 59.3 Favored 'General case' 0 C--N 1.343 0.303 0 N-CA-C 107.728 -1.212 . . . . 0.0 107.728 168.224 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 147.58 -59.0 0.47 Allowed Glycine 0 N--CA 1.451 -0.33 0 N-CA-C 108.837 -1.705 . . . . 0.0 108.837 176.671 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 33.9 t0 -68.6 111.33 7.84 Favored Pre-proline 0 CA--C 1.534 0.338 0 CA-C-O 118.334 -0.841 . . . . 0.0 109.295 178.249 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 20' ' ' PRO . . . . . . . . . . . . . 36.4 Cg_endo -60.76 -20.82 67.6 Favored 'Trans proline' 0 N--CA 1.457 -0.62 0 C-N-CA 121.978 1.785 . . . . 0.0 112.63 -179.752 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 48.5 m-80 -85.06 -1.16 56.52 Favored 'General case' 0 N--CA 1.453 -0.288 0 C-N-CA 124.481 1.112 . . . . 0.0 113.137 -173.17 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 23.6 tt0 -151.27 124.99 9.05 Favored 'General case' 0 CA--C 1.542 0.637 0 CA-C-N 119.749 1.159 . . . . 0.0 113.887 -169.271 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 82.7 mt -98.82 138.11 36.44 Favored 'General case' 0 C--N 1.345 0.386 0 C-N-CA 125.296 1.438 . . . . 0.0 111.632 178.376 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 88.9 p -80.69 174.17 11.88 Favored 'General case' 0 CA--C 1.532 0.283 0 C-N-CA 123.466 0.706 . . . . 0.0 109.734 168.3 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 7.6 mtpm? -56.92 -44.28 82.26 Favored 'General case' 0 C--O 1.226 -0.173 0 N-CA-C 109.721 -0.474 . . . . 0.0 109.721 171.352 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 1.8 mp0 -63.09 -51.95 64.61 Favored 'General case' 0 N--CA 1.451 -0.424 0 C-N-CA 123.285 0.634 . . . . 0.0 110.259 -176.861 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -57.67 -41.77 82.23 Favored 'General case' 0 N--CA 1.451 -0.401 0 CA-C-O 118.564 -0.731 . . . . 0.0 110.422 176.687 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 14.3 mt -57.79 -43.66 85.74 Favored 'General case' 0 CA--C 1.513 -0.446 0 CA-C-N 119.614 1.097 . . . . 0.0 113.126 169.744 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 21.0 ttmm -61.11 -49.36 77.61 Favored 'General case' 0 N--CA 1.449 -0.497 0 CA-C-N 118.773 0.715 . . . . 0.0 109.857 -178.163 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 95.9 mt -62.02 -45.49 93.35 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.39 -0.368 . . . . 0.0 111.169 179.156 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 7.6 tt -50.84 -57.85 7.42 Favored 'General case' 0 C--O 1.232 0.132 0 C-N-CA 124.098 0.959 . . . . 0.0 109.405 173.668 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 40.7 mt -55.56 -58.01 9.53 Favored 'General case' 0 N--CA 1.455 -0.179 0 N-CA-C 109.637 -0.505 . . . . 0.0 109.637 -178.794 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 22.8 tt0 -53.07 -50.45 64.35 Favored 'General case' 0 N--CA 1.452 -0.349 0 C-N-CA 124.202 1.001 . . . . 0.0 111.674 -176.012 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 15.0 m -74.48 -49.97 20.11 Favored 'General case' 0 N--CA 1.453 -0.303 0 CA-C-N 116.34 -0.391 . . . . 0.0 110.898 -173.017 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 73.2 mm-40 -94.58 -32.5 13.41 Favored 'General case' 0 N--CA 1.448 -0.554 0 N-CA-C 112.685 0.624 . . . . 0.0 112.685 -167.06 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 81.6 m-85 -138.81 68.84 43.71 Favored Pre-proline 0 CA--C 1.538 0.494 0 C-N-CA 123.49 0.716 . . . . 0.0 112.443 -173.919 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 88.7 Cg_exo -47.51 -29.42 10.26 Favored 'Trans proline' 0 N--CA 1.459 -0.525 0 C-N-CA 123.479 2.786 . . . . 0.0 113.388 169.638 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 4.6 p -61.88 -66.84 0.48 Allowed 'General case' 0 N--CA 1.447 -0.614 0 C-N-CA 124.321 1.049 . . . . 0.0 108.695 175.034 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 95.8 mt -53.22 -35.51 60.0 Favored 'General case' 0 N--CA 1.456 -0.166 0 C-N-CA 124.48 1.112 . . . . 0.0 112.036 -178.628 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 19.5 tp -49.21 -42.04 39.0 Favored 'General case' 0 CA--C 1.534 0.359 0 C-N-CA 122.515 0.326 . . . . 0.0 111.301 174.488 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 5.7 mptp? -88.35 -36.5 16.57 Favored 'General case' 0 CA--C 1.533 0.3 0 C-N-CA 123.868 0.867 . . . . 0.0 110.882 176.841 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . -75.05 54.55 2.66 Favored Glycine 0 CA--C 1.531 1.078 0 C-N-CA 124.873 1.225 . . . . 0.0 113.631 -172.668 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 43' ' ' GLY . . . . . . . . . . . . . . . -176.48 142.41 5.93 Favored Glycine 0 CA--C 1.524 0.629 0 N-CA-C 108.266 -1.934 . . . . 0.0 108.266 174.874 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 44' ' ' SER . . . . . . . . . . . . . 3.4 m -48.47 -53.33 18.36 Favored 'General case' 0 CA--C 1.534 0.349 0 C-N-CA 124.865 1.266 . . . . 0.0 113.054 -169.943 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 45.7 p -150.93 161.27 43.04 Favored 'General case' 0 C--O 1.234 0.269 0 N-CA-C 107.003 -1.48 . . . . 0.0 107.003 169.401 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 57.3 tp -53.19 -43.4 67.14 Favored 'General case' 0 C--O 1.223 -0.305 0 N-CA-C 109.936 -0.394 . . . . 0.0 109.936 169.474 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 5.6 m-20 -58.96 -52.62 64.98 Favored 'General case' 0 N--CA 1.449 -0.524 0 C-N-CA 123.734 0.814 . . . . 0.0 111.027 179.781 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 33.8 mt-10 -59.37 -45.59 91.0 Favored 'General case' 0 N--CA 1.455 -0.18 0 CA-C-N 116.618 -0.265 . . . . 0.0 111.125 177.88 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 59.7 mt -54.9 -54.72 38.98 Favored 'General case' 0 C--O 1.224 -0.238 0 N-CA-C 109.636 -0.505 . . . . 0.0 109.636 174.802 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 50' ' ' PHE . . . . . . . . . . . . . 80.4 t80 -52.43 -49.92 63.6 Favored 'General case' 0 N--CA 1.449 -0.475 0 C-N-CA 123.965 0.906 . . . . 0.0 110.36 -177.527 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 27.7 tp10 -58.72 -48.34 81.5 Favored 'General case' 0 N--CA 1.454 -0.268 0 CA-C-O 120.755 0.312 . . . . 0.0 110.83 177.143 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 42.8 tt0 -56.68 -39.71 74.28 Favored 'General case' 0 CA--C 1.53 0.174 0 C-N-CA 123.631 0.772 . . . . 0.0 111.156 179.598 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 38.1 mt -78.71 -43.99 24.56 Favored 'General case' 0 N--CA 1.448 -0.56 0 C-N-CA 122.952 0.501 . . . . 0.0 112.114 -178.636 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 53.1 t0 -73.57 57.54 0.56 Allowed 'General case' 0 CA--C 1.538 0.493 0 C-N-CA 125.101 1.361 . . . . 0.0 111.361 -177.356 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 16.0 mmtp -61.4 -33.46 73.72 Favored 'General case' 0 C--N 1.333 -0.14 0 C-N-CA 124.083 0.953 . . . . 0.0 112.143 -177.161 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 56' ' ' ASN . . . . . . . . . . . . . 31.5 p30 -75.39 -9.53 58.65 Favored 'General case' 0 CA--C 1.536 0.434 0 N-CA-C 112.203 0.445 . . . . 0.0 112.203 176.775 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . 62.05 32.32 81.87 Favored Glycine 0 CA--C 1.53 0.999 0 CA-C-O 119.235 -0.759 . . . . 0.0 113.374 179.261 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 1.5 p30 -78.35 -6.99 56.76 Favored 'General case' 0 CA--C 1.535 0.381 0 CA-C-N 119.045 1.422 . . . . 0.0 112.634 -179.174 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . 88.02 11.51 67.4 Favored Glycine 0 CA--C 1.53 0.969 0 CA-C-N 118.399 0.545 . . . . 0.0 112.557 177.492 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 31.5 mt-10 -155.41 178.13 10.58 Favored 'General case' 0 N--CA 1.452 -0.331 0 C-N-CA 129.238 3.015 . . . . 0.0 104.944 173.726 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 61' ' ' VAL . . . . . . . . . . . . . 5.1 t -117.02 115.2 48.14 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.193 0 N-CA-C 109.685 -0.487 . . . . 0.0 109.685 -178.599 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 12.6 t -84.89 164.31 18.46 Favored 'General case' 0 CA--C 1.537 0.465 0 C-N-CA 122.65 0.38 . . . . 0.0 111.572 173.537 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 63' ' ' PHE . . . . . . . . . . . . . 64.4 t80 -62.01 -39.63 92.89 Favored 'General case' 0 N--CA 1.464 0.238 0 N-CA-C 112.65 0.611 . . . . 0.0 112.65 -170.044 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 50.9 mt-10 -62.33 -57.09 12.61 Favored 'General case' 0 N--CA 1.453 -0.292 0 N-CA-C 109.639 -0.504 . . . . 0.0 109.639 -178.471 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 20.3 pt-20 -64.28 -34.33 77.88 Favored 'General case' 0 CA--C 1.539 0.547 0 O-C-N 121.639 -0.663 . . . . 0.0 111.425 -179.692 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 17.8 t80 -52.03 -25.4 8.43 Favored 'General case' 0 CA--C 1.538 0.493 0 C-N-CA 123.828 0.851 . . . . 0.0 112.237 169.357 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 67' ' ' GLN . . . . . . . . . . . . . 45.6 mm-40 -54.64 -23.78 18.7 Favored 'General case' 0 CA--C 1.537 0.459 0 CA-C-N 119.745 1.157 . . . . 0.0 113.197 172.473 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 83.0 t -53.96 -33.16 23.55 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.485 0 CA-C-N 119.162 0.892 . . . . 0.0 110.817 170.469 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 19.3 tp -75.47 -53.11 9.2 Favored 'General case' 0 N--CA 1.452 -0.345 0 N-CA-C 108.134 -1.061 . . . . 0.0 108.134 173.163 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 70' ' ' VAL . . . . . . . . . . . . . 58.1 t -50.04 -44.75 22.34 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.352 0 CA-C-N 118.324 0.511 . . . . 0.0 111.74 -175.295 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 5.6 ptpp? -63.36 -37.37 87.01 Favored 'General case' 0 CA--C 1.529 0.169 0 O-C-N 121.573 -0.704 . . . . 0.0 112.127 179.274 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 72' ' ' LYS . . . . . . . . . . . . 0.273 0.1 OUTLIER -68.01 -44.39 76.66 Favored 'General case' 0 N--CA 1.443 -0.817 0 C-N-CA 125.558 1.543 . . . . 0.0 108.616 177.61 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 73' ' ' ILE . . . . . . . . . . . . . 65.3 mt -54.23 -45.7 67.51 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.335 0 O-C-N 121.327 -0.858 . . . . 0.0 109.007 171.503 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 11.1 m -73.03 3.1 5.8 Favored 'General case' 0 CA--C 1.538 0.498 0 N-CA-C 113.167 0.803 . . . . 0.0 113.167 177.983 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 75' ' ' GLN . . . . . . . . . . . . . 71.2 mm-40 . . . . . 0 C--O 1.27 2.144 0 C-N-CA 126.848 2.059 . . . . 0.0 113.135 -177.845 . . . . . . . . 0 0 . 1 . 003 nuclear build full ' A' A ' 1' ' ' LYS . . . . . . . . . . . . . 73.9 mmtt . . . . . 0 N--CA 1.451 -0.394 0 N-CA-C 108.41 -0.959 . . . . 0.0 108.41 . . . . . . . . . 0 0 . 1 . 003 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 86.6 p -79.22 158.99 73.7 Favored Pre-proline 0 CA--C 1.535 0.366 0 N-CA-C 109.178 -0.675 . . . . 0.0 109.178 171.87 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 85.8 Cg_exo -46.46 -39.78 22.52 Favored 'Trans proline' 0 N--CA 1.455 -0.78 0 C-N-CA 122.921 2.414 . . . . 0.0 112.015 168.786 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 2.8 mp0 -61.3 -47.07 87.64 Favored 'General case' 0 N--CA 1.455 -0.175 0 C-N-CA 123.841 0.857 . . . . 0.0 111.942 176.607 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -62.88 -44.23 96.67 Favored 'General case' 0 C--N 1.331 -0.215 0 N-CA-C 108.974 -0.75 . . . . 0.0 108.974 178.108 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 6' ' ' LEU . . . . . 0.475 HD13 HG22 ' A' ' 70' ' ' VAL . 12.8 mt -59.43 -40.58 87.2 Favored 'General case' 0 N--CA 1.449 -0.501 0 C-N-CA 122.646 0.379 . . . . 0.0 111.844 177.047 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 51.7 tptt -58.62 -47.11 85.46 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 118.414 0.552 . . . . 0.0 110.307 170.167 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . -52.89 -54.65 27.47 Favored Glycine 0 CA--C 1.53 0.989 0 N-CA-C 110.744 -0.943 . . . . 0.0 110.744 179.648 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 9' ' ' ILE . . . . . . . . . . . . . 65.9 mt -51.12 -58.14 2.25 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.13 0 C-N-CA 125.407 1.483 . . . . 0.0 109.523 171.639 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 10' ' ' PHE . . . . . . . . . . . . . 23.7 t80 -49.91 -48.11 51.84 Favored 'General case' 0 N--CA 1.442 -0.826 0 O-C-N 122.006 -0.434 . . . . 0.0 110.07 -175.883 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 55.3 mt-10 -64.88 -50.24 67.34 Favored 'General case' 0 N--CA 1.452 -0.33 0 C-N-CA 123.483 0.713 . . . . 0.0 110.636 179.118 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 21.8 ttpt -43.55 -50.37 7.22 Favored 'General case' 0 N--CA 1.461 0.114 0 C-N-CA 124.161 0.984 . . . . 0.0 110.384 175.422 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 59.6 m-85 -78.73 -44.97 22.24 Favored 'General case' 0 N--CA 1.449 -0.475 0 CA-C-N 116.47 -0.332 . . . . 0.0 111.862 -175.137 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -67.52 -35.04 78.34 Favored 'General case' 0 N--CA 1.466 0.342 0 C-N-CA 125.139 1.376 . . . . 0.0 113.24 -176.545 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -58.04 -29.36 65.29 Favored 'General case' 0 N--CA 1.452 -0.373 0 C-N-CA 123.039 0.536 . . . . 0.0 111.455 -178.956 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 9.0 mtmp? -58.69 -50.78 72.62 Favored 'General case' 0 CA--C 1.531 0.245 0 CA-C-N 117.945 0.338 . . . . 0.0 111.298 -176.097 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 31.3 tt0 -75.83 -40.46 54.81 Favored 'General case' 0 N--CA 1.457 -0.082 0 N-CA-C 110.0 -0.37 . . . . 0.0 110.0 177.667 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 163.08 -79.75 0.14 Allowed Glycine 0 C--N 1.335 0.496 0 C-N-CA 120.839 -0.696 . . . . 0.0 112.263 170.043 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 42.4 t0 -63.33 110.31 3.46 Favored Pre-proline 0 CA--C 1.533 0.315 0 CA-C-O 118.35 -0.834 . . . . 0.0 110.265 -169.947 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 20' ' ' PRO . . . . . . . . . . . . . 26.4 Cg_endo -58.1 -21.34 50.48 Favored 'Trans proline' 0 N--CA 1.456 -0.723 0 C-N-CA 122.001 1.801 . . . . 0.0 112.66 -178.72 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 38.8 m-80 -87.56 -7.18 57.87 Favored 'General case' 0 N--CA 1.453 -0.316 0 C-N-CA 124.831 1.253 . . . . 0.0 112.962 -175.521 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 9.9 tt0 -144.89 125.1 13.71 Favored 'General case' 0 CA--C 1.539 0.523 0 CA-C-N 119.294 0.952 . . . . 0.0 113.256 -171.942 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 52.1 mt -96.07 142.98 27.62 Favored 'General case' 0 C--N 1.343 0.284 0 C-N-CA 124.8 1.24 . . . . 0.0 111.423 179.349 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 93.2 p -92.35 174.61 7.2 Favored 'General case' 0 CA--C 1.538 0.512 0 C-N-CA 124.091 0.956 . . . . 0.0 108.974 167.029 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 97.6 mttt -54.6 -49.4 70.51 Favored 'General case' 0 C--N 1.339 0.135 0 O-C-N 121.895 -0.503 . . . . 0.0 111.49 -179.173 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 24.2 mt-10 -63.73 -43.51 96.31 Favored 'General case' 0 CA--C 1.519 -0.215 0 CA-C-O 121.234 0.54 . . . . 0.0 110.414 -175.105 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 57.6 mt-10 -58.22 -47.55 83.14 Favored 'General case' 0 N--CA 1.45 -0.426 0 CA-C-N 115.929 -0.578 . . . . 0.0 109.709 176.149 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 11.4 mt -56.8 -41.3 77.51 Favored 'General case' 0 CA--C 1.511 -0.545 0 N-CA-C 112.932 0.716 . . . . 0.0 112.932 171.683 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 84.8 tttt -61.5 -49.74 75.53 Favored 'General case' 0 C--N 1.324 -0.515 0 CA-C-N 118.747 0.703 . . . . 0.0 109.604 -178.37 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 10.4 mp -60.15 -46.89 88.13 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.394 -0.366 . . . . 0.0 111.101 177.847 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 7.5 tt -51.9 -57.27 9.89 Favored 'General case' 0 C--N 1.333 -0.12 0 C-N-CA 123.652 0.781 . . . . 0.0 109.682 175.366 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 43.2 mt -55.44 -53.61 54.15 Favored 'General case' 0 N--CA 1.454 -0.252 0 C-N-CA 123.994 0.918 . . . . 0.0 109.246 -178.522 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 22.7 tt0 -55.21 -46.48 75.91 Favored 'General case' 0 N--CA 1.451 -0.386 0 C-N-CA 123.665 0.786 . . . . 0.0 111.629 -177.508 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 5.3 m -73.96 -53.11 10.8 Favored 'General case' 0 CA--C 1.532 0.258 0 C-N-CA 120.916 -0.314 . . . . 0.0 111.03 -176.307 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 79.4 mm-40 -91.82 -39.05 11.98 Favored 'General case' 0 N--CA 1.45 -0.442 0 C-N-CA 123.762 0.825 . . . . 0.0 112.751 -166.953 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 17.7 m-85 -134.91 62.99 56.22 Favored Pre-proline 0 CA--C 1.539 0.541 0 N-CA-C 113.22 0.822 . . . . 0.0 113.22 -169.132 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 85.4 Cg_exo -46.84 -34.73 16.59 Favored 'Trans proline' 0 CA--C 1.535 0.551 0 C-N-CA 123.275 2.65 . . . . 0.0 112.924 169.547 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 2.6 p -52.86 -54.66 31.29 Favored 'General case' 0 N--CA 1.447 -0.605 0 C-N-CA 125.777 1.631 . . . . 0.0 109.642 176.731 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 76.5 mt -70.05 -38.36 75.77 Favored 'General case' 0 N--CA 1.451 -0.409 0 C-N-CA 123.776 0.83 . . . . 0.0 111.239 178.785 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 12.0 tp -52.16 -49.23 64.2 Favored 'General case' 0 CA--C 1.53 0.179 0 CA-C-O 121.027 0.441 . . . . 0.0 109.913 176.618 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 9.1 mtpm? -69.28 -49.44 55.99 Favored 'General case' 0 N--CA 1.451 -0.377 0 C-N-CA 123.61 0.764 . . . . 0.0 110.525 176.021 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . -75.73 62.31 2.81 Favored Glycine 0 CA--C 1.527 0.831 0 C-N-CA 124.945 1.26 . . . . 0.0 112.624 -173.876 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 43' ' ' GLY . . . . . . . . . . . . . . . -162.2 149.07 16.94 Favored Glycine 0 CA--C 1.521 0.437 0 N-CA-C 108.393 -1.883 . . . . 0.0 108.393 172.207 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 44' ' ' SER . . . . . . . . . . . . . 3.0 m -63.94 -45.06 90.86 Favored 'General case' 0 N--CA 1.453 -0.303 0 CA-C-N 117.842 0.821 . . . . 0.0 109.757 -179.119 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 41.3 p -152.81 160.95 43.11 Favored 'General case' 0 N--CA 1.452 -0.354 0 N-CA-C 107.177 -1.416 . . . . 0.0 107.177 170.816 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 52.6 tp -52.79 -44.19 66.42 Favored 'General case' 0 N--CA 1.457 -0.115 0 N-CA-C 109.375 -0.602 . . . . 0.0 109.375 168.864 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 5.0 m-20 -55.78 -52.56 63.54 Favored 'General case' 0 N--CA 1.449 -0.495 0 C-N-CA 124.575 1.15 . . . . 0.0 110.602 177.805 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 4.0 tm-20 -53.49 -52.27 60.1 Favored 'General case' 0 C--N 1.331 -0.218 0 C-N-CA 122.512 0.325 . . . . 0.0 110.784 176.22 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 95.6 mt -55.18 -49.53 71.63 Favored 'General case' 0 CA--C 1.529 0.169 0 CA-C-O 121.282 0.563 . . . . 0.0 110.305 178.671 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 50' ' ' PHE . . . . . . . . . . . . . 62.4 t80 -55.49 -50.67 69.3 Favored 'General case' 0 N--CA 1.45 -0.426 0 C-N-CA 123.827 0.851 . . . . 0.0 110.828 -179.115 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 36.0 mt-10 -59.3 -45.93 89.94 Favored 'General case' 0 N--CA 1.454 -0.234 0 C-N-CA 123.289 0.636 . . . . 0.0 110.547 177.994 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 12.5 tm-20 -56.25 -46.16 79.73 Favored 'General case' 0 N--CA 1.456 -0.172 0 C-N-CA 123.358 0.663 . . . . 0.0 110.072 178.708 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 91.6 mt -72.6 -43.34 63.44 Favored 'General case' 0 N--CA 1.45 -0.435 0 C-N-CA 123.021 0.528 . . . . 0.0 112.04 -176.58 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 47.4 t0 -73.54 66.24 1.0 Allowed 'General case' 0 CA--C 1.537 0.459 0 C-N-CA 124.206 1.002 . . . . 0.0 112.206 -172.616 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 14.2 mptt -49.95 -43.64 50.11 Favored 'General case' 0 CA--C 1.531 0.234 0 C-N-CA 124.299 1.04 . . . . 0.0 112.127 173.766 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 56' ' ' ASN . . . . . . . . . . . . . 7.5 p30 -70.71 -14.12 62.33 Favored 'General case' 0 CA--C 1.536 0.432 0 N-CA-C 112.518 0.562 . . . . 0.0 112.518 -177.349 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . 66.99 18.06 68.39 Favored Glycine 0 CA--C 1.53 1.022 0 CA-C-O 119.063 -0.854 . . . . 0.0 114.327 173.038 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 3.0 p-10 -79.64 -3.05 45.42 Favored 'General case' 0 CA--C 1.533 0.318 0 CA-C-N 119.411 1.605 . . . . 0.0 113.058 -177.635 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . 81.55 30.08 37.63 Favored Glycine 0 CA--C 1.528 0.859 0 CA-C-O 119.63 -0.539 . . . . 0.0 111.841 178.903 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 30.3 mt-10 -156.43 176.09 13.16 Favored 'General case' 0 CA--C 1.528 0.129 0 C-N-CA 128.145 2.578 . . . . 0.0 105.924 169.904 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 61' ' ' VAL . . . . . . . . . . . . . 3.5 t -123.57 115.36 45.07 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.183 0 N-CA-C 109.373 -0.603 . . . . 0.0 109.373 179.582 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 62.4 p -77.95 156.96 29.92 Favored 'General case' 0 CA--C 1.532 0.267 0 C-N-CA 123.515 0.726 . . . . 0.0 110.395 177.794 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 63' ' ' PHE . . . . . . . . . . . . . 71.4 t80 -55.11 -34.97 64.15 Favored 'General case' 0 N--CA 1.463 0.207 0 N-CA-C 112.318 0.488 . . . . 0.0 112.318 178.042 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 45.8 mt-10 -58.1 -67.56 0.33 Allowed 'General case' 0 N--CA 1.452 -0.339 0 N-CA-C 109.903 -0.406 . . . . 0.0 109.903 176.78 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 9.8 pt-20 -65.24 -28.55 69.44 Favored 'General case' 0 CA--C 1.534 0.348 0 O-C-N 121.842 -0.536 . . . . 0.0 111.669 -175.015 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 8.2 t80 -49.15 -29.88 5.98 Favored 'General case' 0 CA--C 1.532 0.276 0 C-N-CA 123.391 0.677 . . . . 0.0 112.283 169.102 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 67' ' ' GLN . . . . . . . . . . . . . 97.8 mm-40 -56.86 -19.93 20.25 Favored 'General case' 0 CA--C 1.54 0.571 0 CA-C-N 119.661 1.119 . . . . 0.0 112.933 175.993 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 69.8 t -56.97 -34.29 44.23 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.552 0 CA-C-N 119.61 1.095 . . . . 0.0 110.878 169.472 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 9.4 tt -70.9 -44.36 66.42 Favored 'General case' 0 N--CA 1.456 -0.147 0 N-CA-C 107.179 -1.415 . . . . 0.0 107.179 -179.675 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 70' ' ' VAL . . . . . 0.475 HG22 HD13 ' A' ' 6' ' ' LEU . 22.2 t -58.96 -43.62 89.17 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.371 0 N-CA-C 109.913 -0.403 . . . . 0.0 109.913 176.879 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 79.0 tttt -53.46 -53.59 49.24 Favored 'General case' 0 N--CA 1.455 -0.206 0 C-N-CA 122.88 0.472 . . . . 0.0 110.545 171.628 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 5.5 mptp? -50.34 -45.45 54.98 Favored 'General case' 0 CA--C 1.537 0.475 0 N-CA-C 112.073 0.397 . . . . 0.0 112.073 174.604 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 73' ' ' ILE . . . . . . . . . . . . . 52.2 mt -59.29 -53.65 45.16 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.307 0 CA-C-N 118.361 0.528 . . . . 0.0 110.216 176.302 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 2.5 m 64.06 -39.93 0.22 Allowed 'General case' 0 CA--C 1.537 0.468 0 C-N-CA 128.095 2.558 . . . . 0.0 115.274 -175.54 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 75' ' ' GLN . . . . . . . . . . . . . 38.4 mm-40 . . . . . 0 C--O 1.27 2.156 0 O-C-N 121.418 -0.801 . . . . 0.0 110.487 -174.886 . . . . . . . . 0 0 . 1 . 004 nuclear build full ' A' A ' 1' ' ' LYS . . . . . . . . . . . . . 29.3 mttp . . . . . 0 N--CA 1.45 -0.436 0 N-CA-C 108.469 -0.937 . . . . 0.0 108.469 . . . . . . . . . 0 0 . 1 . 004 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 90.7 p -72.44 153.12 91.99 Favored Pre-proline 0 CA--C 1.534 0.345 0 CA-C-O 118.931 -0.557 . . . . 0.0 110.053 177.639 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 99.2 Cg_exo -44.2 -42.13 13.16 Favored 'Trans proline' 0 N--CA 1.458 -0.58 0 C-N-CA 123.305 2.67 . . . . 0.0 112.463 169.571 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 2.9 mp0 -58.59 -50.33 74.2 Favored 'General case' 0 N--CA 1.454 -0.246 0 C-N-CA 123.762 0.825 . . . . 0.0 111.971 176.473 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 31.9 mt-10 -60.35 -45.57 93.02 Favored 'General case' 0 C--N 1.332 -0.183 0 N-CA-C 109.101 -0.703 . . . . 0.0 109.101 178.254 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 20.2 mt -59.45 -38.03 79.67 Favored 'General case' 0 N--CA 1.446 -0.651 0 C-N-CA 122.841 0.457 . . . . 0.0 111.998 178.116 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 78.3 tttt -64.55 -44.48 90.62 Favored 'General case' 0 N--CA 1.449 -0.504 0 CA-C-N 118.292 0.496 . . . . 0.0 110.664 172.769 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . -54.55 -51.71 50.18 Favored Glycine 0 CA--C 1.529 0.966 0 N-CA-C 109.893 -1.283 . . . . 0.0 109.893 177.709 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 9' ' ' ILE . . . . . . . . . . . . . 63.1 mt -53.84 -56.79 7.46 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.23 0 C-N-CA 125.935 1.694 . . . . 0.0 110.055 173.245 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 10' ' ' PHE . . . . . . . . . . . . . 51.9 t80 -45.97 -53.43 10.01 Favored 'General case' 0 N--CA 1.451 -0.414 0 C-N-CA 123.169 0.588 . . . . 0.0 109.843 179.019 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 44.3 mt-10 -62.8 -51.92 65.21 Favored 'General case' 0 CA--C 1.532 0.265 0 C-N-CA 122.756 0.423 . . . . 0.0 110.731 -178.591 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 26.4 ttpt -45.8 -53.72 9.16 Favored 'General case' 0 C--N 1.338 0.102 0 C-N-CA 125.15 1.38 . . . . 0.0 111.077 178.186 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 57.0 m-85 -77.28 -44.36 30.03 Favored 'General case' 0 N--CA 1.45 -0.44 0 N-CA-C 110.107 -0.331 . . . . 0.0 110.107 -175.456 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -52.99 -45.92 68.07 Favored 'General case' 0 C--O 1.225 -0.204 0 C-N-CA 123.652 0.781 . . . . 0.0 111.897 178.956 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -64.03 -19.78 65.45 Favored 'General case' 0 C--N 1.331 -0.21 0 N-CA-C 113.007 0.743 . . . . 0.0 113.007 178.075 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 36.9 ttmt -71.75 87.32 0.96 Allowed 'General case' 0 N--CA 1.448 -0.563 0 N-CA-C 107.685 -1.228 . . . . 0.0 107.685 -178.952 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 12.1 tm-20 78.57 -46.2 0.41 Allowed 'General case' 0 CA--C 1.531 0.217 0 C-N-CA 126.275 1.83 . . . . 0.0 111.206 -178.102 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . -67.26 176.74 22.29 Favored Glycine 0 CA--C 1.532 1.101 0 CA-C-O 121.833 0.685 . . . . 0.0 111.656 177.387 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 10.5 t70 -79.08 135.59 58.29 Favored Pre-proline 0 CA--C 1.532 0.268 0 N-CA-C 107.486 -1.302 . . . . 0.0 107.486 172.653 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 20' ' ' PRO . . . . . . . . . . . . . 19.2 Cg_endo -52.54 -26.9 30.44 Favored 'Trans proline' 0 CA--C 1.535 0.567 0 C-N-CA 122.919 2.413 . . . . 0.0 113.988 -179.162 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 44.8 m-80 -85.0 -7.59 59.08 Favored 'General case' 0 N--CA 1.453 -0.289 0 C-N-CA 123.779 0.832 . . . . 0.0 112.877 -178.523 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 11.4 tt0 -156.87 117.63 3.64 Favored 'General case' 0 CA--C 1.538 0.482 0 CA-C-N 119.648 1.113 . . . . 0.0 112.903 -169.017 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 19.2 mt -79.66 136.31 36.77 Favored 'General case' 0 C--O 1.234 0.278 0 C-N-CA 124.566 1.146 . . . . 0.0 110.918 179.43 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 12.4 p -97.42 -179.62 4.55 Favored 'General case' 0 CA--C 1.54 0.583 0 N-CA-C 107.322 -1.362 . . . . 0.0 107.322 164.796 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 62.4 mttp -55.14 -47.11 75.55 Favored 'General case' 0 C--O 1.226 -0.135 0 O-C-N 121.941 -0.475 . . . . 0.0 112.157 -173.097 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 34.4 tt0 -64.09 -46.3 84.88 Favored 'General case' 0 N--CA 1.456 -0.173 0 CA-C-N 118.16 0.436 . . . . 0.0 110.62 -174.54 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 2.6 mp0 -54.7 -49.93 69.52 Favored 'General case' 0 N--CA 1.451 -0.414 0 N-CA-C 109.578 -0.527 . . . . 0.0 109.578 175.214 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 9.6 mt -55.88 -43.74 77.48 Favored 'General case' 0 CA--C 1.51 -0.573 0 N-CA-C 113.266 0.839 . . . . 0.0 113.266 173.473 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 84.8 tttt -62.45 -48.54 79.21 Favored 'General case' 0 C--N 1.323 -0.567 0 CA-C-N 118.512 0.596 . . . . 0.0 109.769 -175.858 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 81.5 mt -62.44 -47.51 83.75 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.875 178.905 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 6.7 tt -49.5 -58.22 5.59 Favored 'General case' 0 CA--C 1.522 -0.12 0 C-N-CA 123.979 0.912 . . . . 0.0 109.264 174.023 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 39.9 mt -56.68 -57.99 10.01 Favored 'General case' 0 N--CA 1.451 -0.4 0 C-N-CA 123.533 0.733 . . . . 0.0 109.281 -177.404 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 7.0 tp-100 -52.2 -49.7 63.38 Favored 'General case' 0 N--CA 1.455 -0.206 0 C-N-CA 123.04 0.536 . . . . 0.0 111.161 -176.343 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 11.4 m -75.74 -49.38 18.37 Favored 'General case' 0 N--CA 1.454 -0.258 0 CA-C-N 116.223 -0.444 . . . . 0.0 111.069 -171.574 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 70.4 mm-40 -89.67 -29.25 18.92 Favored 'General case' 0 N--CA 1.45 -0.458 0 C-N-CA 123.362 0.665 . . . . 0.0 111.771 -169.465 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 94.1 m-85 -146.07 65.0 10.47 Favored Pre-proline 0 CA--C 1.537 0.443 0 C-N-CA 124.425 1.09 . . . . 0.0 111.63 -174.66 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 37.9 Cg_endo -58.86 -28.36 87.01 Favored 'Trans proline' 0 N--CA 1.457 -0.675 0 C-N-CA 122.29 1.993 . . . . 0.0 110.894 178.008 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 2.8 p -53.65 -57.1 12.02 Favored 'General case' 0 N--CA 1.447 -0.59 0 C-N-CA 125.992 1.717 . . . . 0.0 109.421 173.279 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 94.2 mt -63.64 -43.95 95.29 Favored 'General case' 0 N--CA 1.452 -0.341 0 C-N-CA 123.768 0.827 . . . . 0.0 110.908 178.754 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 3.2 tm? -52.23 -50.02 62.83 Favored 'General case' 0 CA--C 1.527 0.094 0 CA-C-O 120.954 0.407 . . . . 0.0 110.1 -179.424 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 97.9 mttt -74.35 -63.57 1.21 Allowed 'General case' 0 N--CA 1.45 -0.427 0 CA-C-O 121.757 0.789 . . . . 0.0 110.293 179.368 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . -80.45 68.04 3.4 Favored Glycine 0 CA--C 1.523 0.589 0 C-N-CA 124.59 1.09 . . . . 0.0 110.795 -177.32 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 43' ' ' GLY . . . . . . . . . . . . . . . -163.43 176.83 39.54 Favored Glycine 0 CA--C 1.524 0.594 0 N-CA-C 110.208 -1.157 . . . . 0.0 110.208 176.881 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 44' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -57.18 162.32 2.7 Favored 'General case' 0 N--CA 1.452 -0.344 0 C-N-CA 124.072 0.949 . . . . 0.0 110.123 172.859 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 68.7 p -61.96 155.74 22.88 Favored 'General case' 0 CA--C 1.532 0.286 0 N-CA-C 108.735 -0.839 . . . . 0.0 108.735 173.778 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 66.6 tp -50.27 -46.87 55.41 Favored 'General case' 0 C--O 1.224 -0.246 0 O-C-N 121.968 -0.458 . . . . 0.0 111.714 -171.395 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 5.3 m-20 -60.6 -46.11 91.46 Favored 'General case' 0 N--CA 1.451 -0.4 0 C-N-CA 123.339 0.656 . . . . 0.0 111.542 179.803 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 93.0 mt-10 -59.64 -52.12 66.91 Favored 'General case' 0 N--CA 1.455 -0.181 0 N-CA-C 109.557 -0.535 . . . . 0.0 109.557 177.383 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 46.9 tp -58.47 -46.39 86.71 Favored 'General case' 0 N--CA 1.452 -0.364 0 N-CA-C 109.416 -0.587 . . . . 0.0 109.416 -178.147 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 50' ' ' PHE . . . . . . . . . . . . . 71.2 t80 -54.6 -50.11 68.83 Favored 'General case' 0 N--CA 1.449 -0.497 0 C-N-CA 123.934 0.894 . . . . 0.0 110.249 177.281 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 41.2 tt0 -57.35 -49.84 74.88 Favored 'General case' 0 N--CA 1.453 -0.279 0 C-N-CA 122.275 0.23 . . . . 0.0 110.761 177.411 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 39.9 mt-10 -55.18 -44.57 75.36 Favored 'General case' 0 CA--C 1.53 0.196 0 C-N-CA 123.141 0.576 . . . . 0.0 111.458 178.931 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 84.7 mt -71.3 -42.66 68.38 Favored 'General case' 0 N--CA 1.451 -0.388 0 C-N-CA 122.955 0.502 . . . . 0.0 111.582 -178.879 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 21.4 t0 -70.59 72.08 0.5 Allowed 'General case' 0 CA--C 1.534 0.331 0 C-N-CA 124.289 1.036 . . . . 0.0 110.363 177.553 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 2.7 mmmp? -65.39 -33.08 75.13 Favored 'General case' 0 N--CA 1.452 -0.369 0 C-N-CA 123.071 0.548 . . . . 0.0 111.66 172.941 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 56' ' ' ASN . . . . . . . . . . . . . 1.1 p30 -64.71 -39.46 93.69 Favored 'General case' 0 CA--C 1.535 0.366 0 C-N-CA 122.561 0.344 . . . . 0.0 111.319 -175.864 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . 110.09 -11.24 31.67 Favored Glycine 0 CA--C 1.531 1.049 0 C-N-CA 124.115 0.864 . . . . 0.0 114.09 172.021 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 9.5 p-10 -78.15 11.37 2.35 Favored 'General case' 0 CA--C 1.535 0.367 0 CA-C-N 119.696 1.748 . . . . 0.0 113.84 -171.56 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . 70.33 32.66 68.4 Favored Glycine 0 CA--C 1.526 0.739 0 CA-C-O 118.894 -0.948 . . . . 0.0 112.156 177.596 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 46.9 mt-10 -157.91 171.25 20.6 Favored 'General case' 0 CA--C 1.532 0.254 0 C-N-CA 126.6 1.96 . . . . 0.0 107.466 169.929 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 61' ' ' VAL . . . . . . . . . . . . . 4.4 t -127.78 111.75 25.6 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.408 0 C-N-CA 123.006 0.522 . . . . 0.0 111.213 -169.679 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 8.6 t -83.3 177.4 8.53 Favored 'General case' 0 CA--C 1.537 0.467 0 CA-C-O 121.249 0.547 . . . . 0.0 111.991 172.572 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 63' ' ' PHE . . . . . . . . . . . . . 40.2 t80 -64.97 -47.59 77.06 Favored 'General case' 0 N--CA 1.461 0.086 0 C-N-CA 123.615 0.766 . . . . 0.0 112.723 -168.693 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 23.1 mp0 -59.87 -56.24 24.19 Favored 'General case' 0 N--CA 1.452 -0.342 0 N-CA-C 108.862 -0.792 . . . . 0.0 108.862 -175.984 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 18.0 pt-20 -62.84 -35.1 78.85 Favored 'General case' 0 CA--C 1.537 0.45 0 N-CA-C 112.102 0.408 . . . . 0.0 112.102 179.429 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 7.4 t80 -50.06 -31.73 13.81 Favored 'General case' 0 CA--C 1.535 0.397 0 O-C-N 121.172 -0.955 . . . . 0.0 112.403 169.542 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 67' ' ' GLN . . . . . . . . . . . . . 14.7 mm-40 -55.66 -20.43 14.07 Favored 'General case' 0 CA--C 1.54 0.593 0 CA-C-N 119.388 0.995 . . . . 0.0 113.372 174.265 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 76.8 t -53.63 -28.8 16.58 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.56 0 CA-C-N 119.654 1.116 . . . . 0.0 110.929 169.942 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 31.1 tp -70.69 -39.13 73.66 Favored 'General case' 0 CA--C 1.532 0.27 0 O-C-N 121.094 -1.004 . . . . 0.0 108.293 176.706 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 70' ' ' VAL . . . . . . . . . . . . . 11.5 t -66.54 -36.23 76.8 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.256 0 O-C-N 121.786 -0.571 . . . . 0.0 109.699 176.911 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 79.0 tttt -56.14 -53.35 58.11 Favored 'General case' 0 CA--C 1.532 0.265 0 O-C-N 122.004 -0.435 . . . . 0.0 110.167 168.957 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 2.7 mptm? -49.48 -45.58 47.04 Favored 'General case' 0 CA--C 1.536 0.429 0 N-CA-C 112.106 0.41 . . . . 0.0 112.106 174.601 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 73' ' ' ILE . . . . . . . . . . . . . 98.6 mt -58.75 -56.99 13.12 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.324 0 N-CA-C 109.735 -0.469 . . . . 0.0 109.735 175.542 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 12.0 t -178.18 -70.91 0.01 OUTLIER 'General case' 0 N--CA 1.454 -0.235 0 C-N-CA 126.182 1.793 . . . . 0.0 108.817 178.829 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 75' ' ' GLN . . . . . . . . . . . . . 25.4 mp0 . . . . . 0 C--O 1.27 2.182 0 CA-C-O 121.431 0.634 . . . . 0.0 109.318 -174.134 . . . . . . . . 0 0 . 1 . 005 nuclear build full ' A' A ' 1' ' ' LYS . . . . . . . . . . . . . 2.5 mptp? . . . . . 0 N--CA 1.45 -0.461 0 N-CA-C 108.336 -0.987 . . . . 0.0 108.336 . . . . . . . . . 0 0 . 1 . 005 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 80.7 p -68.7 160.79 75.48 Favored Pre-proline 0 CA--C 1.535 0.39 0 N-CA-C 109.301 -0.629 . . . . 0.0 109.301 169.926 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 98.0 Cg_exo -45.69 -41.91 19.24 Favored 'Trans proline' 0 N--CA 1.459 -0.501 0 C-N-CA 123.168 2.579 . . . . 0.0 112.619 169.803 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 45.0 mt-10 -61.79 -45.51 93.58 Favored 'General case' 0 N--CA 1.454 -0.256 0 C-N-CA 123.046 0.539 . . . . 0.0 111.249 178.152 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 31.7 mt-10 -65.28 -44.3 88.43 Favored 'General case' 0 N--CA 1.45 -0.436 0 N-CA-C 109.108 -0.701 . . . . 0.0 109.108 178.378 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 14.6 mt -55.02 -42.87 73.12 Favored 'General case' 0 N--CA 1.453 -0.323 0 C-N-CA 123.684 0.794 . . . . 0.0 111.075 175.843 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 23.3 tptm -61.53 -52.14 65.7 Favored 'General case' 0 C--O 1.226 -0.136 0 CA-C-N 118.483 0.583 . . . . 0.0 111.113 172.954 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . -51.06 -49.3 43.49 Favored Glycine 0 CA--C 1.533 1.18 0 N-CA-C 111.081 -0.808 . . . . 0.0 111.081 179.297 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 9' ' ' ILE . . . . . . . . . . . . . 3.0 mm -58.81 -55.48 22.9 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.257 0 C-N-CA 126.885 2.074 . . . . 0.0 109.037 176.46 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 10' ' ' PHE . . . . . . . . . . . . . 58.7 t80 -46.15 -52.24 12.61 Favored 'General case' 0 N--CA 1.451 -0.398 0 C-N-CA 123.242 0.617 . . . . 0.0 109.938 177.785 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 52.6 mt-10 -62.06 -51.56 67.49 Favored 'General case' 0 CA--C 1.532 0.287 0 C-N-CA 123.213 0.605 . . . . 0.0 110.738 -179.986 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 67.2 tttt -44.65 -51.91 8.7 Favored 'General case' 0 N--CA 1.462 0.15 0 C-N-CA 124.877 1.271 . . . . 0.0 111.128 177.7 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 58.1 m-85 -77.75 -46.24 22.3 Favored 'General case' 0 N--CA 1.454 -0.259 0 O-C-N 122.304 -0.248 . . . . 0.0 110.645 -175.532 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -56.34 -41.48 76.13 Favored 'General case' 0 C--N 1.332 -0.17 0 C-N-CA 123.491 0.716 . . . . 0.0 111.793 -179.655 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -46.58 -36.06 6.49 Favored 'General case' 0 CA--C 1.53 0.181 0 C-N-CA 124.518 1.127 . . . . 0.0 112.232 177.8 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 46.0 mtmt -59.48 -31.21 69.13 Favored 'General case' 0 CA--C 1.536 0.404 0 CA-C-N 118.464 0.575 . . . . 0.0 111.835 -179.622 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 25.3 tp10 -71.68 -22.06 61.71 Favored 'General case' 0 CA--C 1.532 0.262 0 C-N-CA 123.843 0.857 . . . . 0.0 111.208 175.821 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 108.91 -53.28 0.6 Allowed Glycine 0 CA--C 1.523 0.553 0 N-CA-C 108.694 -1.763 . . . . 0.0 108.694 -171.159 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 42.9 t0 -81.17 112.45 32.99 Favored Pre-proline 0 CA--C 1.537 0.475 0 CA-C-O 118.636 -0.697 . . . . 0.0 110.443 179.548 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 20' ' ' PRO . . . . . . . . . . . . . 41.4 Cg_endo -65.53 -21.79 59.49 Favored 'Trans proline' 0 N--CA 1.458 -0.598 0 C-N-CA 122.059 1.839 . . . . 0.0 113.201 177.143 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 51.0 m-80 -81.51 -4.12 55.04 Favored 'General case' 0 C--O 1.234 0.272 0 N-CA-C 113.58 0.955 . . . . 0.0 113.58 -169.21 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 43.5 tt0 -155.52 130.87 9.59 Favored 'General case' 0 CA--C 1.533 0.322 0 CA-C-N 119.333 0.969 . . . . 0.0 112.428 -168.311 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 40.2 mt -102.66 123.58 46.63 Favored 'General case' 0 N--CA 1.453 -0.283 0 C-N-CA 124.651 1.18 . . . . 0.0 111.85 179.13 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -84.21 170.84 13.33 Favored 'General case' 0 CA--C 1.537 0.471 0 C-N-CA 123.625 0.77 . . . . 0.0 109.591 165.202 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 98.4 mttt -51.14 -49.94 59.85 Favored 'General case' 0 C--N 1.339 0.123 0 N-CA-C 113.333 0.864 . . . . 0.0 113.333 -168.949 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 38.6 tp10 -63.2 -45.12 93.21 Favored 'General case' 0 N--CA 1.456 -0.152 0 O-C-N 121.983 -0.448 . . . . 0.0 111.045 -173.249 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 1.9 mp0 -53.66 -51.19 63.94 Favored 'General case' 0 N--CA 1.452 -0.358 0 N-CA-C 109.598 -0.519 . . . . 0.0 109.598 173.319 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 9.2 mt -55.73 -41.72 74.29 Favored 'General case' 0 CA--C 1.513 -0.472 0 N-CA-C 113.173 0.805 . . . . 0.0 113.173 173.748 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 60.0 tttm -61.82 -51.96 66.13 Favored 'General case' 0 C--N 1.325 -0.494 0 CA-C-N 118.67 0.668 . . . . 0.0 109.82 -177.249 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 10.5 mp -63.2 -44.09 96.32 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.146 -0.479 . . . . 0.0 110.606 -179.936 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 7.4 tt -50.32 -58.25 6.07 Favored 'General case' 0 C--N 1.332 -0.167 0 C-N-CA 123.789 0.835 . . . . 0.0 109.543 173.074 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 29.4 mt -54.19 -62.13 1.85 Allowed 'General case' 0 N--CA 1.455 -0.193 0 C-N-CA 123.561 0.744 . . . . 0.0 109.605 -179.103 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 25.5 tt0 -55.73 -45.08 78.05 Favored 'General case' 0 N--CA 1.452 -0.331 0 C-N-CA 123.575 0.75 . . . . 0.0 111.534 -173.096 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 19.8 m -78.44 -48.0 16.33 Favored 'General case' 0 C--N 1.33 -0.28 0 C-N-CA 122.367 0.267 . . . . 0.0 111.313 -173.376 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 66.7 mm-40 -96.42 -31.02 13.05 Favored 'General case' 0 N--CA 1.45 -0.463 0 N-CA-C 112.766 0.654 . . . . 0.0 112.766 -167.748 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 69.7 m-85 -139.41 60.31 16.5 Favored Pre-proline 0 CA--C 1.53 0.197 0 C-N-CA 123.522 0.729 . . . . 0.0 110.462 -176.205 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 21.1 Cg_endo -55.07 -30.12 68.73 Favored 'Trans proline' 0 N--CA 1.457 -0.669 0 C-N-CA 122.904 2.403 . . . . 0.0 111.956 -172.997 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 1.5 m -54.06 -44.97 71.55 Favored 'General case' 0 N--CA 1.45 -0.449 0 C-N-CA 124.875 1.27 . . . . 0.0 110.314 178.754 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 58.2 mt -65.97 -21.26 66.41 Favored 'General case' 0 N--CA 1.454 -0.241 0 C-N-CA 123.793 0.837 . . . . 0.0 111.986 -177.037 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 21.8 tp -66.38 -29.87 70.14 Favored 'General case' 0 N--CA 1.454 -0.263 0 CA-C-N 117.956 0.344 . . . . 0.0 110.252 175.323 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 2.6 mptp? -87.21 154.74 20.48 Favored 'General case' 0 N--CA 1.438 -1.031 0 N-CA-C 106.646 -1.612 . . . . 0.0 106.646 167.599 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . 77.24 -42.74 1.94 Allowed Glycine 0 CA--C 1.531 1.089 0 O-C-N 121.666 -0.647 . . . . 0.0 112.742 176.145 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 43' ' ' GLY . . . . . . . . . . . . . . . -67.96 69.02 0.32 Allowed Glycine 0 CA--C 1.532 1.145 0 C-N-CA 124.55 1.071 . . . . 0.0 112.323 177.202 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 44' ' ' SER . . . . . . . . . . . . . 80.5 p 34.07 -93.12 0.01 OUTLIER 'General case' 0 N--CA 1.451 -0.394 0 C-N-CA 128.681 2.792 . . . . 0.0 113.988 169.895 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 82.2 p -141.17 167.86 21.16 Favored 'General case' 0 N--CA 1.454 -0.238 0 N-CA-C 105.506 -2.035 . . . . 0.0 105.506 168.709 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 58.8 tp -55.79 -46.88 77.9 Favored 'General case' 0 C--O 1.226 -0.153 0 CA-C-N 118.904 0.774 . . . . 0.0 110.775 174.051 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 5.7 m-20 -61.03 -54.5 44.06 Favored 'General case' 0 N--CA 1.45 -0.431 0 C-N-CA 123.395 0.678 . . . . 0.0 110.788 -179.215 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 59.1 mm-40 -58.29 -43.67 88.17 Favored 'General case' 0 N--CA 1.455 -0.217 0 C-N-CA 120.681 -0.407 . . . . 0.0 110.535 178.676 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 46.5 tp -61.17 -47.47 86.02 Favored 'General case' 0 N--CA 1.452 -0.335 0 N-CA-C 109.746 -0.465 . . . . 0.0 109.746 179.816 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 50' ' ' PHE . . . . . . . . . . . . . 70.4 t80 -51.96 -49.61 62.87 Favored 'General case' 0 C--N 1.331 -0.209 0 C-N-CA 124.022 0.929 . . . . 0.0 110.367 176.595 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 36.0 mt-10 -62.46 -44.11 97.2 Favored 'General case' 0 CA--C 1.532 0.266 0 C-N-CA 122.45 0.3 . . . . 0.0 111.687 177.464 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 34.4 mt-10 -57.36 -40.75 78.75 Favored 'General case' 0 C--N 1.332 -0.183 0 C-N-CA 122.921 0.488 . . . . 0.0 110.962 176.097 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 94.6 mt -66.33 -67.32 0.46 Allowed 'General case' 0 N--CA 1.449 -0.499 0 C-N-CA 123.054 0.542 . . . . 0.0 109.971 176.732 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 39.8 t0 -87.69 74.97 9.07 Favored 'General case' 0 N--CA 1.454 -0.267 0 N-CA-C 108.192 -1.04 . . . . 0.0 108.192 177.368 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 46.7 tptt -81.65 -30.44 32.76 Favored 'General case' 0 N--CA 1.452 -0.342 0 CA-C-N 115.652 -0.703 . . . . 0.0 111.369 179.471 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 56' ' ' ASN . . . . . . . . . . . . . 31.7 p-10 -139.96 29.82 2.06 Favored 'General case' 0 CA--C 1.528 0.131 0 C-N-CA 123.669 0.788 . . . . 0.0 112.029 -170.533 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . -109.48 -97.89 2.49 Favored Glycine 0 C--N 1.339 0.721 0 N-CA-C 108.977 -1.649 . . . . 0.0 108.977 174.576 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 5.1 p-10 -139.81 -45.5 0.44 Allowed 'General case' 0 N--CA 1.446 -0.637 0 C-N-CA 125.625 1.57 . . . . 0.0 111.782 -170.66 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . 158.38 -64.3 0.3 Allowed Glycine 0 CA--C 1.526 0.739 0 N-CA-C 107.931 -2.068 . . . . 0.0 107.931 -173.65 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 11.3 mp0 -78.83 132.29 36.79 Favored 'General case' 0 N--CA 1.454 -0.266 0 N-CA-C 108.375 -0.972 . . . . 0.0 108.375 -177.195 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 61' ' ' VAL . . . . . . . . . . . . . 15.2 t -79.18 110.54 15.01 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.375 0 C-N-CA 123.399 0.68 . . . . 0.0 111.397 -166.42 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 8.7 t -79.36 172.91 13.14 Favored 'General case' 0 CA--C 1.537 0.465 0 CA-C-O 120.815 0.34 . . . . 0.0 111.316 169.668 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 63' ' ' PHE . . . . . . . . . . . . . 55.1 t80 -63.45 -36.83 85.04 Favored 'General case' 0 N--CA 1.464 0.265 0 N-CA-C 113.3 0.852 . . . . 0.0 113.3 -168.679 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 21.1 mp0 -67.55 -58.4 4.77 Favored 'General case' 0 N--CA 1.453 -0.321 0 N-CA-C 108.864 -0.791 . . . . 0.0 108.864 -177.857 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 17.8 pt-20 -59.58 -35.04 73.49 Favored 'General case' 0 CA--C 1.539 0.549 0 O-C-N 121.775 -0.578 . . . . 0.0 111.796 177.351 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 19.2 t80 -51.39 -28.6 13.13 Favored 'General case' 0 CA--C 1.534 0.344 0 O-C-N 121.288 -0.882 . . . . 0.0 112.489 169.89 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 67' ' ' GLN . . . . . . . . . . . . . 74.8 mm-40 -54.38 -23.73 16.85 Favored 'General case' 0 CA--C 1.538 0.497 0 CA-C-N 120.119 1.327 . . . . 0.0 113.063 174.04 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 86.5 t -55.64 -27.93 22.4 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.704 0 CA-C-N 119.44 1.018 . . . . 0.0 111.042 172.079 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 8.4 tt -71.44 -41.03 69.96 Favored 'General case' 0 CA--C 1.529 0.164 0 O-C-N 120.892 -1.13 . . . . 0.0 108.256 176.597 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 70' ' ' VAL . . . . . . . . . . . . . 15.7 t -66.28 -33.61 64.68 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.498 0 O-C-N 121.705 -0.622 . . . . 0.0 109.812 176.642 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 76.7 tttt -57.69 -54.36 47.76 Favored 'General case' 0 N--CA 1.455 -0.222 0 O-C-N 121.81 -0.557 . . . . 0.0 109.973 168.997 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 2.6 mptm? -50.97 -45.41 60.85 Favored 'General case' 0 CA--C 1.536 0.404 0 C-N-CA 122.436 0.295 . . . . 0.0 111.774 174.506 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 73' ' ' ILE . . . . . . . . . . . . . 73.5 mt -57.44 -49.1 81.32 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.23 0 CA-C-N 117.954 0.343 . . . . 0.0 110.454 176.909 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 30.0 t -159.61 -54.32 0.06 Allowed 'General case' 0 C--N 1.333 -0.122 0 N-CA-C 112.667 0.617 . . . . 0.0 112.667 -170.323 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 75' ' ' GLN . . . . . . . . . . . . . 15.8 mm100 . . . . . 0 C--O 1.27 2.146 0 O-C-N 121.85 -0.531 . . . . 0.0 111.371 -167.677 . . . . . . . . 0 0 . 1 . 006 nuclear build full ' A' A ' 1' ' ' LYS . . . . . . . . . . . . . 43.9 mmtm . . . . . 0 N--CA 1.451 -0.397 0 N-CA-C 108.4 -0.963 . . . . 0.0 108.4 . . . . . . . . . 0 0 . 1 . 006 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 86.8 p -70.13 157.6 89.46 Favored Pre-proline 0 CA--C 1.536 0.415 0 CA-C-O 119.012 -0.518 . . . . 0.0 109.869 175.004 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 88.8 Cg_exo -46.34 -42.72 22.25 Favored 'Trans proline' 0 N--CA 1.458 -0.592 0 C-N-CA 123.136 2.557 . . . . 0.0 112.465 169.908 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 45.7 mt-10 -59.25 -48.14 82.72 Favored 'General case' 0 C--O 1.232 0.159 0 C-N-CA 123.504 0.722 . . . . 0.0 111.083 177.687 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 31.6 mt-10 -61.42 -46.22 91.04 Favored 'General case' 0 C--O 1.221 -0.41 0 N-CA-C 108.957 -0.757 . . . . 0.0 108.957 177.263 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 14.8 mt -59.25 -40.38 85.8 Favored 'General case' 0 N--CA 1.451 -0.417 0 C-N-CA 123.596 0.759 . . . . 0.0 111.477 -178.334 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -60.18 -53.93 51.89 Favored 'General case' 0 CA--C 1.53 0.206 0 C-N-CA 123.332 0.653 . . . . 0.0 110.73 170.987 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . -51.84 -49.03 49.57 Favored Glycine 0 CA--C 1.533 1.192 0 N-CA-C 111.295 -0.722 . . . . 0.0 111.295 179.205 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 9' ' ' ILE . . . . . . . . . . . . . 3.4 mm -59.41 -52.07 65.21 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.265 0 C-N-CA 127.416 2.286 . . . . 0.0 109.254 177.339 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 10' ' ' PHE . . . . . . . . . . . . . 51.9 t80 -48.13 -53.21 17.42 Favored 'General case' 0 N--CA 1.45 -0.463 0 N-CA-C 109.306 -0.627 . . . . 0.0 109.306 177.234 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 44.5 mt-10 -60.48 -52.97 62.94 Favored 'General case' 0 CA--C 1.53 0.173 0 C-N-CA 122.438 0.295 . . . . 0.0 110.682 179.411 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 39.4 tttm -43.06 -54.82 4.13 Favored 'General case' 0 N--CA 1.455 -0.177 0 C-N-CA 125.025 1.33 . . . . 0.0 110.668 179.832 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 70.0 m-85 -78.47 -44.1 25.43 Favored 'General case' 0 N--CA 1.454 -0.238 0 CA-C-O 119.533 -0.27 . . . . 0.0 111.386 -176.254 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -52.19 -37.96 56.41 Favored 'General case' 0 N--CA 1.463 0.208 0 C-N-CA 123.351 0.66 . . . . 0.0 112.086 179.118 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -72.28 -14.11 61.68 Favored 'General case' 0 N--CA 1.451 -0.402 0 N-CA-C 113.597 0.962 . . . . 0.0 113.597 179.589 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 64.6 mttm -78.0 62.69 2.84 Favored 'General case' 0 C--N 1.343 0.301 0 CA-C-N 120.345 1.43 . . . . 0.0 109.251 -179.22 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 33.5 mt-10 60.74 116.24 0.01 OUTLIER 'General case' 0 N--CA 1.446 -0.638 0 C-N-CA 127.283 2.233 . . . . 0.0 111.453 -167.388 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 146.18 179.94 22.73 Favored Glycine 0 N--CA 1.447 -0.581 0 N-CA-C 107.616 -2.194 . . . . 0.0 107.616 -173.385 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 30.5 t0 -77.94 121.89 84.73 Favored Pre-proline 0 N--CA 1.45 -0.45 0 N-CA-C 106.06 -1.829 . . . . 0.0 106.06 169.675 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 20' ' ' PRO . . . . . . . . . . . . . 17.8 Cg_endo -53.8 -25.95 36.94 Favored 'Trans proline' 0 CA--C 1.54 0.804 0 C-N-CA 121.956 1.771 . . . . 0.0 112.351 177.844 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 31.9 m-80 -86.22 -7.62 58.4 Favored 'General case' 0 CA--C 1.533 0.314 0 C-N-CA 124.615 1.166 . . . . 0.0 112.97 -179.1 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 25.3 tt0 -155.57 115.53 3.71 Favored 'General case' 0 CA--C 1.538 0.506 0 CA-C-N 119.443 1.02 . . . . 0.0 111.81 -168.907 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 32.3 mt -80.49 128.32 33.45 Favored 'General case' 0 C--O 1.234 0.283 0 C-N-CA 123.513 0.725 . . . . 0.0 112.015 -171.421 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -86.12 175.25 8.63 Favored 'General case' 0 CA--C 1.541 0.629 0 N-CA-C 108.108 -1.071 . . . . 0.0 108.108 166.13 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 98.6 mttt -56.15 -44.83 79.63 Favored 'General case' 0 N--CA 1.456 -0.165 0 C-N-CA 123.394 0.678 . . . . 0.0 112.187 -172.209 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 24.8 mt-10 -65.46 -46.84 78.23 Favored 'General case' 0 CA--C 1.521 -0.136 0 CA-C-O 121.116 0.484 . . . . 0.0 110.551 -173.56 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 2.0 mp0 -53.36 -51.32 62.85 Favored 'General case' 0 N--CA 1.451 -0.424 0 CA-C-N 115.734 -0.666 . . . . 0.0 109.257 174.089 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 8.6 mt -55.42 -42.17 73.77 Favored 'General case' 0 CA--C 1.511 -0.551 0 N-CA-C 113.646 0.98 . . . . 0.0 113.646 173.486 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 84.1 tttt -60.63 -56.67 18.54 Favored 'General case' 0 C--N 1.324 -0.533 0 N-CA-C 108.835 -0.802 . . . . 0.0 108.835 -178.291 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 4.2 mm? -58.37 -43.65 88.54 Favored 'General case' 0 C--N 1.328 -0.341 0 C-N-CA 120.887 -0.325 . . . . 0.0 110.92 -178.348 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 9.3 tt -51.99 -57.85 8.25 Favored 'General case' 0 CA--C 1.53 0.179 0 C-N-CA 123.533 0.733 . . . . 0.0 109.906 173.769 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 38.9 mt -54.46 -58.41 7.58 Favored 'General case' 0 C--N 1.332 -0.159 0 C-N-CA 123.739 0.816 . . . . 0.0 110.309 -178.596 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 23.8 mm100 -52.32 -55.01 24.32 Favored 'General case' 0 N--CA 1.453 -0.277 0 C-N-CA 124.603 1.161 . . . . 0.0 110.846 -176.96 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 11.9 m -74.42 -43.43 56.31 Favored 'General case' 0 N--CA 1.449 -0.479 0 CA-C-N 115.602 -0.727 . . . . 0.0 111.202 -169.558 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 71.8 mm-40 -100.1 -29.36 12.55 Favored 'General case' 0 N--CA 1.448 -0.572 0 N-CA-C 113.583 0.956 . . . . 0.0 113.583 -167.734 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 50.9 m-85 -137.53 63.07 39.36 Favored Pre-proline 0 C--O 1.234 0.276 0 N-CA-C 113.157 0.799 . . . . 0.0 113.157 -171.23 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 57.8 Cg_endo -59.57 -29.41 89.82 Favored 'Trans proline' 0 CA--C 1.539 0.744 0 C-N-CA 121.798 1.665 . . . . 0.0 109.726 169.343 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 1.3 m -62.46 -23.17 66.75 Favored 'General case' 0 N--CA 1.45 -0.44 0 C-N-CA 127.14 2.176 . . . . 0.0 111.561 178.423 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 43.3 mt -90.52 -53.14 4.56 Favored 'General case' 0 N--CA 1.449 -0.518 0 N-CA-C 108.788 -0.819 . . . . 0.0 108.788 169.508 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 27.8 tp -44.25 -50.83 8.73 Favored 'General case' 0 CA--C 1.528 0.101 0 C-N-CA 124.772 1.229 . . . . 0.0 112.592 -172.868 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 32.6 mtmm 20.83 -88.18 0.0 OUTLIER 'General case' 0 N--CA 1.449 -0.522 0 C-N-CA 128.308 2.643 . . . . 0.0 115.711 -179.226 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . -76.82 2.38 59.82 Favored Glycine 0 CA--C 1.532 1.1 0 C-N-CA 124.157 0.884 . . . . 0.0 114.226 -172.042 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 43' ' ' GLY . . . . . . . . . . . . . . . 77.73 -63.42 3.44 Favored Glycine 0 CA--C 1.525 0.717 0 CA-C-N 118.511 1.156 . . . . 0.0 111.356 176.747 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 44' ' ' SER . . . . . . . . . . . . . 46.2 t 52.25 -136.08 1.4 Allowed 'General case' 0 CA--C 1.535 0.385 0 N-CA-C 107.987 -1.116 . . . . 0.0 107.987 -169.608 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 58.3 p -130.5 143.88 51.04 Favored 'General case' 0 N--CA 1.451 -0.378 0 N-CA-C 107.452 -1.314 . . . . 0.0 107.452 167.448 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 22.7 mt -54.62 -42.02 70.69 Favored 'General case' 0 C--O 1.221 -0.438 0 N-CA-C 107.913 -1.143 . . . . 0.0 107.913 173.23 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 5.4 m-20 -53.28 -53.64 47.92 Favored 'General case' 0 N--CA 1.449 -0.521 0 C-N-CA 124.633 1.173 . . . . 0.0 111.66 176.901 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 19.9 tp10 -56.89 -52.06 66.65 Favored 'General case' 0 N--CA 1.456 -0.146 0 N-CA-C 110.403 -0.221 . . . . 0.0 110.403 177.513 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 3.9 mm? -56.08 -45.43 79.35 Favored 'General case' 0 C--O 1.225 -0.213 0 CA-C-O 120.969 0.414 . . . . 0.0 110.264 179.781 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 50' ' ' PHE . . . . . . . . . . . . . 64.9 t80 -58.86 -50.89 72.3 Favored 'General case' 0 N--CA 1.448 -0.533 0 C-N-CA 124.117 0.967 . . . . 0.0 110.084 -178.287 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 24.9 tp10 -59.46 -46.42 88.83 Favored 'General case' 0 N--CA 1.453 -0.306 0 N-CA-C 109.996 -0.372 . . . . 0.0 109.996 178.555 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 13.6 tm-20 -57.44 -44.24 84.54 Favored 'General case' 0 CA--C 1.531 0.231 0 C-N-CA 123.609 0.764 . . . . 0.0 110.493 -179.824 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 84.6 mt -72.09 -45.23 61.47 Favored 'General case' 0 N--CA 1.45 -0.429 0 C-N-CA 123.5 0.72 . . . . 0.0 111.568 -178.363 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 47.1 t0 -75.15 63.86 1.35 Allowed 'General case' 0 CA--C 1.533 0.319 0 C-N-CA 123.699 0.8 . . . . 0.0 110.697 -177.786 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 37.9 mmtm -54.11 -39.42 66.4 Favored 'General case' 0 N--CA 1.455 -0.182 0 C-N-CA 123.501 0.72 . . . . 0.0 112.473 -179.1 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 56' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -78.29 -5.11 51.07 Favored 'General case' 0 CA--C 1.535 0.387 0 N-CA-C 112.943 0.72 . . . . 0.0 112.943 -179.858 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . 61.57 35.87 91.76 Favored Glycine 0 CA--C 1.529 0.926 0 CA-C-O 119.368 -0.684 . . . . 0.0 113.825 172.682 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 1.7 p30 -78.22 -16.11 58.15 Favored 'General case' 0 CA--C 1.534 0.337 0 CA-C-N 118.827 1.314 . . . . 0.0 112.306 179.282 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . 103.92 2.5 45.79 Favored Glycine 0 CA--C 1.53 1.021 0 C-N-CA 124.187 0.899 . . . . 0.0 112.647 179.902 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 59.5 mt-10 -152.77 173.01 15.83 Favored 'General case' 0 CA--C 1.532 0.272 0 C-N-CA 128.126 2.57 . . . . 0.0 106.431 173.577 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 61' ' ' VAL . . . . . . . . . . . . . 8.9 t -108.93 109.54 28.71 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.446 0 CA-C-N 118.554 0.616 . . . . 0.0 110.78 -175.911 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 3.8 m -78.76 154.03 30.31 Favored 'General case' 0 CA--C 1.537 0.45 0 C-N-CA 123.296 0.638 . . . . 0.0 111.107 173.418 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 63' ' ' PHE . . . . . . . . . . . . . 69.7 t80 -51.13 -42.37 60.7 Favored 'General case' 0 CA--C 1.534 0.358 0 C-N-CA 123.524 0.73 . . . . 0.0 112.711 -173.334 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 12.6 pt-20 -59.18 -37.09 76.52 Favored 'General case' 0 CA--C 1.534 0.349 0 N-CA-C 112.746 0.647 . . . . 0.0 112.746 -178.565 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 18.7 pt-20 -91.23 -30.52 16.59 Favored 'General case' 0 CA--C 1.531 0.239 0 C-N-CA 123.091 0.557 . . . . 0.0 110.062 -179.087 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 7.9 t80 -49.97 -27.28 5.17 Favored 'General case' 0 CA--C 1.536 0.421 0 C-N-CA 123.86 0.864 . . . . 0.0 111.071 167.815 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 67' ' ' GLN . . . . . . . . . . . . . 68.9 mm-40 -49.55 -27.61 4.63 Favored 'General case' 0 CA--C 1.537 0.47 0 CA-C-N 119.259 0.936 . . . . 0.0 113.448 171.586 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 69.2 t -53.17 -32.25 18.81 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.58 0 O-C-N 121.368 -0.833 . . . . 0.0 111.368 172.613 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 8.5 tt -71.54 -42.69 67.59 Favored 'General case' 0 N--CA 1.455 -0.192 0 N-CA-C 107.946 -1.131 . . . . 0.0 107.946 178.806 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 70' ' ' VAL . . . . . . . . . . . . . 19.0 t -62.14 -43.03 97.31 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.286 0 N-CA-C 109.721 -0.474 . . . . 0.0 109.721 177.272 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 33.2 ttpt -53.9 -51.1 64.8 Favored 'General case' 0 N--CA 1.455 -0.224 0 C-N-CA 122.748 0.419 . . . . 0.0 110.364 171.598 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 13.7 mptt -53.15 -44.95 68.18 Favored 'General case' 0 CA--C 1.535 0.37 0 N-CA-C 112.608 0.596 . . . . 0.0 112.608 174.929 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 73' ' ' ILE . . . . . . . . . . . . . 88.6 mt -56.32 -50.73 70.24 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.439 0 N-CA-C 109.161 -0.681 . . . . 0.0 109.161 173.322 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 5.7 t 73.14 -62.31 0.47 Allowed 'General case' 0 CA--C 1.53 0.197 0 C-N-CA 126.09 1.756 . . . . 0.0 111.75 175.017 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 75' ' ' GLN . . . . . 0.828 ' OXT' ' OE1' ' A' ' 75' ' ' GLN . 0.7 OUTLIER . . . . . 0 C--O 1.27 2.164 0 C-N-CA 123.884 0.874 . . . . 0.0 109.274 179.148 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 1' ' ' LYS . . . . . . . . . . . . . 33.1 mmtp . . . . . 0 N--CA 1.451 -0.377 0 N-CA-C 108.207 -1.034 . . . . 0.0 108.207 . . . . . . . . . 0 0 . 1 . 007 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 56.6 p -78.92 158.27 75.31 Favored Pre-proline 0 CA--C 1.536 0.435 0 N-CA-C 109.191 -0.67 . . . . 0.0 109.191 175.318 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 97.1 Cg_exo -45.17 -41.29 16.59 Favored 'Trans proline' 0 N--CA 1.458 -0.598 0 C-N-CA 123.271 2.647 . . . . 0.0 112.821 172.392 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 3.0 mp0 -59.06 -49.84 76.34 Favored 'General case' 0 N--CA 1.456 -0.125 0 C-N-CA 123.54 0.736 . . . . 0.0 111.757 176.751 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 46.6 mm-40 -62.63 -43.15 99.53 Favored 'General case' 0 C--N 1.331 -0.204 0 N-CA-C 109.201 -0.666 . . . . 0.0 109.201 179.165 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 12.8 mt -60.34 -36.66 78.49 Favored 'General case' 0 N--CA 1.446 -0.664 0 CA-C-O 119.266 -0.397 . . . . 0.0 111.916 175.67 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 79.3 tttt -64.64 -45.07 88.38 Favored 'General case' 0 N--CA 1.448 -0.55 0 CA-C-N 118.813 0.733 . . . . 0.0 110.526 172.294 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . -52.8 -52.36 39.26 Favored Glycine 0 CA--C 1.53 1.028 0 N-CA-C 110.169 -1.172 . . . . 0.0 110.169 177.253 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 9' ' ' ILE . . . . . . . . . . . . . 15.1 mm -54.19 -58.25 4.12 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.198 0 C-N-CA 125.631 1.572 . . . . 0.0 109.391 173.848 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 10' ' ' PHE . . . . . . . . . . . . . 28.5 t80 -46.05 -51.11 14.3 Favored 'General case' 0 N--CA 1.448 -0.566 0 C-N-CA 123.173 0.589 . . . . 0.0 109.995 179.854 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 48.0 mt-10 -63.4 -49.94 71.81 Favored 'General case' 0 CA--C 1.53 0.195 0 C-N-CA 123.657 0.783 . . . . 0.0 111.037 -179.385 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 41.1 tttp -42.57 -51.16 5.24 Favored 'General case' 0 C--N 1.341 0.212 0 C-N-CA 124.635 1.174 . . . . 0.0 110.649 176.693 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 81.2 m-85 -78.79 -51.27 9.99 Favored 'General case' 0 N--CA 1.452 -0.348 0 CA-C-N 116.521 -0.309 . . . . 0.0 110.504 -178.78 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -56.93 -25.56 57.76 Favored 'General case' 0 N--CA 1.465 0.287 0 C-N-CA 126.347 1.859 . . . . 0.0 114.436 -174.46 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -81.58 -14.5 56.73 Favored 'General case' 0 N--CA 1.453 -0.318 0 CA-C-O 118.276 -0.868 . . . . 0.0 113.278 177.3 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 99.1 mttt -62.77 -57.74 9.86 Favored 'General case' 0 CA--C 1.531 0.248 0 CA-C-N 120.031 1.287 . . . . 0.0 110.174 -174.231 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -154.75 103.28 2.43 Favored 'General case' 0 N--CA 1.449 -0.484 0 CA-C-O 123.381 1.562 . . . . 0.0 111.187 167.7 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 158.99 -151.08 21.97 Favored Glycine 0 CA--C 1.525 0.67 0 N-CA-C 105.585 -3.006 . . . . 0.0 105.585 -169.036 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 11.7 t70 -115.51 146.64 37.06 Favored Pre-proline 0 C--O 1.224 -0.27 0 N-CA-C 106.351 -1.722 . . . . 0.0 106.351 169.767 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 20' ' ' PRO . . . . . . . . . . . . . 10.4 Cg_endo -50.15 -23.64 9.91 Favored 'Trans proline' 0 CA--C 1.542 0.902 0 C-N-CA 121.978 1.785 . . . . 0.0 114.546 176.92 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 38.9 m-80 -98.88 -1.96 38.85 Favored 'General case' 0 CA--C 1.538 0.486 0 C-N-CA 125.395 1.478 . . . . 0.0 112.827 -178.955 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 4.4 tp60 -145.22 116.84 8.1 Favored 'General case' 0 CA--C 1.55 0.964 0 C-N-CA 124.684 1.194 . . . . 0.0 112.42 -168.152 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 44.3 mt -91.71 128.83 37.7 Favored 'General case' 0 C--N 1.344 0.331 0 C-N-CA 124.592 1.157 . . . . 0.0 112.578 -175.354 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 98.3 p -79.4 167.71 20.48 Favored 'General case' 0 CA--C 1.537 0.462 0 C-N-CA 123.779 0.832 . . . . 0.0 109.316 167.665 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 97.4 mttt -54.79 -47.7 73.66 Favored 'General case' 0 C--N 1.339 0.141 0 O-C-N 121.866 -0.521 . . . . 0.0 111.342 -179.421 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 42.2 tt0 -61.41 -44.06 97.79 Favored 'General case' 0 N--CA 1.454 -0.234 0 CA-C-O 120.695 0.283 . . . . 0.0 110.729 -178.138 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 69.5 mt-10 -59.58 -48.8 80.25 Favored 'General case' 0 N--CA 1.448 -0.525 0 N-CA-C 109.717 -0.475 . . . . 0.0 109.717 177.329 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 7.5 mt -54.16 -42.53 69.71 Favored 'General case' 0 CA--C 1.511 -0.549 0 N-CA-C 113.084 0.772 . . . . 0.0 113.084 170.868 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 82.5 tttt -62.46 -50.1 72.81 Favored 'General case' 0 N--CA 1.448 -0.565 0 CA-C-N 118.68 0.673 . . . . 0.0 109.593 -177.304 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 79.1 mt -59.95 -45.43 92.66 Favored 'General case' 0 C--O 1.235 0.341 0 C-N-CA 122.725 0.41 . . . . 0.0 111.506 178.272 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 7.9 tt -53.63 -56.74 14.57 Favored 'General case' 0 N--CA 1.455 -0.188 0 C-N-CA 123.77 0.828 . . . . 0.0 109.169 174.851 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 50.2 mt -55.72 -51.08 68.56 Favored 'General case' 0 N--CA 1.454 -0.267 0 C-N-CA 123.813 0.845 . . . . 0.0 109.751 -178.569 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 35.5 mt-30 -49.51 -54.6 17.01 Favored 'General case' 0 N--CA 1.458 -0.032 0 C-N-CA 123.165 0.586 . . . . 0.0 111.236 176.982 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 6.0 m -70.71 -48.66 53.47 Favored 'General case' 0 N--CA 1.454 -0.267 0 CA-C-N 116.059 -0.519 . . . . 0.0 111.095 -170.93 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 19.6 mm-40 -97.57 -37.34 9.98 Favored 'General case' 0 N--CA 1.45 -0.445 0 C-N-CA 123.759 0.824 . . . . 0.0 113.131 -167.339 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 27.0 m-85 -139.8 65.66 31.89 Favored Pre-proline 0 CA--C 1.536 0.411 0 C-N-CA 122.93 0.492 . . . . 0.0 112.155 -168.744 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 41.5 Cg_endo -61.39 -27.67 83.04 Favored 'Trans proline' 0 N--CA 1.457 -0.669 0 C-N-CA 122.728 2.285 . . . . 0.0 111.779 -178.882 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 2.7 p -55.23 -52.64 62.74 Favored 'General case' 0 N--CA 1.45 -0.451 0 C-N-CA 124.591 1.156 . . . . 0.0 109.36 172.719 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 93.5 mt -72.99 -29.36 62.99 Favored 'General case' 0 N--CA 1.449 -0.517 0 CA-C-N 115.163 -0.926 . . . . 0.0 111.434 179.667 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 15.5 tp -55.38 -50.79 68.79 Favored 'General case' 0 C--N 1.34 0.175 0 CA-C-N 118.485 0.584 . . . . 0.0 109.979 170.506 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 74.1 mmtt -59.63 -60.6 3.58 Favored 'General case' 0 N--CA 1.45 -0.464 0 N-CA-C 108.906 -0.776 . . . . 0.0 108.906 173.739 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . 70.24 -62.02 0.8 Allowed Glycine 0 CA--C 1.531 1.053 0 C-N-CA 125.272 1.415 . . . . 0.0 114.687 168.826 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 43' ' ' GLY . . . . . . . . . . . . . . . 121.21 -77.23 0.33 Allowed Glycine 0 CA--C 1.522 0.479 0 N-CA-C 105.228 -3.149 . . . . 0.0 105.228 -169.011 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 44' ' ' SER . . . . . . . . . . . . . 1.6 m -63.79 141.01 58.93 Favored 'General case' 0 N--CA 1.451 -0.399 0 N-CA-C 108.036 -1.098 . . . . 0.0 108.036 168.221 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 27.4 p -77.74 169.71 17.82 Favored 'General case' 0 C--O 1.234 0.261 0 CA-C-N 118.2 0.454 . . . . 0.0 111.008 -171.252 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 65.1 tp -42.58 -45.67 4.65 Favored 'General case' 0 C--O 1.223 -0.297 0 C-N-CA 125.331 1.452 . . . . 0.0 111.982 178.471 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 6.7 m-20 -58.09 -51.2 70.69 Favored 'General case' 0 N--CA 1.452 -0.369 0 C-N-CA 123.306 0.643 . . . . 0.0 111.392 179.276 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 3.2 mp0 -60.44 -46.93 88.28 Favored 'General case' 0 N--CA 1.457 -0.116 0 N-CA-C 109.983 -0.377 . . . . 0.0 109.983 177.955 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 94.5 mt -56.73 -46.19 81.49 Favored 'General case' 0 C--O 1.225 -0.236 0 N-CA-C 109.946 -0.39 . . . . 0.0 109.946 178.66 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 50' ' ' PHE . . . . . . . . . . . . . 68.7 t80 -57.23 -51.88 67.58 Favored 'General case' 0 N--CA 1.45 -0.446 0 C-N-CA 124.034 0.934 . . . . 0.0 110.457 179.561 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 53.5 mm-40 -57.39 -48.2 79.7 Favored 'General case' 0 CA--C 1.532 0.275 0 CA-C-O 120.594 0.235 . . . . 0.0 110.98 176.559 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 47.5 tp10 -55.3 -44.4 75.7 Favored 'General case' 0 CA--C 1.53 0.204 0 C-N-CA 123.759 0.824 . . . . 0.0 110.865 179.43 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 85.2 mt -69.32 -46.64 66.59 Favored 'General case' 0 N--CA 1.449 -0.5 0 C-N-CA 123.213 0.605 . . . . 0.0 110.923 179.902 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 55.2 t0 -75.51 62.75 1.42 Allowed 'General case' 0 CA--C 1.535 0.402 0 C-N-CA 123.548 0.739 . . . . 0.0 110.57 179.309 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 25.8 mmtm -47.06 -48.09 22.52 Favored 'General case' 0 CA--C 1.528 0.122 0 C-N-CA 124.881 1.272 . . . . 0.0 112.482 179.342 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 56' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -75.9 -6.12 49.36 Favored 'General case' 0 CA--C 1.537 0.451 0 N-CA-C 112.881 0.697 . . . . 0.0 112.881 -177.473 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . 61.33 37.77 94.59 Favored Glycine 0 CA--C 1.528 0.847 0 C-N-CA 123.905 0.764 . . . . 0.0 113.306 171.525 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 2.2 p30 -77.53 -25.29 50.07 Favored 'General case' 0 N--CA 1.455 -0.216 0 CA-C-N 118.36 1.08 . . . . 0.0 111.755 -179.992 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . 127.51 -20.01 5.87 Favored Glycine 0 CA--C 1.525 0.661 0 CA-C-O 118.626 -1.097 . . . . 0.0 112.649 179.778 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . 0.343 0.2 OUTLIER -153.13 149.63 28.25 Favored 'General case' 0 CA--C 1.537 0.469 0 CA-C-N 119.041 1.421 . . . . 0.0 110.735 175.089 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 61' ' ' VAL . . . . . . . . . . . . . 13.6 t -77.23 122.53 32.02 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.42 0 N-CA-C 113.921 1.082 . . . . 0.0 113.921 -164.096 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -77.96 152.09 33.34 Favored 'General case' 0 CA--C 1.536 0.406 0 C-N-CA 123.838 0.855 . . . . 0.0 110.942 174.053 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 63' ' ' PHE . . . . . . . . . . . . . 59.7 t80 -53.81 -31.24 48.38 Favored 'General case' 0 N--CA 1.47 0.566 0 N-CA-C 113.862 1.06 . . . . 0.0 113.862 176.771 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 28.8 mp0 -68.65 -63.52 1.04 Allowed 'General case' 0 N--CA 1.453 -0.318 0 O-C-N 121.581 -0.7 . . . . 0.0 109.112 -179.977 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 18.5 pt-20 -62.27 -28.37 69.67 Favored 'General case' 0 CA--C 1.539 0.522 0 O-C-N 121.274 -0.891 . . . . 0.0 111.828 -179.631 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 12.7 t80 -50.01 -27.54 5.64 Favored 'General case' 0 CA--C 1.534 0.342 0 C-N-CA 123.662 0.785 . . . . 0.0 112.622 169.304 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 67' ' ' GLN . . . . . . . . . . . . . 71.6 mm-40 -55.4 -22.09 18.43 Favored 'General case' 0 CA--C 1.543 0.706 0 CA-C-N 119.812 1.187 . . . . 0.0 112.901 173.925 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 72.5 t -53.23 -29.15 15.65 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.589 0 O-C-N 120.98 -1.075 . . . . 0.0 111.175 169.889 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 18.7 tp -70.91 -42.06 70.42 Favored 'General case' 0 N--CA 1.452 -0.331 0 N-CA-C 107.872 -1.158 . . . . 0.0 107.872 177.438 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 70' ' ' VAL . . . . . . . . . . . . . 24.2 t -62.54 -39.83 85.96 Favored 'Isoleucine or valine' 0 N--CA 1.456 -0.169 0 N-CA-C 109.863 -0.421 . . . . 0.0 109.863 177.077 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 69.9 tttt -53.36 -52.01 60.63 Favored 'General case' 0 CA--C 1.531 0.238 0 O-C-N 122.247 -0.283 . . . . 0.0 110.703 169.925 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 14.3 mptt -55.65 -42.49 75.11 Favored 'General case' 0 CA--C 1.535 0.395 0 N-CA-C 112.083 0.401 . . . . 0.0 112.083 175.568 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 73' ' ' ILE . . . . . . . . . . . . . 94.4 mt -59.61 -58.64 6.2 Favored 'Isoleucine or valine' 0 N--CA 1.462 0.164 0 N-CA-C 109.788 -0.449 . . . . 0.0 109.788 177.103 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 26.2 m -168.54 73.42 0.1 Allowed 'General case' 0 CA--C 1.53 0.185 0 C-N-CA 124.828 1.251 . . . . 0.0 110.097 -171.383 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 75' ' ' GLN . . . . . 0.818 ' CD ' ' OXT' ' A' ' 75' ' ' GLN . 0.1 OUTLIER . . . . . 0 C--O 1.27 2.165 0 O-C-N 121.932 -0.48 . . . . 0.0 109.998 169.14 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 1' ' ' LYS . . . . . 1.04 ' O ' ' OXT' ' A' ' 75' ' ' GLN . 29.0 mtmm . . . . . 0 N--CA 1.451 -0.398 0 N-CA-C 108.52 -0.918 . . . . 0.0 108.52 . . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 84.3 p -68.35 160.85 73.6 Favored Pre-proline 0 CA--C 1.534 0.332 0 C-N-CA 123.62 0.768 . . . . 0.0 111.116 -172.037 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 88.1 Cg_exo -47.58 -37.6 26.96 Favored 'Trans proline' 0 N--CA 1.456 -0.685 0 C-N-CA 122.935 2.424 . . . . 0.0 112.107 168.46 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 40.0 tt0 -63.62 -47.03 83.02 Favored 'General case' 0 N--CA 1.456 -0.164 0 C-N-CA 123.327 0.651 . . . . 0.0 111.293 177.129 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 25.9 mt-10 -60.46 -47.53 85.74 Favored 'General case' 0 N--CA 1.454 -0.241 0 N-CA-C 108.48 -0.933 . . . . 0.0 108.48 176.997 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 17.9 mt -57.75 -37.7 74.08 Favored 'General case' 0 N--CA 1.45 -0.462 0 C-N-CA 123.639 0.776 . . . . 0.0 111.947 178.127 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 21.1 tptm -62.4 -51.84 65.96 Favored 'General case' 0 C--N 1.332 -0.188 0 CA-C-N 118.728 0.695 . . . . 0.0 111.089 171.986 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . -53.95 -50.61 54.16 Favored Glycine 0 CA--C 1.531 1.035 0 N-CA-C 110.136 -1.186 . . . . 0.0 110.136 -179.811 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 9' ' ' ILE . . . . . . . . . . . . . 69.3 mt -55.01 -53.63 32.1 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.385 0 C-N-CA 125.772 1.629 . . . . 0.0 110.27 174.053 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 10' ' ' PHE . . . . . . . . . . . . . 41.0 t80 -49.17 -52.76 24.55 Favored 'General case' 0 N--CA 1.45 -0.457 0 N-CA-C 109.208 -0.664 . . . . 0.0 109.208 179.153 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 50.0 mt-10 -58.91 -50.9 72.3 Favored 'General case' 0 N--CA 1.453 -0.292 0 C-N-CA 122.898 0.479 . . . . 0.0 110.289 -179.468 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 41.0 tttm -48.63 -59.76 3.26 Favored 'General case' 0 CA--C 1.532 0.268 0 C-N-CA 123.462 0.705 . . . . 0.0 111.243 176.879 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 57.8 m-85 -76.57 -30.01 56.87 Favored 'General case' 0 C--O 1.224 -0.26 0 O-C-N 121.913 -0.492 . . . . 0.0 110.946 -169.955 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -66.2 -46.52 77.01 Favored 'General case' 0 N--CA 1.453 -0.275 0 O-C-N 121.932 -0.48 . . . . 0.0 110.259 173.878 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -63.78 -31.94 73.28 Favored 'General case' 0 C--N 1.333 -0.128 0 C-N-CA 123.545 0.738 . . . . 0.0 111.572 176.987 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 9.6 ttpp -61.32 91.27 0.03 OUTLIER 'General case' 0 N--CA 1.451 -0.421 0 N-CA-C 108.962 -0.755 . . . . 0.0 108.962 175.896 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 30.5 mt-10 77.53 -41.49 0.36 Allowed 'General case' 0 CA--C 1.531 0.242 0 C-N-CA 127.425 2.29 . . . . 0.0 112.303 176.715 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . -75.75 -171.93 31.71 Favored Glycine 0 CA--C 1.528 0.9 0 CA-C-O 121.779 0.655 . . . . 0.0 111.992 178.348 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 9.7 t70 -84.59 135.57 40.62 Favored Pre-proline 0 N--CA 1.454 -0.271 0 N-CA-C 107.4 -1.333 . . . . 0.0 107.4 171.412 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 20' ' ' PRO . . . . . . . . . . . . . 13.3 Cg_endo -51.52 -23.9 15.64 Favored 'Trans proline' 0 CA--C 1.535 0.525 0 C-N-CA 123.462 2.775 . . . . 0.0 114.893 -178.389 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 46.4 m-80 -90.39 -2.29 57.96 Favored 'General case' 0 N--CA 1.452 -0.358 0 C-N-CA 123.9 0.88 . . . . 0.0 112.583 -177.257 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 43.6 tt0 -155.79 122.67 5.32 Favored 'General case' 0 CA--C 1.539 0.553 0 CA-C-N 119.799 1.181 . . . . 0.0 113.432 -167.677 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 56.8 mt -89.05 133.16 34.46 Favored 'General case' 0 CA--C 1.532 0.281 0 C-N-CA 124.252 1.021 . . . . 0.0 112.055 -178.682 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 45.1 p -78.27 172.46 13.55 Favored 'General case' 0 CA--C 1.535 0.377 0 C-N-CA 123.534 0.734 . . . . 0.0 109.413 167.676 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 98.0 mttt -57.97 -45.91 85.99 Favored 'General case' 0 C--O 1.226 -0.177 0 O-C-N 121.746 -0.596 . . . . 0.0 109.752 174.34 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 26' ' ' GLU . . . . . 0.421 ' H ' ' CD ' ' A' ' 26' ' ' GLU . 2.0 mp0 -62.57 -48.29 80.12 Favored 'General case' 0 CA--C 1.516 -0.345 0 CA-C-O 121.194 0.521 . . . . 0.0 109.948 -177.311 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 34.2 mt-10 -56.29 -47.37 78.79 Favored 'General case' 0 N--CA 1.449 -0.487 0 CA-C-N 115.467 -0.788 . . . . 0.0 109.661 177.104 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 11.0 mt -55.16 -44.83 75.55 Favored 'General case' 0 CA--C 1.512 -0.496 0 N-CA-C 113.051 0.76 . . . . 0.0 113.051 170.003 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 62.5 tttm -61.73 -48.9 78.64 Favored 'General case' 0 C--N 1.324 -0.533 0 CA-C-N 118.732 0.697 . . . . 0.0 110.019 -176.093 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 4.2 mm? -61.53 -46.07 91.52 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.375 -0.375 . . . . 0.0 111.056 178.142 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 6.0 tt -49.87 -59.17 4.1 Favored 'General case' 0 C--N 1.333 -0.127 0 C-N-CA 123.648 0.779 . . . . 0.0 109.332 173.859 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 49.4 mt -55.78 -58.26 8.58 Favored 'General case' 0 N--CA 1.454 -0.265 0 C-N-CA 123.563 0.745 . . . . 0.0 109.817 -177.738 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 30.0 tt0 -50.97 -52.2 45.03 Favored 'General case' 0 N--CA 1.452 -0.349 0 C-N-CA 124.361 1.064 . . . . 0.0 111.438 -177.807 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 16.3 m -74.54 -49.31 22.4 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.235 -0.439 . . . . 0.0 110.861 -171.26 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 70.8 mm-40 -89.5 -31.99 17.4 Favored 'General case' 0 N--CA 1.449 -0.483 0 C-N-CA 122.7 0.4 . . . . 0.0 111.77 -169.4 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 76.4 m-85 -133.84 64.32 66.59 Favored Pre-proline 0 CA--C 1.535 0.366 0 C-N-CA 124.268 1.027 . . . . 0.0 110.235 -175.541 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 44.5 Cg_endo -60.31 -21.83 68.53 Favored 'Trans proline' 0 N--CA 1.457 -0.649 0 C-N-CA 122.995 2.463 . . . . 0.0 111.867 -178.434 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -63.54 -35.42 80.42 Favored 'General case' 0 N--CA 1.451 -0.406 0 C-N-CA 124.2 1.0 . . . . 0.0 110.297 174.798 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 84.3 mt -90.52 -49.29 6.58 Favored 'General case' 0 N--CA 1.451 -0.398 0 C-N-CA 124.879 1.272 . . . . 0.0 110.298 -176.619 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 59.8 tp 51.2 -73.76 0.01 OUTLIER 'General case' 0 CA--C 1.533 0.324 0 C-N-CA 127.381 2.273 . . . . 0.0 115.174 173.844 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 99.3 mttt -63.85 -40.95 97.78 Favored 'General case' 0 N--CA 1.451 -0.391 0 C-N-CA 124.36 1.064 . . . . 0.0 109.527 169.891 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . 123.21 -53.67 0.73 Allowed Glycine 0 C--N 1.336 0.55 0 C-N-CA 125.967 1.746 . . . . 0.0 108.741 -176.482 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 43' ' ' GLY . . . . . . . . . . . . . . . 174.19 -66.76 0.11 Allowed Glycine 0 C--N 1.332 0.356 0 N-CA-C 105.975 -2.85 . . . . 0.0 105.975 176.208 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 44' ' ' SER . . . . . . . . . . . . . 5.3 p -77.46 176.45 8.87 Favored 'General case' 0 N--CA 1.446 -0.664 0 N-CA-C 107.296 -1.372 . . . . 0.0 107.296 166.682 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 1.9 p -62.91 148.87 46.08 Favored 'General case' 0 N--CA 1.452 -0.337 0 N-CA-C 109.271 -0.64 . . . . 0.0 109.271 171.898 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 62.6 tp -50.49 -45.81 56.59 Favored 'General case' 0 C--O 1.227 -0.084 0 C-N-CA 124.001 0.92 . . . . 0.0 112.606 -169.935 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 5.9 m-20 -57.87 -56.62 19.66 Favored 'General case' 0 N--CA 1.451 -0.415 0 CA-C-O 121.408 0.623 . . . . 0.0 110.129 178.899 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 70.0 mm-40 -54.23 -47.35 72.28 Favored 'General case' 0 N--CA 1.453 -0.323 0 CA-C-N 115.911 -0.586 . . . . 0.0 110.222 178.555 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 6.2 tp -52.8 -53.5 47.55 Favored 'General case' 0 C--O 1.224 -0.283 0 C-N-CA 123.096 0.558 . . . . 0.0 109.921 176.172 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 50' ' ' PHE . . . . . . . . . . . . . 63.1 t80 -52.6 -51.35 60.34 Favored 'General case' 0 N--CA 1.453 -0.299 0 C-N-CA 124.232 1.013 . . . . 0.0 110.486 -179.194 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 2.2 mp0 -56.18 -50.03 72.35 Favored 'General case' 0 CA--C 1.533 0.31 0 CA-C-O 120.529 0.204 . . . . 0.0 111.18 174.89 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 34.6 mt-10 -55.62 -41.75 73.95 Favored 'General case' 0 CA--C 1.531 0.217 0 C-N-CA 123.024 0.53 . . . . 0.0 111.673 179.983 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 76.4 mt -67.04 -54.9 17.16 Favored 'General case' 0 N--CA 1.449 -0.523 0 C-N-CA 122.921 0.488 . . . . 0.0 110.339 177.689 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 11.4 t70 -75.2 79.35 2.33 Favored 'General case' 0 N--CA 1.453 -0.296 0 CA-C-O 121.627 0.727 . . . . 0.0 109.332 -179.136 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 39.9 mmtm -65.08 89.6 0.08 Allowed 'General case' 0 N--CA 1.451 -0.408 0 CA-C-O 121.982 0.896 . . . . 0.0 110.709 173.911 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 56' ' ' ASN . . . . . . . . . . . . 0.264 0.0 OUTLIER 40.83 46.4 2.32 Favored 'General case' 0 C--N 1.325 -0.48 0 C-N-CA 128.87 2.868 . . . . 0.0 114.05 178.703 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . -87.61 -90.53 1.05 Allowed Glycine 0 C--N 1.337 0.608 0 N-CA-C 107.783 -2.127 . . . . 0.0 107.783 171.575 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 6.9 p-10 -137.01 -42.51 0.58 Allowed 'General case' 0 N--CA 1.446 -0.654 0 C-N-CA 125.206 1.402 . . . . 0.0 111.577 -177.986 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . 149.0 -65.9 0.39 Allowed Glycine 0 CA--C 1.523 0.577 0 N-CA-C 108.522 -1.831 . . . . 0.0 108.522 -171.071 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 39.7 mt-10 -74.53 133.73 42.27 Favored 'General case' 0 N--CA 1.455 -0.204 0 N-CA-C 107.615 -1.254 . . . . 0.0 107.615 -174.695 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 61' ' ' VAL . . . . . . . . . . . . . 3.8 t -88.77 111.24 22.35 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.308 0 N-CA-C 112.754 0.65 . . . . 0.0 112.754 -163.913 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 34.3 m -79.45 162.36 25.51 Favored 'General case' 0 CA--C 1.533 0.326 0 C-N-CA 123.094 0.558 . . . . 0.0 111.989 169.876 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 63' ' ' PHE . . . . . . . . . . . . . 57.7 t80 -54.2 -37.89 65.05 Favored 'General case' 0 N--CA 1.464 0.257 0 N-CA-C 113.388 0.885 . . . . 0.0 113.388 -169.568 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 25.3 mp0 -65.39 -57.69 7.72 Favored 'General case' 0 N--CA 1.451 -0.404 0 N-CA-C 109.081 -0.711 . . . . 0.0 109.081 -176.565 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 17.1 pt-20 -61.43 -36.49 80.5 Favored 'General case' 0 CA--C 1.541 0.623 0 O-C-N 121.823 -0.548 . . . . 0.0 111.347 177.478 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 14.6 t80 -52.76 -26.12 13.29 Favored 'General case' 0 CA--C 1.537 0.474 0 C-N-CA 123.943 0.897 . . . . 0.0 112.335 169.922 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 67' ' ' GLN . . . . . . . . . . . . . 60.3 mm-40 -54.82 -23.17 17.06 Favored 'General case' 0 CA--C 1.534 0.337 0 CA-C-N 119.83 1.195 . . . . 0.0 113.077 173.356 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 98.6 t -55.89 -33.76 35.77 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.516 0 CA-C-N 119.341 0.973 . . . . 0.0 110.528 171.526 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 22.5 tp -74.12 -49.92 21.77 Favored 'General case' 0 N--CA 1.455 -0.203 0 N-CA-C 107.754 -1.202 . . . . 0.0 107.754 177.264 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 70' ' ' VAL . . . . . . . . . . . . . 58.9 t -50.55 -42.3 21.59 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.408 0 C-N-CA 123.642 0.777 . . . . 0.0 110.472 179.63 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -51.54 -57.75 8.2 Favored 'General case' 0 N--CA 1.455 -0.204 0 C-N-CA 123.446 0.699 . . . . 0.0 111.053 173.022 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 4.5 mptp? -55.17 -43.5 74.37 Favored 'General case' 0 CA--C 1.534 0.333 0 C-N-CA 122.568 0.347 . . . . 0.0 111.853 176.624 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 73' ' ' ILE . . . . . . . . . . . . . 57.7 mt -58.99 -37.22 66.3 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.375 0 N-CA-C 109.942 -0.392 . . . . 0.0 109.942 175.668 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 25.5 t 60.3 32.18 20.66 Favored 'General case' 0 C--O 1.235 0.313 0 C-N-CA 125.379 1.472 . . . . 0.0 110.408 -174.408 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 75' ' ' GLN . . . . . 1.04 ' OXT' ' O ' ' A' ' 1' ' ' LYS . 4.3 tp-100 . . . . . 0 C--O 1.269 2.109 0 C-N-CA 125.996 1.718 . . . . 0.0 106.612 178.04 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 1' ' ' LYS . . . . . . . . . . . . . 31.8 mtmt . . . . . 0 N--CA 1.452 -0.342 0 N-CA-C 108.561 -0.903 . . . . 0.0 108.561 . . . . . . . . . 0 0 . 1 . 009 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 81.0 p -62.67 157.1 60.63 Favored Pre-proline 0 CA--C 1.532 0.269 0 C-N-CA 122.736 0.414 . . . . 0.0 110.477 -176.287 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 76.3 Cg_exo -48.51 -36.44 31.34 Favored 'Trans proline' 0 N--CA 1.453 -0.856 0 C-N-CA 122.455 2.103 . . . . 0.0 111.821 168.968 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 44.9 mt-10 -62.46 -53.07 60.31 Favored 'General case' 0 CA--C 1.531 0.234 0 C-N-CA 123.807 0.843 . . . . 0.0 111.327 176.77 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 28.7 mt-10 -55.28 -46.85 76.18 Favored 'General case' 0 C--N 1.335 -0.057 0 CA-C-O 121.599 0.714 . . . . 0.0 109.19 176.37 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 58.9 mt -60.65 -35.75 76.98 Favored 'General case' 0 N--CA 1.446 -0.626 0 C-N-CA 124.118 0.967 . . . . 0.0 112.757 178.344 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER -62.24 -47.95 82.11 Favored 'General case' 0 N--CA 1.454 -0.254 0 CA-C-N 119.031 0.832 . . . . 0.0 109.633 170.629 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . -53.75 -52.02 45.07 Favored Glycine 0 CA--C 1.532 1.106 0 N-CA-C 110.698 -0.961 . . . . 0.0 110.698 177.316 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 9' ' ' ILE . . . . . . . . . . . . . 24.0 mm -55.45 -54.45 25.18 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.235 0 C-N-CA 125.341 1.457 . . . . 0.0 109.775 175.152 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 10' ' ' PHE . . . . . . . . . . . . . 34.4 t80 -47.56 -50.75 23.08 Favored 'General case' 0 N--CA 1.45 -0.45 0 C-N-CA 123.445 0.698 . . . . 0.0 109.878 178.872 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 57.7 mt-10 -61.97 -53.14 59.73 Favored 'General case' 0 CA--C 1.53 0.173 0 C-N-CA 122.59 0.356 . . . . 0.0 110.781 178.385 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 39.4 tttm -44.0 -49.64 8.56 Favored 'General case' 0 CA--C 1.527 0.092 0 C-N-CA 124.986 1.314 . . . . 0.0 111.022 178.624 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 57.6 m-85 -78.38 -52.41 8.62 Favored 'General case' 0 N--CA 1.45 -0.437 0 CA-C-O 119.409 -0.329 . . . . 0.0 110.613 -177.64 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -48.01 -60.65 2.45 Favored 'General case' 0 C--N 1.331 -0.199 0 C-N-CA 124.083 0.953 . . . . 0.0 111.043 -179.444 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -55.14 -20.29 9.78 Favored 'General case' 0 CA--C 1.529 0.167 0 C-N-CA 125.148 1.379 . . . . 0.0 113.051 -177.411 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 10.8 ttmm -62.54 -24.52 67.56 Favored 'General case' 0 CA--C 1.535 0.385 0 CA-C-N 118.247 0.476 . . . . 0.0 111.079 -179.657 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 12.2 tm-20 -154.62 -47.48 0.09 Allowed 'General case' 0 C--N 1.341 0.219 0 CA-C-N 118.211 0.459 . . . . 0.0 111.406 -179.877 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . -79.38 175.21 55.13 Favored Glycine 0 CA--C 1.526 0.741 0 N-CA-C 110.526 -1.03 . . . . 0.0 110.526 -179.664 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 8.1 t70 -62.43 140.86 96.6 Favored Pre-proline 0 CA--C 1.535 0.403 0 N-CA-C 107.149 -1.426 . . . . 0.0 107.149 169.216 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 20' ' ' PRO . . . . . . . . . . . . . 12.0 Cg_endo -51.13 -24.87 15.64 Favored 'Trans proline' 0 CA--C 1.536 0.583 0 C-N-CA 123.087 2.525 . . . . 0.0 114.533 -178.042 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 51.8 m-80 -88.58 2.9 52.17 Favored 'General case' 0 CA--C 1.536 0.429 0 C-N-CA 124.77 1.228 . . . . 0.0 113.105 -179.611 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -149.38 116.43 6.01 Favored 'General case' 0 CA--C 1.541 0.619 0 CA-C-N 119.187 0.903 . . . . 0.0 112.683 -169.039 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 77.9 mt -88.2 134.3 33.82 Favored 'General case' 0 CA--C 1.532 0.288 0 C-N-CA 124.563 1.145 . . . . 0.0 111.095 173.654 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 27.5 p -80.38 178.73 8.1 Favored 'General case' 0 CA--C 1.534 0.341 0 N-CA-C 108.543 -0.91 . . . . 0.0 108.543 166.389 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 64.4 mttp -57.98 -38.95 77.01 Favored 'General case' 0 N--CA 1.455 -0.218 0 N-CA-C 109.806 -0.442 . . . . 0.0 109.806 170.127 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 1.8 mp0 -67.95 -50.74 54.13 Favored 'General case' 0 N--CA 1.45 -0.433 0 C-N-CA 122.883 0.473 . . . . 0.0 110.035 -175.755 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 3.0 mp0 -55.79 -44.77 78.1 Favored 'General case' 0 N--CA 1.452 -0.361 0 C-N-CA 119.826 -0.75 . . . . 0.0 110.236 174.87 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 12.7 mt -56.85 -43.43 81.13 Favored 'General case' 0 CA--C 1.513 -0.454 0 CA-C-N 119.067 0.849 . . . . 0.0 113.153 171.798 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 64.5 tttm -60.31 -48.76 80.38 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-N 118.505 0.593 . . . . 0.0 109.679 -178.444 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 87.2 mt -60.16 -47.47 85.8 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.179 -0.464 . . . . 0.0 111.375 178.166 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 7.6 tt -51.99 -57.64 8.87 Favored 'General case' 0 N--CA 1.456 -0.143 0 C-N-CA 124.175 0.99 . . . . 0.0 109.497 175.721 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 47.6 mt -56.0 -54.24 47.21 Favored 'General case' 0 C--O 1.223 -0.298 0 N-CA-C 108.717 -0.845 . . . . 0.0 108.717 -178.54 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 28.3 tt0 -53.65 -49.77 67.21 Favored 'General case' 0 N--CA 1.451 -0.387 0 C-N-CA 123.777 0.831 . . . . 0.0 111.652 -176.296 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 2.1 m -73.75 -52.76 12.1 Favored 'General case' 0 CA--C 1.531 0.223 0 C-N-CA 120.684 -0.407 . . . . 0.0 110.984 -175.546 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 57.3 mm-40 -87.22 -31.91 20.06 Favored 'General case' 0 N--CA 1.448 -0.555 0 C-N-CA 123.183 0.593 . . . . 0.0 112.426 -166.595 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 74.5 m-85 -145.19 64.16 10.64 Favored Pre-proline 0 CA--C 1.534 0.335 0 C-N-CA 123.425 0.69 . . . . 0.0 111.604 -172.341 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 33.5 Cg_endo -58.59 -30.5 92.18 Favored 'Trans proline' 0 N--CA 1.456 -0.73 0 C-N-CA 122.346 2.031 . . . . 0.0 111.538 -177.969 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 10.4 t -65.07 -32.99 74.98 Favored 'General case' 0 N--CA 1.456 -0.152 0 O-C-N 121.7 -0.625 . . . . 0.0 109.91 177.362 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 79.1 mt -82.05 -30.05 31.59 Favored 'General case' 0 N--CA 1.451 -0.382 0 CA-C-O 118.966 -0.54 . . . . 0.0 110.543 177.051 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 13.9 tp -55.55 -51.99 65.24 Favored 'General case' 0 CA--C 1.53 0.201 0 N-CA-C 108.762 -0.829 . . . . 0.0 108.762 169.191 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 35.7 mmtp -64.71 -50.5 66.71 Favored 'General case' 0 N--CA 1.452 -0.346 0 C-N-CA 122.924 0.49 . . . . 0.0 111.365 178.419 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . -54.09 -48.12 64.41 Favored Glycine 0 CA--C 1.528 0.86 0 C-N-CA 124.257 0.932 . . . . 0.0 111.443 -179.378 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 43' ' ' GLY . . . . . . . . . . . . . . . -74.9 63.76 2.37 Favored Glycine 0 CA--C 1.526 0.766 0 N-CA-C 110.061 -1.216 . . . . 0.0 110.061 173.911 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 44' ' ' SER . . . . . . . . . . . . . 27.4 p -26.54 -59.49 0.08 Allowed 'General case' 0 C--N 1.339 0.143 0 C-N-CA 127.933 2.493 . . . . 0.0 112.996 -177.025 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 14.2 p -109.78 134.4 52.06 Favored 'General case' 0 N--CA 1.448 -0.531 0 C-N-CA 124.203 1.001 . . . . 0.0 109.515 170.062 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 19.5 mt -73.26 -46.86 47.48 Favored 'General case' 0 CA--C 1.517 -0.316 0 C-N-CA 124.181 0.992 . . . . 0.0 108.658 -173.25 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 3.4 m-20 -50.3 -44.89 54.23 Favored 'General case' 0 N--CA 1.453 -0.29 0 C-N-CA 125.261 1.425 . . . . 0.0 111.528 -176.219 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 5.9 mp0 -59.57 -48.21 82.53 Favored 'General case' 0 C--N 1.328 -0.327 0 C-N-CA 123.702 0.801 . . . . 0.0 110.468 176.907 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 1.3 tt -58.64 -50.96 71.94 Favored 'General case' 0 CA--C 1.534 0.335 0 CA-C-O 121.824 0.821 . . . . 0.0 109.264 177.573 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 50' ' ' PHE . . . . . . . . . . . . . 52.4 t80 -51.55 -50.55 59.83 Favored 'General case' 0 N--CA 1.452 -0.336 0 C-N-CA 124.778 1.231 . . . . 0.0 110.537 178.246 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 27.0 tp10 -60.81 -43.54 98.06 Favored 'General case' 0 N--CA 1.454 -0.253 0 C-N-CA 122.879 0.472 . . . . 0.0 110.587 177.528 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 12.8 tm-20 -54.61 -43.27 72.05 Favored 'General case' 0 CA--C 1.533 0.316 0 C-N-CA 122.763 0.425 . . . . 0.0 110.756 177.079 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 92.1 mt -68.28 -64.42 0.87 Allowed 'General case' 0 N--CA 1.452 -0.341 0 C-N-CA 122.698 0.399 . . . . 0.0 110.918 175.486 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 18.2 t0 -97.25 95.68 7.89 Favored 'General case' 0 N--CA 1.455 -0.202 0 C-N-CA 124.466 1.106 . . . . 0.0 109.438 178.935 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 74.1 mmtt -70.43 79.52 0.56 Allowed 'General case' 0 N--CA 1.454 -0.259 0 CA-C-O 121.794 0.807 . . . . 0.0 110.454 172.464 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 56' ' ' ASN . . . . . . . . . . . . . 16.8 p-10 28.92 48.81 0.03 OUTLIER 'General case' 0 C--N 1.327 -0.402 0 C-N-CA 130.635 3.574 . . . . 0.0 113.013 -179.543 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . -83.54 -83.0 0.93 Allowed Glycine 0 CA--C 1.524 0.622 0 N-CA-C 109.245 -1.542 . . . . 0.0 109.245 179.445 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 12.5 p-10 -91.63 -22.29 20.36 Favored 'General case' 0 N--CA 1.453 -0.279 0 C-N-CA 124.32 1.048 . . . . 0.0 111.428 179.225 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . 93.61 9.48 60.01 Favored Glycine 0 CA--C 1.53 1.021 0 CA-C-O 119.019 -0.878 . . . . 0.0 112.835 177.916 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 31.7 mt-10 -146.13 173.11 12.49 Favored 'General case' 0 N--CA 1.456 -0.14 0 C-N-CA 127.059 2.144 . . . . 0.0 106.722 172.831 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 61' ' ' VAL . . . . . . . . . . . . . 65.5 t -109.92 103.05 14.87 Favored 'Isoleucine or valine' 0 CA--C 1.529 0.137 0 CA-C-N 118.184 0.447 . . . . 0.0 110.231 -169.164 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 11.9 t -78.81 170.96 15.86 Favored 'General case' 0 CA--C 1.535 0.374 0 CA-C-O 121.16 0.505 . . . . 0.0 111.383 172.52 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 63' ' ' PHE . . . . . . . . . . . . . 57.3 t80 -63.85 -39.58 94.54 Favored 'General case' 0 C--O 1.232 0.137 0 C-N-CA 122.713 0.405 . . . . 0.0 111.332 -173.062 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 50.2 mt-10 -61.4 -58.39 8.41 Favored 'General case' 0 N--CA 1.452 -0.359 0 O-C-N 122.088 -0.383 . . . . 0.0 110.025 -178.745 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 10.8 pt-20 -61.27 -36.4 79.94 Favored 'General case' 0 CA--C 1.537 0.458 0 O-C-N 121.707 -0.621 . . . . 0.0 111.547 178.574 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 24.7 t80 -52.97 -26.68 15.98 Favored 'General case' 0 CA--C 1.54 0.562 0 O-C-N 121.313 -0.867 . . . . 0.0 112.585 169.777 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 67' ' ' GLN . . . . . . . . . . . . . 40.2 mm-40 -54.81 -25.64 29.67 Favored 'General case' 0 CA--C 1.537 0.463 0 CA-C-N 119.819 1.191 . . . . 0.0 112.926 173.051 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 96.5 t -54.58 -32.69 25.53 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.605 0 CA-C-N 118.685 0.675 . . . . 0.0 110.458 172.238 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -77.16 -50.28 13.34 Favored 'General case' 0 N--CA 1.455 -0.211 0 C-N-CA 124.684 1.193 . . . . 0.0 108.696 172.931 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 70' ' ' VAL . . . . . . . . . . . . . 98.0 t -50.64 -45.32 26.69 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.314 0 O-C-N 121.861 -0.525 . . . . 0.0 111.702 -177.674 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 16.1 pttp -60.1 -38.86 84.21 Favored 'General case' 0 CA--C 1.53 0.185 0 O-C-N 121.733 -0.604 . . . . 0.0 111.609 179.24 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 72' ' ' LYS . . . . . . . . . . . . 0.282 0.1 OUTLIER -68.21 -42.03 80.44 Favored 'General case' 0 N--CA 1.441 -0.91 0 C-N-CA 125.551 1.54 . . . . 0.0 108.703 -179.966 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 73' ' ' ILE . . . . . . . . . . . . . 49.0 mm -58.42 -47.46 87.96 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.289 0 CA-C-N 118.722 0.692 . . . . 0.0 109.913 171.635 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 74' ' ' SER . . . . . 0.451 ' C ' ' OXT' ' A' ' 75' ' ' GLN . 19.6 m -61.93 -40.44 95.51 Favored 'General case' 0 CA--C 1.53 0.197 0 C-N-CA 123.312 0.645 . . . . 0.0 111.251 -177.485 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 75' ' ' GLN . . . . . 0.451 ' OXT' ' C ' ' A' ' 74' ' ' SER . 60.6 tt0 . . . . . 0 C--O 1.271 2.204 0 C-N-CA 124.902 1.281 . . . . 0.0 110.893 178.611 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 1' ' ' LYS . . . . . . . . . . . . . 39.4 mmtm . . . . . 0 N--CA 1.45 -0.429 0 N-CA-C 107.793 -1.188 . . . . 0.0 107.793 . . . . . . . . . 0 0 . 1 . 010 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 99.5 p -77.19 158.79 79.21 Favored Pre-proline 0 CA--C 1.534 0.332 0 N-CA-C 108.739 -0.837 . . . . 0.0 108.739 171.248 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 88.6 Cg_exo -48.4 -39.73 35.99 Favored 'Trans proline' 0 N--CA 1.458 -0.587 0 C-N-CA 122.623 2.216 . . . . 0.0 112.58 169.999 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 48.4 mt-10 -60.93 -50.23 74.24 Favored 'General case' 0 C--O 1.232 0.177 0 C-N-CA 123.335 0.654 . . . . 0.0 110.841 177.357 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 45.1 mm-40 -59.58 -46.01 90.18 Favored 'General case' 0 N--CA 1.453 -0.281 0 N-CA-C 108.794 -0.817 . . . . 0.0 108.794 178.008 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 6' ' ' LEU . . . . . 0.422 HD13 HG22 ' A' ' 70' ' ' VAL . 25.6 mt -57.9 -40.1 79.5 Favored 'General case' 0 N--CA 1.445 -0.703 0 CA-C-O 118.653 -0.689 . . . . 0.0 112.333 178.235 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 20.6 tptm -59.5 -52.33 66.02 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 119.506 1.048 . . . . 0.0 110.168 171.94 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . -49.89 -53.84 20.63 Favored Glycine 0 CA--C 1.536 1.372 0 N-CA-C 111.699 -0.561 . . . . 0.0 111.699 177.927 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 9' ' ' ILE . . . . . . . . . . . . . 1.6 mm -53.7 -56.4 9.08 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.163 0 C-N-CA 127.007 2.123 . . . . 0.0 108.825 175.826 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 10' ' ' PHE . . . . . . . . . . . . . 24.0 t80 -49.36 -50.53 39.56 Favored 'General case' 0 N--CA 1.444 -0.732 0 C-N-CA 123.406 0.683 . . . . 0.0 109.374 -179.27 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 53.1 mt-10 -62.41 -48.07 81.31 Favored 'General case' 0 N--CA 1.453 -0.29 0 C-N-CA 123.196 0.598 . . . . 0.0 110.833 -179.147 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 37.1 tttm -44.2 -51.45 8.18 Favored 'General case' 0 CA--C 1.529 0.163 0 C-N-CA 124.006 0.923 . . . . 0.0 111.002 177.207 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 85.1 m-85 -79.38 -49.28 12.61 Favored 'General case' 0 CA--C 1.535 0.376 0 CA-C-O 120.546 0.212 . . . . 0.0 111.12 -177.245 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -55.67 -39.02 70.39 Favored 'General case' 0 N--CA 1.464 0.243 0 C-N-CA 124.532 1.133 . . . . 0.0 112.558 -177.428 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -50.42 -31.34 14.72 Favored 'General case' 0 CA--C 1.532 0.279 0 C-N-CA 123.411 0.684 . . . . 0.0 111.807 175.794 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 7.9 mtmp? -69.58 -30.4 68.17 Favored 'General case' 0 CA--C 1.535 0.395 0 CA-C-N 118.181 0.446 . . . . 0.0 111.388 -179.805 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 49.0 mm-40 -70.4 -48.08 57.82 Favored 'General case' 0 C--N 1.342 0.263 0 N-CA-C 107.961 -1.126 . . . . 0.0 107.961 168.179 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 145.04 -62.98 0.47 Allowed Glycine 0 C--O 1.227 -0.282 0 N-CA-C 108.983 -1.647 . . . . 0.0 108.983 175.916 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 35.1 t0 -65.83 110.68 4.88 Favored Pre-proline 0 CA--C 1.534 0.358 0 CA-C-O 118.548 -0.739 . . . . 0.0 109.117 178.185 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 20' ' ' PRO . . . . . . . . . . . . . 32.8 Cg_endo -59.5 -21.54 62.22 Favored 'Trans proline' 0 N--CA 1.456 -0.725 0 C-N-CA 121.95 1.766 . . . . 0.0 112.414 -178.547 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 41.9 m-80 -85.42 -5.02 59.33 Favored 'General case' 0 N--CA 1.452 -0.331 0 C-N-CA 124.526 1.13 . . . . 0.0 113.205 -174.167 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 27.8 tt0 -142.91 126.34 16.72 Favored 'General case' 0 CA--C 1.543 0.679 0 CA-C-N 119.513 1.051 . . . . 0.0 113.823 -169.553 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 70.4 mt -103.94 138.27 40.75 Favored 'General case' 0 C--N 1.345 0.393 0 C-N-CA 125.451 1.5 . . . . 0.0 112.15 -179.413 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 77.9 p -80.56 172.76 13.34 Favored 'General case' 0 C--O 1.234 0.259 0 C-N-CA 123.966 0.906 . . . . 0.0 109.722 168.021 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 98.3 mttt -55.41 -45.07 76.71 Favored 'General case' 0 C--O 1.226 -0.172 0 N-CA-C 110.169 -0.308 . . . . 0.0 110.169 172.045 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 22.9 mt-10 -65.85 -46.99 76.45 Favored 'General case' 0 CA--C 1.516 -0.336 0 CA-C-O 120.785 0.326 . . . . 0.0 110.559 -175.96 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -61.67 -39.92 93.12 Favored 'General case' 0 C--N 1.327 -0.374 0 C-N-CA 120.062 -0.655 . . . . 0.0 110.056 177.844 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 13.5 mt -57.47 -47.59 81.45 Favored 'General case' 0 C--O 1.218 -0.593 0 CA-C-N 119.346 0.975 . . . . 0.0 111.897 168.554 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 38.4 ttpt -58.08 -47.26 83.75 Favored 'General case' 0 C--N 1.323 -0.582 0 CA-C-N 119.002 0.819 . . . . 0.0 110.077 -175.95 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 3.7 mm? -59.59 -48.04 83.2 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.351 -0.386 . . . . 0.0 111.475 175.498 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 7.9 tt -51.23 -57.49 8.67 Favored 'General case' 0 N--CA 1.456 -0.136 0 C-N-CA 123.563 0.745 . . . . 0.0 109.896 176.061 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 48.0 mt -57.93 -51.2 70.62 Favored 'General case' 0 C--O 1.223 -0.292 0 N-CA-C 109.546 -0.539 . . . . 0.0 109.546 -179.247 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 17.5 tt0 -54.67 -44.15 73.05 Favored 'General case' 0 N--CA 1.452 -0.344 0 O-C-N 121.744 -0.597 . . . . 0.0 111.755 -176.598 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 2.1 m -77.85 -49.03 15.07 Favored 'General case' 0 CA--C 1.534 0.36 0 C-N-CA 120.92 -0.312 . . . . 0.0 111.316 -177.611 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 67.1 mm-40 -96.79 -27.9 14.52 Favored 'General case' 0 N--CA 1.451 -0.383 0 N-CA-C 114.015 1.117 . . . . 0.0 114.015 -165.716 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 97.9 m-85 -145.33 70.21 14.19 Favored Pre-proline 0 CA--C 1.538 0.513 0 C-N-CA 124.559 1.144 . . . . 0.0 112.2 -176.592 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 88.9 Cg_exo -47.91 -34.7 23.03 Favored 'Trans proline' 0 N--CA 1.459 -0.544 0 C-N-CA 123.178 2.585 . . . . 0.0 112.944 171.204 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 3.0 p -54.86 -56.65 17.18 Favored 'General case' 0 N--CA 1.45 -0.467 0 C-N-CA 125.151 1.38 . . . . 0.0 109.594 176.758 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 81.4 mt -62.26 -41.1 98.15 Favored 'General case' 0 N--CA 1.449 -0.478 0 CA-C-N 115.334 -0.848 . . . . 0.0 111.04 177.588 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 12.8 tp -53.61 -48.58 69.17 Favored 'General case' 0 CA--C 1.531 0.243 0 CA-C-N 118.183 0.447 . . . . 0.0 110.32 176.268 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 95.3 mttt -74.09 -49.23 24.91 Favored 'General case' 0 N--CA 1.45 -0.427 0 C-N-CA 123.532 0.733 . . . . 0.0 112.678 -174.638 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . -121.26 0.85 11.53 Favored Glycine 0 CA--C 1.528 0.847 0 N-CA-C 115.624 1.01 . . . . 0.0 115.624 -168.283 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 43' ' ' GLY . . . . . . . . . . . . . . . -76.69 65.35 2.86 Favored Glycine 0 CA--C 1.527 0.784 0 CA-C-N 119.055 1.428 . . . . 0.0 110.337 179.46 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 44' ' ' SER . . . . . . . . . . . . . 25.8 t 55.1 -146.59 0.56 Allowed 'General case' 0 CA--C 1.535 0.367 0 C-N-CA 123.801 0.84 . . . . 0.0 108.98 -169.576 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 22.0 p -110.98 146.16 37.14 Favored 'General case' 0 N--CA 1.454 -0.267 0 N-CA-C 106.929 -1.508 . . . . 0.0 106.929 169.005 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 66.9 tp -51.88 -46.94 64.69 Favored 'General case' 0 C--O 1.225 -0.192 0 C-N-CA 123.431 0.692 . . . . 0.0 112.274 -169.509 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 6.2 m-20 -59.21 -51.51 69.66 Favored 'General case' 0 N--CA 1.45 -0.431 0 C-N-CA 123.017 0.527 . . . . 0.0 110.829 -179.54 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 38.1 mm-40 -61.41 -43.96 97.96 Favored 'General case' 0 N--CA 1.453 -0.317 0 CA-C-N 116.291 -0.413 . . . . 0.0 110.394 -179.905 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 67.0 tp -56.99 -50.65 72.05 Favored 'General case' 0 N--CA 1.451 -0.38 0 N-CA-C 109.431 -0.581 . . . . 0.0 109.431 175.724 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 50' ' ' PHE . . . . . . . . . . . . . 65.4 t80 -54.06 -50.85 65.82 Favored 'General case' 0 N--CA 1.45 -0.439 0 C-N-CA 123.806 0.842 . . . . 0.0 110.508 -178.982 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 59.0 mm-40 -58.22 -47.51 83.27 Favored 'General case' 0 CA--C 1.532 0.267 0 CA-C-O 120.629 0.252 . . . . 0.0 111.151 175.683 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 40.7 tt0 -55.28 -40.3 70.87 Favored 'General case' 0 CA--C 1.531 0.238 0 C-N-CA 123.526 0.73 . . . . 0.0 111.338 179.279 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 84.3 mt -77.18 -49.28 15.52 Favored 'General case' 0 N--CA 1.448 -0.567 0 C-N-CA 122.99 0.516 . . . . 0.0 111.492 -179.341 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 43.8 t0 -74.9 59.74 0.92 Allowed 'General case' 0 CA--C 1.536 0.409 0 C-N-CA 123.828 0.851 . . . . 0.0 111.586 -175.799 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 16.4 mmtp -62.21 -33.72 75.11 Favored 'General case' 0 N--CA 1.456 -0.162 0 C-N-CA 123.54 0.736 . . . . 0.0 111.965 -178.104 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 56' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -74.95 -8.15 55.67 Favored 'General case' 0 CA--C 1.536 0.426 0 N-CA-C 112.355 0.502 . . . . 0.0 112.355 175.868 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . 63.17 36.63 93.7 Favored Glycine 0 CA--C 1.527 0.831 0 C-N-CA 123.724 0.678 . . . . 0.0 113.458 172.01 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 1.6 p30 -78.42 -13.1 59.99 Favored 'General case' 0 CA--C 1.534 0.344 0 CA-C-N 118.697 1.248 . . . . 0.0 112.362 179.198 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . 100.27 -0.72 55.93 Favored Glycine 0 CA--C 1.53 1.016 0 C-N-CA 123.821 0.724 . . . . 0.0 112.368 179.172 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 42.0 mt-10 -147.47 170.95 16.32 Favored 'General case' 0 N--CA 1.452 -0.338 0 C-N-CA 127.626 2.371 . . . . 0.0 106.137 173.528 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 61' ' ' VAL . . . . . . . . . . . . . 16.1 t -102.32 116.22 45.61 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.149 0 N-CA-C 108.807 -0.812 . . . . 0.0 108.807 -179.028 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 78.3 p -79.99 156.67 27.08 Favored 'General case' 0 CA--C 1.537 0.458 0 C-N-CA 122.934 0.493 . . . . 0.0 111.248 174.966 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 63' ' ' PHE . . . . . . . . . . . . . 77.2 t80 -56.11 -32.88 64.59 Favored 'General case' 0 N--CA 1.467 0.383 0 N-CA-C 113.31 0.856 . . . . 0.0 113.31 -178.361 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 13.0 tp10 -65.42 -62.45 1.52 Allowed 'General case' 0 N--CA 1.453 -0.288 0 O-C-N 121.882 -0.511 . . . . 0.0 109.624 178.495 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 12.0 pt-20 -64.97 -27.15 68.64 Favored 'General case' 0 CA--C 1.54 0.578 0 O-C-N 121.182 -0.948 . . . . 0.0 111.553 -177.023 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 15.5 t80 -50.97 -27.53 7.86 Favored 'General case' 0 CA--C 1.534 0.33 0 C-N-CA 123.499 0.72 . . . . 0.0 112.176 168.828 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 67' ' ' GLN . . . . . . . . . . . . . 66.8 mm-40 -53.88 -24.29 15.45 Favored 'General case' 0 CA--C 1.54 0.559 0 CA-C-N 119.814 1.188 . . . . 0.0 113.058 173.314 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 97.2 t -57.06 -31.26 36.46 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.631 0 O-C-N 121.043 -1.036 . . . . 0.0 111.24 171.796 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 7.5 tt -71.93 -44.22 63.99 Favored 'General case' 0 N--CA 1.457 -0.094 0 N-CA-C 107.721 -1.214 . . . . 0.0 107.721 177.959 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 70' ' ' VAL . . . . . 0.422 HG22 HD13 ' A' ' 6' ' ' LEU . 18.2 t -60.06 -42.77 90.94 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.286 0 N-CA-C 109.804 -0.443 . . . . 0.0 109.804 178.07 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 55.0 tttm -51.59 -57.48 9.01 Favored 'General case' 0 N--CA 1.454 -0.241 0 N-CA-C 109.668 -0.493 . . . . 0.0 109.668 170.028 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 5.0 mptp? -49.4 -44.71 45.33 Favored 'General case' 0 CA--C 1.533 0.302 0 C-N-CA 123.317 0.647 . . . . 0.0 112.575 177.95 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 73' ' ' ILE . . . . . . . . . . . . . 58.0 mt -58.79 -55.53 22.56 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.226 0 N-CA-C 109.59 -0.522 . . . . 0.0 109.59 174.327 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 98.8 p -61.25 -45.24 95.34 Favored 'General case' 0 CA--C 1.53 0.189 0 N-CA-C 112.143 0.424 . . . . 0.0 112.143 -170.003 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 75' ' ' GLN . . . . . . . . . . . . . 16.3 pt20 . . . . . 0 C--O 1.27 2.154 0 O-C-N 122.148 -0.345 . . . . 0.0 110.137 -179.128 . . . . . . . . 0 0 . 1 . 011 nuclear build full ' A' A ' 1' ' ' LYS . . . . . . . . . . . . . 74.6 mmtt . . . . . 0 N--CA 1.45 -0.434 0 N-CA-C 108.493 -0.928 . . . . 0.0 108.493 . . . . . . . . . 0 0 . 1 . 011 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 84.6 p -69.0 154.64 94.85 Favored Pre-proline 0 CA--C 1.534 0.365 0 N-CA-C 109.711 -0.477 . . . . 0.0 109.711 175.89 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 84.8 Cg_exo -47.38 -36.71 23.8 Favored 'Trans proline' 0 N--CA 1.456 -0.71 0 C-N-CA 122.761 2.307 . . . . 0.0 112.364 169.256 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 44.7 mt-10 -62.71 -48.94 77.06 Favored 'General case' 0 CA--C 1.529 0.162 0 C-N-CA 123.657 0.783 . . . . 0.0 111.395 176.652 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 29.0 mt-10 -60.11 -46.46 89.55 Favored 'General case' 0 C--N 1.332 -0.164 0 N-CA-C 109.148 -0.686 . . . . 0.0 109.148 177.18 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 27.4 mt -60.29 -39.34 86.55 Favored 'General case' 0 N--CA 1.447 -0.585 0 C-N-CA 123.031 0.532 . . . . 0.0 111.953 179.087 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 19.7 tptm -58.86 -49.12 78.92 Favored 'General case' 0 C--N 1.332 -0.175 0 O-C-N 121.678 -0.639 . . . . 0.0 110.046 170.029 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . -51.66 -50.68 41.87 Favored Glycine 0 CA--C 1.529 0.941 0 N-CA-C 110.401 -1.08 . . . . 0.0 110.401 178.686 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 9' ' ' ILE . . . . . . . . . . . . . 24.4 mm -57.6 -54.95 24.52 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.252 0 C-N-CA 125.324 1.45 . . . . 0.0 109.894 175.795 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 10' ' ' PHE . . . . . . . . . . . . . 25.6 t80 -48.36 -50.84 28.97 Favored 'General case' 0 N--CA 1.446 -0.673 0 O-C-N 121.747 -0.596 . . . . 0.0 109.673 179.815 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 43.6 mt-10 -64.4 -46.69 82.21 Favored 'General case' 0 N--CA 1.453 -0.298 0 CA-C-O 118.687 -0.673 . . . . 0.0 111.429 179.596 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 29.2 ttmt -43.37 -53.3 5.41 Favored 'General case' 0 N--CA 1.464 0.24 0 C-N-CA 124.072 0.949 . . . . 0.0 110.469 175.947 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 80.3 m-85 -78.86 -47.84 15.82 Favored 'General case' 0 N--CA 1.451 -0.392 0 CA-C-N 116.544 -0.298 . . . . 0.0 110.829 -175.346 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -56.75 -45.48 81.99 Favored 'General case' 0 CA--C 1.533 0.32 0 CA-C-O 121.654 0.74 . . . . 0.0 112.1 -177.919 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -53.33 -30.39 38.96 Favored 'General case' 0 CA--C 1.53 0.193 0 C-N-CA 123.96 0.904 . . . . 0.0 111.777 175.967 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 15.4 ttmm -63.15 -33.86 76.38 Favored 'General case' 0 CA--C 1.533 0.302 0 CA-C-N 117.835 0.289 . . . . 0.0 110.484 178.864 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 6.0 tp10 -73.94 -49.18 25.87 Favored 'General case' 0 C--N 1.341 0.209 0 N-CA-C 108.572 -0.899 . . . . 0.0 108.572 171.355 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 153.63 -63.68 0.36 Allowed Glycine 0 CA--C 1.521 0.421 0 N-CA-C 109.701 -1.36 . . . . 0.0 109.701 175.081 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 43.9 t0 -67.52 113.8 16.04 Favored Pre-proline 0 CA--C 1.533 0.306 0 CA-C-O 118.304 -0.855 . . . . 0.0 109.26 -179.9 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 20' ' ' PRO . . . . . . . . . . . . . 29.3 Cg_endo -61.52 -20.0 66.87 Favored 'Trans proline' 0 N--CA 1.456 -0.702 0 C-N-CA 121.91 1.74 . . . . 0.0 113.124 179.505 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 43.1 m-80 -89.81 -6.14 56.22 Favored 'General case' 0 CA--C 1.531 0.228 0 C-N-CA 124.539 1.136 . . . . 0.0 113.601 -170.571 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 30.0 tt0 -148.09 126.35 12.24 Favored 'General case' 0 CA--C 1.541 0.606 0 CA-C-N 119.39 0.995 . . . . 0.0 112.492 -168.138 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 51.2 mt -103.31 135.88 44.13 Favored 'General case' 0 C--N 1.344 0.361 0 C-N-CA 125.295 1.438 . . . . 0.0 111.117 -178.649 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 7.0 p -88.6 178.06 6.61 Favored 'General case' 0 C--O 1.236 0.376 0 N-CA-C 108.475 -0.935 . . . . 0.0 108.475 167.162 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 99.1 mttt -54.16 -43.65 70.77 Favored 'General case' 0 N--CA 1.454 -0.231 0 C-N-CA 122.991 0.516 . . . . 0.0 111.299 -179.754 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 34.3 tt0 -65.84 -46.38 78.73 Favored 'General case' 0 N--CA 1.456 -0.14 0 O-C-N 121.995 -0.441 . . . . 0.0 110.602 -175.636 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 4.1 mp0 -58.39 -45.31 88.57 Favored 'General case' 0 N--CA 1.453 -0.322 0 N-CA-C 109.474 -0.565 . . . . 0.0 109.474 176.609 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 18.9 mt -57.39 -42.02 81.37 Favored 'General case' 0 CA--C 1.512 -0.489 0 C-N-CA 120.288 -0.565 . . . . 0.0 112.262 173.279 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 25.3 ttpp -61.71 -50.96 70.34 Favored 'General case' 0 N--CA 1.447 -0.582 0 CA-C-N 118.725 0.693 . . . . 0.0 109.479 -178.113 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 83.3 mt -59.83 -46.02 90.56 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-O 120.847 0.356 . . . . 0.0 111.398 178.972 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 8.0 tt -53.31 -55.92 20.78 Favored 'General case' 0 C--N 1.332 -0.168 0 C-N-CA 124.002 0.921 . . . . 0.0 109.518 174.695 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 38.4 mt -54.14 -54.39 40.24 Favored 'General case' 0 C--O 1.226 -0.178 0 C-N-CA 123.517 0.727 . . . . 0.0 109.689 -179.412 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 41.2 mt-30 -51.32 -51.84 50.68 Favored 'General case' 0 N--CA 1.457 -0.087 0 C-N-CA 122.954 0.502 . . . . 0.0 111.432 179.249 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 7.0 m -70.19 -53.95 14.93 Favored 'General case' 0 N--CA 1.455 -0.205 0 CA-C-N 116.485 -0.325 . . . . 0.0 111.149 -172.483 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 42.5 mm-40 -94.05 -34.84 12.85 Favored 'General case' 0 N--CA 1.45 -0.438 0 N-CA-C 113.134 0.79 . . . . 0.0 113.134 -167.671 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 17.3 m-85 -133.05 56.41 21.77 Favored Pre-proline 0 CA--C 1.53 0.209 0 C-N-CA 122.626 0.37 . . . . 0.0 111.82 -170.571 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 56.5 Cg_endo -60.57 -27.96 85.77 Favored 'Trans proline' 0 N--CA 1.453 -0.904 0 C-N-CA 122.211 1.941 . . . . 0.0 110.619 -178.974 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -57.7 -32.4 67.34 Favored 'General case' 0 N--CA 1.451 -0.424 0 C-N-CA 125.853 1.661 . . . . 0.0 111.083 -179.202 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 49.7 mt -72.5 -27.5 62.3 Favored 'General case' 0 N--CA 1.45 -0.44 0 C-N-CA 123.016 0.526 . . . . 0.0 111.007 178.229 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 85.3 mt -81.88 69.77 8.64 Favored 'General case' 0 N--CA 1.456 -0.132 0 CA-C-O 123.85 1.786 . . . . 0.0 110.718 -179.095 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -114.94 -151.63 0.49 Allowed 'General case' 0 N--CA 1.437 -1.091 0 C-N-CA 128.848 2.859 . . . . 0.0 105.946 169.592 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . -75.18 52.45 2.57 Favored Glycine 0 CA--C 1.531 1.077 0 O-C-N 121.037 -1.039 . . . . 0.0 111.166 171.633 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 43' ' ' GLY . . . . . . . . . . . . . . . -78.65 60.57 4.06 Favored Glycine 0 CA--C 1.525 0.689 0 N-CA-C 109.999 -1.24 . . . . 0.0 109.999 -177.077 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 44' ' ' SER . . . . . . . . . . . . . 54.3 p 52.22 -102.46 0.13 Allowed 'General case' 0 N--CA 1.442 -0.85 0 C-N-CA 125.8 1.64 . . . . 0.0 110.84 -170.227 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 76.3 p -143.59 159.85 41.71 Favored 'General case' 0 N--CA 1.453 -0.277 0 N-CA-C 106.941 -1.503 . . . . 0.0 106.941 168.836 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 56.8 tp -51.89 -43.83 63.51 Favored 'General case' 0 C--O 1.224 -0.265 0 CA-C-O 120.781 0.324 . . . . 0.0 110.254 170.056 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 5.5 m-20 -56.88 -55.48 33.92 Favored 'General case' 0 N--CA 1.452 -0.325 0 C-N-CA 124.271 1.028 . . . . 0.0 111.313 177.571 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 31.1 mm-40 -59.08 -42.83 91.38 Favored 'General case' 0 C--N 1.331 -0.213 0 O-C-N 122.222 -0.299 . . . . 0.0 111.119 178.692 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 59.1 tp -59.19 -47.42 85.37 Favored 'General case' 0 CA--C 1.531 0.233 0 CA-C-O 121.207 0.527 . . . . 0.0 110.055 176.485 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 50' ' ' PHE . . . . . . . . . . . . . 59.7 t80 -55.03 -49.35 71.78 Favored 'General case' 0 N--CA 1.452 -0.371 0 C-N-CA 123.914 0.885 . . . . 0.0 109.888 178.989 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 78.3 mm-40 -59.2 -46.07 89.4 Favored 'General case' 0 N--CA 1.455 -0.209 0 CA-C-O 120.443 0.163 . . . . 0.0 111.42 175.11 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 36.8 tt0 -52.14 -45.08 64.87 Favored 'General case' 0 CA--C 1.531 0.224 0 C-N-CA 122.735 0.414 . . . . 0.0 111.016 177.651 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 96.4 mt -68.68 -59.58 3.01 Favored 'General case' 0 N--CA 1.451 -0.393 0 C-N-CA 122.982 0.513 . . . . 0.0 110.846 177.655 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 12.0 t0 -113.34 100.14 8.33 Favored 'General case' 0 N--CA 1.455 -0.202 0 C-N-CA 125.648 1.579 . . . . 0.0 110.136 178.209 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 30.6 mmmt -73.67 78.32 1.52 Allowed 'General case' 0 N--CA 1.455 -0.191 0 CA-C-O 122.462 1.125 . . . . 0.0 110.499 174.699 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 56' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER 39.85 38.28 0.44 Allowed 'General case' 0 C--N 1.323 -0.579 0 C-N-CA 130.135 3.374 . . . . 0.0 114.532 179.661 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . -78.97 -80.72 0.74 Allowed Glycine 0 CA--C 1.525 0.677 0 N-CA-C 109.933 -1.267 . . . . 0.0 109.933 -179.8 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 14.2 p-10 -88.61 -8.24 55.03 Favored 'General case' 0 CA--C 1.535 0.369 0 C-N-CA 124.256 1.023 . . . . 0.0 111.644 177.514 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . 69.22 26.54 74.54 Favored Glycine 0 CA--C 1.528 0.875 0 N-CA-C 111.484 -0.647 . . . . 0.0 111.484 -179.315 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 25.6 mt-10 -160.54 175.09 13.11 Favored 'General case' 0 N--CA 1.453 -0.299 0 C-N-CA 128.203 2.601 . . . . 0.0 105.829 -179.826 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 61' ' ' VAL . . . . . . . . . . . . . 98.7 t -113.68 110.2 31.27 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.248 0 N-CA-C 108.924 -0.769 . . . . 0.0 108.924 -179.248 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 4.6 m -79.23 163.21 25.16 Favored 'General case' 0 CA--C 1.535 0.39 0 C-N-CA 124.699 1.2 . . . . 0.0 110.648 174.126 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 63' ' ' PHE . . . . . . . . . . . . . 64.9 t80 -58.48 -34.63 71.1 Favored 'General case' 0 N--CA 1.466 0.33 0 N-CA-C 113.084 0.772 . . . . 0.0 113.084 -177.563 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 12.7 tp10 -65.17 -60.63 2.79 Favored 'General case' 0 CA--C 1.533 0.32 0 O-C-N 121.931 -0.481 . . . . 0.0 109.896 178.255 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 9.9 pt-20 -61.83 -30.9 71.14 Favored 'General case' 0 CA--C 1.539 0.52 0 O-C-N 121.376 -0.827 . . . . 0.0 111.679 -178.506 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 20.6 t80 -51.35 -30.53 18.97 Favored 'General case' 0 CA--C 1.535 0.396 0 O-C-N 121.462 -0.774 . . . . 0.0 112.476 169.019 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 67' ' ' GLN . . . . . . . . . . . . . 77.9 mm-40 -55.52 -23.52 26.77 Favored 'General case' 0 CA--C 1.537 0.461 0 CA-C-N 119.723 1.147 . . . . 0.0 112.769 174.224 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 90.7 t -60.35 -33.09 52.67 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.563 0 CA-C-N 119.512 1.051 . . . . 0.0 110.789 172.068 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 3.2 tm? -72.71 -49.69 29.57 Favored 'General case' 0 N--CA 1.457 -0.085 0 N-CA-C 106.997 -1.483 . . . . 0.0 106.997 -179.35 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 70' ' ' VAL . . . . . . . . . . . . . 22.0 t -55.24 -45.26 77.5 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.406 0 C-N-CA 122.845 0.458 . . . . 0.0 109.982 176.705 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 5.1 ttpm? -54.65 -54.41 42.03 Favored 'General case' 0 N--CA 1.452 -0.327 0 C-N-CA 122.911 0.484 . . . . 0.0 110.328 173.961 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 12.6 mptt -48.7 -46.06 40.03 Favored 'General case' 0 CA--C 1.535 0.391 0 N-CA-C 112.457 0.54 . . . . 0.0 112.457 176.124 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 73' ' ' ILE . . . . . . . . . . . . . 71.2 mt -50.25 -38.06 14.89 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.532 0 CA-C-O 119.157 -0.449 . . . . 0.0 110.857 176.941 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 74' ' ' SER . . . . . 0.555 ' O ' ' OXT' ' A' ' 75' ' ' GLN . 61.0 p 45.27 -94.6 0.02 OUTLIER 'General case' 0 CA--C 1.532 0.287 0 C-N-CA 126.224 1.81 . . . . 0.0 113.145 170.437 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 75' ' ' GLN . . . . . 0.555 ' OXT' ' O ' ' A' ' 74' ' ' SER . 17.7 tt0 . . . . . 0 C--O 1.27 2.181 0 C-N-CA 125.251 1.421 . . . . 0.0 111.015 178.266 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 1' ' ' LYS . . . . . . . . . . . . . 30.2 mmtp . . . . . 0 N--CA 1.45 -0.474 0 N-CA-C 108.31 -0.996 . . . . 0.0 108.31 . . . . . . . . . 0 0 . 1 . 012 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 99.6 p -79.72 157.24 74.64 Favored Pre-proline 0 CA--C 1.533 0.291 0 N-CA-C 109.032 -0.729 . . . . 0.0 109.032 174.988 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 86.2 Cg_exo -48.05 -39.76 33.33 Favored 'Trans proline' 0 N--CA 1.458 -0.616 0 C-N-CA 122.958 2.438 . . . . 0.0 112.015 169.498 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 48.9 mt-10 -62.2 -49.43 75.81 Favored 'General case' 0 N--CA 1.455 -0.191 0 C-N-CA 123.534 0.734 . . . . 0.0 111.105 177.578 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 2.4 tm-20 -62.4 -43.33 99.08 Favored 'General case' 0 CA--C 1.531 0.215 0 N-CA-C 108.414 -0.958 . . . . 0.0 108.414 -179.483 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 31.7 mt -59.99 -39.85 87.15 Favored 'General case' 0 N--CA 1.45 -0.475 0 C-N-CA 124.245 1.018 . . . . 0.0 111.732 176.827 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 54.8 tptt -59.35 -50.46 73.87 Favored 'General case' 0 C--N 1.333 -0.14 0 CA-C-N 118.986 0.812 . . . . 0.0 110.157 170.575 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . -49.22 -53.65 18.57 Favored Glycine 0 CA--C 1.532 1.127 0 N-CA-C 111.246 -0.742 . . . . 0.0 111.246 177.346 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 9' ' ' ILE . . . . . . . . . . . . . 1.6 mm -56.52 -54.49 27.93 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.226 0 C-N-CA 125.81 1.644 . . . . 0.0 109.209 176.565 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 10' ' ' PHE . . . . . . . . . . . . . 19.6 t80 -48.03 -51.35 24.47 Favored 'General case' 0 N--CA 1.447 -0.607 0 C-N-CA 123.304 0.642 . . . . 0.0 109.562 179.574 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 52.8 mt-10 -62.41 -49.89 73.67 Favored 'General case' 0 N--CA 1.455 -0.196 0 C-N-CA 123.374 0.67 . . . . 0.0 110.727 -179.749 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 45.4 tttp -43.78 -50.9 7.63 Favored 'General case' 0 CA--C 1.528 0.098 0 C-N-CA 124.094 0.958 . . . . 0.0 110.87 177.606 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 75.4 m-85 -79.56 -47.92 14.7 Favored 'General case' 0 CA--C 1.528 0.13 0 N-CA-C 111.836 0.31 . . . . 0.0 111.836 -177.937 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -57.07 -31.21 64.98 Favored 'General case' 0 N--CA 1.466 0.354 0 C-N-CA 124.902 1.281 . . . . 0.0 112.859 -178.628 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -58.77 -30.38 67.51 Favored 'General case' 0 N--CA 1.451 -0.421 0 O-C-N 121.872 -0.517 . . . . 0.0 111.472 174.767 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 57.6 mttm -79.1 44.9 0.59 Allowed 'General case' 0 CA--C 1.537 0.46 0 C-N-CA 123.87 0.868 . . . . 0.0 111.929 -172.517 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 33.2 tt0 -170.72 -51.17 0.02 OUTLIER 'General case' 0 N--CA 1.456 -0.171 0 C-N-CA 125.759 1.624 . . . . 0.0 108.076 178.001 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 176.24 -90.49 0.08 OUTLIER Glycine 0 CA--C 1.523 0.535 0 N-CA-C 111.451 -0.659 . . . . 0.0 111.451 173.722 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 26.5 t0 -66.13 112.72 9.78 Favored Pre-proline 0 CA--C 1.535 0.403 0 CA-C-O 118.485 -0.769 . . . . 0.0 110.71 -170.33 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 20' ' ' PRO . . . . . . . . . . . . . 22.9 Cg_endo -58.83 -16.49 31.81 Favored 'Trans proline' 0 CA--C 1.536 0.593 0 C-N-CA 122.472 2.115 . . . . 0.0 113.35 179.869 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 41.9 m-80 -94.05 3.28 55.55 Favored 'General case' 0 CA--C 1.533 0.315 0 C-N-CA 125.303 1.441 . . . . 0.0 113.205 -178.487 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 51.0 tt0 -139.59 124.12 18.25 Favored 'General case' 0 CA--C 1.539 0.555 0 CA-C-N 119.109 0.868 . . . . 0.0 112.134 -176.891 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 60.4 mt -100.16 136.55 39.89 Favored 'General case' 0 C--N 1.343 0.311 0 C-N-CA 123.908 0.883 . . . . 0.0 110.667 175.768 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 99.0 p -88.07 175.44 7.74 Favored 'General case' 0 CA--C 1.535 0.371 0 C-N-CA 123.75 0.82 . . . . 0.0 108.956 167.107 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 98.7 mttt -56.28 -46.17 79.85 Favored 'General case' 0 C--O 1.226 -0.148 0 O-C-N 121.968 -0.457 . . . . 0.0 111.288 179.556 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 29.0 tp10 -64.74 -45.14 87.76 Favored 'General case' 0 N--CA 1.455 -0.177 0 CA-C-O 121.034 0.445 . . . . 0.0 110.719 -177.312 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 58.8 mt-10 -56.88 -47.59 80.12 Favored 'General case' 0 N--CA 1.451 -0.42 0 N-CA-C 109.725 -0.472 . . . . 0.0 109.725 176.069 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 16.1 mt -55.86 -43.85 77.51 Favored 'General case' 0 CA--C 1.513 -0.474 0 N-CA-C 112.783 0.66 . . . . 0.0 112.783 170.994 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 63.3 tttp -59.09 -52.27 66.45 Favored 'General case' 0 C--N 1.323 -0.563 0 CA-C-N 118.839 0.745 . . . . 0.0 109.624 -177.145 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 81.2 mt -58.72 -48.97 79.32 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 115.816 -0.629 . . . . 0.0 110.748 178.866 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 9.6 tt -50.64 -55.12 17.86 Favored 'General case' 0 C--O 1.233 0.216 0 C-N-CA 124.007 0.923 . . . . 0.0 110.17 175.914 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 38.3 mt -56.81 -56.85 16.3 Favored 'General case' 0 N--CA 1.456 -0.174 0 C-N-CA 124.061 0.944 . . . . 0.0 110.086 -178.601 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -57.93 -50.37 73.59 Favored 'General case' 0 N--CA 1.455 -0.217 0 C-N-CA 122.552 0.341 . . . . 0.0 110.635 -175.568 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 9.1 m -65.11 -52.49 55.09 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.477 -0.329 . . . . 0.0 111.232 -175.036 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 76.1 mm-40 -103.58 -24.44 13.4 Favored 'General case' 0 N--CA 1.452 -0.348 0 N-CA-C 114.906 1.447 . . . . 0.0 114.906 -165.361 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 46.5 m-85 -135.77 67.29 64.49 Favored Pre-proline 0 C--O 1.235 0.332 0 CA-C-N 119.263 0.938 . . . . 0.0 112.624 -171.795 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 65.5 Cg_endo -62.67 -21.41 72.92 Favored 'Trans proline' 0 N--CA 1.453 -0.866 0 C-N-CA 122.174 1.916 . . . . 0.0 110.243 169.123 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 4.5 p -55.79 -67.74 0.26 Allowed 'General case' 0 N--CA 1.447 -0.587 0 C-N-CA 125.371 1.468 . . . . 0.0 109.134 169.908 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 65.3 mt -47.59 -45.69 27.57 Favored 'General case' 0 C--O 1.231 0.131 0 C-N-CA 123.512 0.725 . . . . 0.0 110.939 176.579 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 23.7 tp -53.48 -26.28 19.87 Favored 'General case' 0 CA--C 1.536 0.423 0 N-CA-C 113.142 0.793 . . . . 0.0 113.142 -177.409 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 62.8 mtpt -49.33 -36.58 21.67 Favored 'General case' 0 CA--C 1.531 0.228 0 CA-C-N 119.004 0.82 . . . . 0.0 112.299 173.129 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . -48.57 -31.73 9.85 Favored Glycine 0 CA--C 1.533 1.157 0 C-N-CA 124.347 0.975 . . . . 0.0 112.73 175.033 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 43' ' ' GLY . . . . . . . . . . . . . . . 61.3 -91.41 0.06 OUTLIER Glycine 0 CA--C 1.525 0.666 0 C-N-CA 124.376 0.988 . . . . 0.0 111.552 172.479 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 44' ' ' SER . . . . . . . . . . . . . 23.5 m 35.51 -111.22 0.06 Allowed 'General case' 0 N--CA 1.45 -0.446 0 C-N-CA 126.632 1.973 . . . . 0.0 110.51 -179.801 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 69.5 p -145.98 152.16 38.94 Favored 'General case' 0 N--CA 1.45 -0.456 0 N-CA-C 106.051 -1.833 . . . . 0.0 106.051 166.381 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 18.5 mt -55.62 -41.16 73.08 Favored 'General case' 0 N--CA 1.451 -0.394 0 N-CA-C 108.152 -1.055 . . . . 0.0 108.152 171.141 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 5.5 m-20 -54.99 -56.38 20.4 Favored 'General case' 0 N--CA 1.451 -0.424 0 C-N-CA 124.527 1.131 . . . . 0.0 111.633 177.425 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 32.5 mt-10 -55.15 -48.1 74.2 Favored 'General case' 0 C--N 1.334 -0.089 0 C-N-CA 122.097 0.159 . . . . 0.0 110.706 176.377 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 55.9 tp -57.66 -47.6 81.83 Favored 'General case' 0 CA--C 1.532 0.263 0 CA-C-O 121.385 0.612 . . . . 0.0 110.47 179.649 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 50' ' ' PHE . . . . . . . . . . . . . 50.0 t80 -57.04 -48.93 77.34 Favored 'General case' 0 N--CA 1.452 -0.368 0 C-N-CA 124.467 1.107 . . . . 0.0 109.864 -179.874 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 33.9 tt0 -61.76 -40.44 95.17 Favored 'General case' 0 N--CA 1.453 -0.284 0 C-N-CA 122.788 0.435 . . . . 0.0 111.16 177.93 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 70.2 tt0 -59.0 -46.51 87.98 Favored 'General case' 0 C--N 1.331 -0.203 0 C-N-CA 123.092 0.557 . . . . 0.0 110.422 176.384 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 84.4 mt -66.38 -56.29 11.77 Favored 'General case' 0 N--CA 1.452 -0.345 0 C-N-CA 123.465 0.706 . . . . 0.0 111.133 -179.52 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 14.2 t0 -103.68 101.25 11.09 Favored 'General case' 0 N--CA 1.453 -0.307 0 C-N-CA 124.376 1.07 . . . . 0.0 108.985 -176.367 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 25.2 mmmt -74.52 75.24 1.96 Allowed 'General case' 0 N--CA 1.453 -0.325 0 CA-C-O 122.38 1.086 . . . . 0.0 111.26 178.643 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 56' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER 37.91 41.19 0.33 Allowed 'General case' 0 C--N 1.323 -0.585 0 C-N-CA 129.56 3.144 . . . . 0.0 114.109 -176.622 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . -79.48 -80.63 0.77 Allowed Glycine 0 CA--C 1.526 0.719 0 N-CA-C 110.418 -1.073 . . . . 0.0 110.418 -177.003 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 35.2 p-10 -97.22 -30.57 12.91 Favored 'General case' 0 CA--C 1.533 0.326 0 C-N-CA 124.688 1.195 . . . . 0.0 111.448 -178.757 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . 93.94 25.29 17.71 Favored Glycine 0 CA--C 1.53 0.977 0 C-N-CA 124.146 0.879 . . . . 0.0 111.242 -174.267 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 42.6 mp0 -149.83 179.18 8.24 Favored 'General case' 0 N--CA 1.457 -0.098 0 C-N-CA 127.024 2.13 . . . . 0.0 105.94 175.569 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 61' ' ' VAL . . . . . . . . . . . . . 39.9 t -118.28 103.79 15.19 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.241 0 N-CA-C 109.136 -0.69 . . . . 0.0 109.136 176.678 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 18.6 t -79.2 167.37 21.07 Favored 'General case' 0 CA--C 1.532 0.282 0 C-N-CA 123.01 0.524 . . . . 0.0 111.345 172.335 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 63' ' ' PHE . . . . . . . . . . . . . 63.1 t80 -60.41 -34.8 74.47 Favored 'General case' 0 CA--C 1.53 0.211 0 C-N-CA 123.204 0.602 . . . . 0.0 112.518 -172.733 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 7.6 tm-20 -64.17 -61.77 2.05 Favored 'General case' 0 CA--C 1.533 0.327 0 N-CA-C 109.476 -0.565 . . . . 0.0 109.476 178.11 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 14.7 pt-20 -59.86 -33.44 71.81 Favored 'General case' 0 CA--C 1.537 0.463 0 O-C-N 121.62 -0.675 . . . . 0.0 111.741 -179.472 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 19.6 t80 -53.03 -25.76 13.48 Favored 'General case' 0 CA--C 1.536 0.415 0 C-N-CA 123.902 0.881 . . . . 0.0 112.897 169.668 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 67' ' ' GLN . . . . . . . . . . . . . 73.2 mm-40 -55.81 -24.75 37.92 Favored 'General case' 0 CA--C 1.538 0.492 0 O-C-N 120.785 -1.197 . . . . 0.0 112.435 171.795 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 74.0 t -61.01 -33.98 58.02 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.547 0 O-C-N 121.086 -1.009 . . . . 0.0 110.339 170.467 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 14.1 tp -73.07 -39.82 65.55 Favored 'General case' 0 C--O 1.225 -0.223 0 O-C-N 120.885 -1.134 . . . . 0.0 108.15 176.494 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 70' ' ' VAL . . . . . . . . . . . . . 40.9 t -58.15 -39.6 73.75 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.544 0 O-C-N 121.939 -0.475 . . . . 0.0 110.54 173.159 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 75.1 tttt -55.75 -51.09 68.57 Favored 'General case' 0 N--CA 1.455 -0.184 0 O-C-N 121.601 -0.687 . . . . 0.0 110.67 170.734 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 4.8 mptp? -52.65 -48.29 66.54 Favored 'General case' 0 CA--C 1.536 0.436 0 CA-C-N 118.281 0.491 . . . . 0.0 112.141 173.316 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 73' ' ' ILE . . . . . . . . . . . . . 95.9 mt -53.74 -40.99 45.66 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.563 0 N-CA-C 109.271 -0.64 . . . . 0.0 109.271 175.852 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 74' ' ' SER . . . . . 0.646 ' O ' ' OXT' ' A' ' 75' ' ' GLN . 4.9 m -86.97 20.35 2.68 Favored 'General case' 0 CA--C 1.537 0.468 0 C-N-CA 124.741 1.216 . . . . 0.0 112.184 177.613 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 75' ' ' GLN . . . . . 0.646 ' OXT' ' O ' ' A' ' 74' ' ' SER . 3.5 mp0 . . . . . 0 C--O 1.27 2.158 0 C-N-CA 125.637 1.575 . . . . 0.0 110.861 -175.598 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 1' ' ' LYS . . . . . . . . . . . . . 74.5 mmtt . . . . . 0 N--CA 1.454 -0.251 0 N-CA-C 108.986 -0.746 . . . . 0.0 108.986 . . . . . . . . . 0 0 . 1 . 013 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 81.2 p -67.51 153.9 94.1 Favored Pre-proline 0 N--CA 1.452 -0.33 0 O-C-N 121.849 -0.532 . . . . 0.0 109.754 -177.261 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 82.2 Cg_exo -46.39 -41.81 22.77 Favored 'Trans proline' 0 N--CA 1.456 -0.726 0 C-N-CA 122.665 2.244 . . . . 0.0 111.621 169.146 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 3.1 mp0 -59.39 -50.83 72.43 Favored 'General case' 0 N--CA 1.454 -0.229 0 C-N-CA 123.817 0.847 . . . . 0.0 112.154 176.236 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 15.3 tp10 -57.96 -46.89 84.4 Favored 'General case' 0 N--CA 1.454 -0.239 0 N-CA-C 108.211 -1.033 . . . . 0.0 108.211 178.502 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 25.8 mt -59.59 -37.83 79.6 Favored 'General case' 0 N--CA 1.445 -0.712 0 C-N-CA 124.216 1.007 . . . . 0.0 111.831 179.266 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 1.2 tmtm? -61.86 -48.0 82.51 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 118.843 0.747 . . . . 0.0 109.949 171.94 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . -54.77 -54.67 31.76 Favored Glycine 0 CA--C 1.528 0.867 0 N-CA-C 110.49 -1.044 . . . . 0.0 110.49 178.758 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 9' ' ' ILE . . . . . . . . . . . . . 72.9 mt -50.98 -54.26 11.1 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.184 0 C-N-CA 125.278 1.431 . . . . 0.0 109.967 172.781 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 10' ' ' PHE . . . . . . . . . . . . . 29.5 t80 -51.97 -49.79 62.54 Favored 'General case' 0 N--CA 1.447 -0.609 0 O-C-N 121.715 -0.616 . . . . 0.0 109.719 -176.863 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 54.8 mt-10 -61.85 -53.05 61.18 Favored 'General case' 0 N--CA 1.457 -0.082 0 N-CA-C 110.292 -0.262 . . . . 0.0 110.292 178.847 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 48.9 tttp -44.24 -53.71 6.36 Favored 'General case' 0 C--O 1.227 -0.124 0 C-N-CA 124.52 1.128 . . . . 0.0 110.586 178.064 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 41.8 m-85 -77.4 -41.28 40.63 Favored 'General case' 0 N--CA 1.454 -0.273 0 CA-C-O 119.629 -0.224 . . . . 0.0 111.491 -173.909 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -58.7 -58.73 7.29 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-O 120.848 0.356 . . . . 0.0 110.847 179.036 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -51.06 -32.1 20.92 Favored 'General case' 0 CA--C 1.531 0.222 0 C-N-CA 125.121 1.368 . . . . 0.0 113.111 -169.941 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 94.1 mttt -56.85 -31.69 65.04 Favored 'General case' 0 CA--C 1.533 0.312 0 C-N-CA 123.218 0.607 . . . . 0.0 112.6 -179.604 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 31.0 tt0 -139.94 -42.44 0.43 Allowed 'General case' 0 CA--C 1.532 0.271 0 N-CA-C 112.453 0.538 . . . . 0.0 112.453 -168.68 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . -111.32 179.32 19.83 Favored Glycine 0 CA--C 1.523 0.593 0 C-N-CA 124.585 1.088 . . . . 0.0 111.131 -173.027 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 9.8 t70 -61.03 134.03 92.77 Favored Pre-proline 0 CA--C 1.533 0.324 0 N-CA-C 108.09 -1.078 . . . . 0.0 108.09 173.506 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 20' ' ' PRO . . . . . . . . . . . . . 12.9 Cg_endo -52.77 -24.61 24.09 Favored 'Trans proline' 0 CA--C 1.537 0.657 0 C-N-CA 122.931 2.421 . . . . 0.0 114.145 -175.809 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 44.1 m-80 -88.38 -5.67 58.16 Favored 'General case' 0 CA--C 1.535 0.381 0 C-N-CA 124.912 1.285 . . . . 0.0 113.186 -177.214 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 37.4 tt0 -148.64 119.57 7.64 Favored 'General case' 0 CA--C 1.539 0.556 0 CA-C-N 118.797 0.726 . . . . 0.0 112.82 -169.446 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 69.5 mt -88.98 133.91 34.16 Favored 'General case' 0 C--N 1.343 0.312 0 C-N-CA 124.139 0.976 . . . . 0.0 112.544 -175.529 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 27.9 p -77.83 171.71 14.56 Favored 'General case' 0 C--O 1.235 0.29 0 C-N-CA 123.626 0.77 . . . . 0.0 109.457 168.268 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 97.8 mttt -57.99 -46.76 84.67 Favored 'General case' 0 N--CA 1.454 -0.237 0 N-CA-C 110.156 -0.313 . . . . 0.0 110.156 174.245 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 27.4 tp10 -65.08 -44.45 88.86 Favored 'General case' 0 N--CA 1.453 -0.283 0 CA-C-O 120.89 0.376 . . . . 0.0 110.34 -176.895 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 21.1 mt-10 -56.1 -49.51 73.64 Favored 'General case' 0 CA--C 1.536 0.433 0 N-CA-C 109.443 -0.577 . . . . 0.0 109.443 175.289 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 10.2 mt -55.75 -41.88 74.62 Favored 'General case' 0 CA--C 1.514 -0.405 0 N-CA-C 113.324 0.861 . . . . 0.0 113.324 171.661 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 89.1 tttt -59.81 -53.29 59.65 Favored 'General case' 0 C--N 1.323 -0.566 0 CA-C-N 118.737 0.699 . . . . 0.0 109.8 -178.637 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 82.9 mt -58.27 -46.78 85.39 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.968 178.875 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 6.4 tt -51.15 -57.65 8.19 Favored 'General case' 0 C--N 1.332 -0.156 0 C-N-CA 123.836 0.854 . . . . 0.0 109.9 175.415 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 40.0 mt -54.73 -55.13 33.21 Favored 'General case' 0 C--N 1.331 -0.196 0 C-N-CA 124.27 1.028 . . . . 0.0 109.724 -178.433 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 24.2 mt-30 -53.13 -50.95 63.46 Favored 'General case' 0 N--CA 1.454 -0.245 0 C-N-CA 123.484 0.714 . . . . 0.0 111.343 -177.556 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 1.6 m -73.54 -51.15 17.99 Favored 'General case' 0 CA--C 1.532 0.264 0 C-N-CA 120.174 -0.61 . . . . 0.0 111.322 -173.898 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 45.0 mm-40 -94.4 -29.62 14.89 Favored 'General case' 0 N--CA 1.449 -0.5 0 N-CA-C 113.622 0.971 . . . . 0.0 113.622 -166.123 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 75.4 m-85 -136.84 66.51 55.69 Favored Pre-proline 0 CA--C 1.534 0.365 0 N-CA-C 113.053 0.76 . . . . 0.0 113.053 -173.249 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 87.7 Cg_exo -49.19 -31.39 21.72 Favored 'Trans proline' 0 N--CA 1.458 -0.582 0 C-N-CA 122.955 2.437 . . . . 0.0 112.492 168.238 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 3.3 p -56.0 -60.54 3.33 Favored 'General case' 0 N--CA 1.45 -0.434 0 C-N-CA 125.166 1.386 . . . . 0.0 109.457 175.836 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 85.4 mt -57.34 -41.19 79.56 Favored 'General case' 0 N--CA 1.453 -0.323 0 CA-C-N 115.477 -0.783 . . . . 0.0 110.914 176.391 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 11.8 tp -57.07 -47.2 81.59 Favored 'General case' 0 CA--C 1.533 0.308 0 CA-C-O 120.825 0.345 . . . . 0.0 111.199 178.769 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 93.7 mttt -66.76 -38.68 87.08 Favored 'General case' 0 N--CA 1.455 -0.196 0 C-N-CA 124.052 0.941 . . . . 0.0 110.983 176.426 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . -36.79 118.4 0.49 Allowed Glycine 0 CA--C 1.53 0.986 0 C-N-CA 125.789 1.661 . . . . 0.0 111.998 175.324 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 43' ' ' GLY . . . . . . . . . . . . . . . -68.03 73.91 0.27 Allowed Glycine 0 CA--C 1.529 0.952 0 C-N-CA 124.274 0.94 . . . . 0.0 113.46 -170.718 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 44' ' ' SER . . . . . . . . . . . . . 17.2 m -158.64 142.57 15.41 Favored 'General case' 0 N--CA 1.443 -0.799 0 C-N-CA 126.654 1.982 . . . . 0.0 106.063 169.954 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 47.5 p -70.44 160.89 31.53 Favored 'General case' 0 N--CA 1.453 -0.282 0 CA-C-O 121.436 0.636 . . . . 0.0 109.7 -179.553 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 46' ' ' LEU . . . . . 0.408 ' HG ' ' H ' ' A' ' 46' ' ' LEU . 18.8 mt -55.35 -43.97 75.52 Favored 'General case' 0 N--CA 1.451 -0.375 0 N-CA-C 108.275 -1.009 . . . . 0.0 108.275 172.72 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 5.7 m-20 -58.38 -49.07 78.57 Favored 'General case' 0 N--CA 1.447 -0.595 0 CA-C-N 115.006 -0.997 . . . . 0.0 111.39 178.503 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 51.0 mt-10 -57.9 -50.64 72.65 Favored 'General case' 0 C--N 1.333 -0.125 0 CA-C-N 117.379 0.081 . . . . 0.0 110.931 175.962 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 81.6 mt -57.64 -48.34 79.73 Favored 'General case' 0 CA--C 1.531 0.22 0 CA-C-O 121.376 0.608 . . . . 0.0 109.926 -179.936 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 50' ' ' PHE . . . . . . . . . . . . . 54.6 t80 -55.03 -53.29 57.75 Favored 'General case' 0 N--CA 1.45 -0.466 0 C-N-CA 123.882 0.873 . . . . 0.0 109.879 178.965 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 42.8 tt0 -57.51 -45.74 84.62 Favored 'General case' 0 N--CA 1.454 -0.264 0 C-N-CA 122.895 0.478 . . . . 0.0 110.771 179.503 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 8.5 tm-20 -55.99 -45.97 78.83 Favored 'General case' 0 N--CA 1.454 -0.264 0 C-N-CA 122.998 0.519 . . . . 0.0 110.308 179.433 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 95.8 mt -78.25 -38.21 43.38 Favored 'General case' 0 CA--C 1.533 0.299 0 N-CA-C 112.592 0.59 . . . . 0.0 112.592 -175.364 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 27.5 t0 -67.41 72.83 0.13 Allowed 'General case' 0 C--N 1.33 -0.274 0 C-N-CA 126.876 2.07 . . . . 0.0 109.674 177.607 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 28.4 mmmt -57.3 99.77 0.04 OUTLIER 'General case' 0 N--CA 1.454 -0.268 0 CA-C-O 121.282 0.563 . . . . 0.0 112.292 -169.072 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 56' ' ' ASN . . . . . . . . . . . . 0.25 0.0 OUTLIER 95.75 5.32 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.304 0 C-N-CA 128.83 2.852 . . . . 0.0 112.609 171.556 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . 79.09 53.08 4.61 Favored Glycine 0 CA--C 1.525 0.705 0 N-CA-C 110.94 -0.864 . . . . 0.0 110.94 177.706 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 3.2 p30 -77.16 -48.28 18.08 Favored 'General case' 0 N--CA 1.451 -0.385 0 N-CA-C 108.139 -1.059 . . . . 0.0 108.139 170.947 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . 159.35 -86.65 0.12 Allowed Glycine 0 C--O 1.223 -0.591 0 N-CA-C 108.57 -1.812 . . . . 0.0 108.57 168.061 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 62.4 mt-10 -97.8 150.03 21.7 Favored 'General case' 0 C--N 1.326 -0.45 0 C-N-CA 123.767 0.827 . . . . 0.0 108.906 -172.022 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 61' ' ' VAL . . . . . . . . . . . . . 2.8 t -83.87 109.77 17.76 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.203 0 O-C-N 122.221 -0.3 . . . . 0.0 111.585 -165.814 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 1.7 m -77.78 153.47 32.82 Favored 'General case' 0 CA--C 1.534 0.352 0 C-N-CA 124.123 0.969 . . . . 0.0 110.741 -177.586 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 63' ' ' PHE . . . . . . . . . . . . . 69.1 t80 -55.31 -38.69 69.0 Favored 'General case' 0 N--CA 1.468 0.472 0 N-CA-C 113.072 0.767 . . . . 0.0 113.072 -174.336 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 12.5 tp10 -61.92 -59.92 4.4 Favored 'General case' 0 CA--C 1.534 0.33 0 O-C-N 121.994 -0.441 . . . . 0.0 110.012 179.865 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 16.6 pt-20 -59.35 -36.19 75.25 Favored 'General case' 0 CA--C 1.535 0.388 0 O-C-N 121.394 -0.816 . . . . 0.0 111.798 179.739 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 23.7 t80 -51.94 -26.24 9.97 Favored 'General case' 0 CA--C 1.54 0.578 0 C-N-CA 123.788 0.835 . . . . 0.0 112.408 171.682 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 67' ' ' GLN . . . . . . . . . . . . . 36.2 mm-40 -53.23 -27.84 24.12 Favored 'General case' 0 CA--C 1.54 0.567 0 O-C-N 120.985 -1.072 . . . . 0.0 113.117 172.625 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 85.8 t -56.22 -30.58 30.21 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.436 0 C-N-CA 122.966 0.506 . . . . 0.0 110.967 173.206 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 16.8 tp -78.17 -51.32 10.4 Favored 'General case' 0 N--CA 1.455 -0.178 0 N-CA-C 109.221 -0.659 . . . . 0.0 109.221 170.664 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 70' ' ' VAL . . . . . . . . . . . . . 84.4 t -47.91 -43.92 10.91 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.22 0 C-N-CA 122.88 0.472 . . . . 0.0 111.591 -175.695 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 54.0 pttt -59.91 -41.35 91.51 Favored 'General case' 0 CA--C 1.533 0.317 0 C-N-CA 120.281 -0.567 . . . . 0.0 112.388 179.732 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 5.6 mptp? -60.55 -45.42 93.95 Favored 'General case' 0 CA--C 1.529 0.172 0 N-CA-C 110.309 -0.256 . . . . 0.0 110.309 172.56 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 73' ' ' ILE . . . . . . . . . . . . . 55.4 mt -61.04 -54.2 38.63 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.216 0 CA-C-O 120.751 0.31 . . . . 0.0 110.889 -177.781 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 55.5 m -160.76 57.05 0.32 Allowed 'General case' 0 CA--C 1.532 0.269 0 C-N-CA 123.758 0.823 . . . . 0.0 110.898 -172.431 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 75' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.27 2.141 0 C-N-CA 125.977 1.711 . . . . 0.0 113.82 170.999 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 1' ' ' LYS . . . . . . . . . . . . . 72.3 mmtt . . . . . 0 N--CA 1.45 -0.457 0 N-CA-C 108.44 -0.948 . . . . 0.0 108.44 . . . . . . . . . 0 0 . 1 . 014 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 90.5 p -80.24 152.64 73.81 Favored Pre-proline 0 N--CA 1.453 -0.3 0 N-CA-C 108.821 -0.807 . . . . 0.0 108.821 174.283 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 83.9 Cg_exo -47.14 -38.01 24.33 Favored 'Trans proline' 0 N--CA 1.456 -0.692 0 C-N-CA 122.72 2.28 . . . . 0.0 112.322 169.782 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 3.1 mp0 -62.54 -48.66 78.52 Favored 'General case' 0 CA--C 1.53 0.202 0 C-N-CA 123.793 0.837 . . . . 0.0 111.917 175.966 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 9.6 tm-20 -60.33 -44.47 95.46 Favored 'General case' 0 CA--C 1.53 0.206 0 N-CA-C 108.739 -0.837 . . . . 0.0 108.739 178.074 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 6' ' ' LEU . . . . . 0.421 HD13 HG22 ' A' ' 70' ' ' VAL . 14.5 mt -60.98 -37.18 81.56 Favored 'General case' 0 N--CA 1.447 -0.6 0 C-N-CA 123.614 0.766 . . . . 0.0 112.568 175.803 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 54.5 tptt -59.24 -47.45 85.29 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 119.232 0.924 . . . . 0.0 109.724 169.752 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . -51.18 -54.21 24.27 Favored Glycine 0 CA--C 1.531 1.072 0 N-CA-C 110.696 -0.962 . . . . 0.0 110.696 176.793 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 9' ' ' ILE . . . . . . . . . . . . . 4.2 mm -54.56 -56.12 11.85 Favored 'Isoleucine or valine' 0 CA--C 1.529 0.166 0 C-N-CA 125.063 1.345 . . . . 0.0 109.321 175.99 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 10' ' ' PHE . . . . . . . . . . . . . 23.2 t80 -49.56 -49.33 46.75 Favored 'General case' 0 N--CA 1.444 -0.753 0 C-N-CA 123.612 0.765 . . . . 0.0 109.772 -178.65 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 52.1 mt-10 -63.35 -48.77 76.55 Favored 'General case' 0 N--CA 1.453 -0.288 0 C-N-CA 123.504 0.722 . . . . 0.0 110.613 179.638 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 64.6 tttt -44.39 -51.84 8.25 Favored 'General case' 0 CA--C 1.53 0.21 0 C-N-CA 123.893 0.877 . . . . 0.0 110.756 176.592 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 83.0 m-85 -80.68 -38.54 28.81 Favored 'General case' 0 CA--C 1.533 0.295 0 N-CA-C 112.379 0.511 . . . . 0.0 112.379 -176.723 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -69.05 -52.63 26.52 Favored 'General case' 0 C--N 1.333 -0.147 0 C-N-CA 123.552 0.741 . . . . 0.0 111.757 -176.908 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -55.46 -20.52 12.86 Favored 'General case' 0 C--N 1.332 -0.188 0 C-N-CA 124.124 0.97 . . . . 0.0 112.255 -178.57 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 38.8 ttmt -56.57 -30.29 62.98 Favored 'General case' 0 N--CA 1.449 -0.52 0 C-N-CA 123.713 0.805 . . . . 0.0 111.372 179.349 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 9.8 tp10 -155.29 -45.76 0.08 Allowed 'General case' 0 C--N 1.341 0.229 0 CA-C-N 118.201 0.455 . . . . 0.0 111.501 177.575 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . -74.35 175.88 48.29 Favored Glycine 0 CA--C 1.527 0.84 0 CA-C-O 121.787 0.66 . . . . 0.0 111.522 179.315 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 10.1 t70 -63.31 139.92 97.64 Favored Pre-proline 0 CA--C 1.533 0.299 0 N-CA-C 107.289 -1.375 . . . . 0.0 107.289 169.519 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 20' ' ' PRO . . . . . . . . . . . . . 11.1 Cg_endo -50.68 -23.67 11.6 Favored 'Trans proline' 0 CA--C 1.537 0.649 0 C-N-CA 122.859 2.373 . . . . 0.0 114.538 -179.143 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 49.2 m-80 -96.56 -1.17 47.6 Favored 'General case' 0 CA--C 1.533 0.3 0 C-N-CA 124.956 1.302 . . . . 0.0 113.314 -177.743 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 30.7 tt0 -141.51 116.98 10.21 Favored 'General case' 0 CA--C 1.538 0.514 0 C-N-CA 123.869 0.868 . . . . 0.0 112.579 -176.712 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 46.9 mt -90.56 136.74 32.87 Favored 'General case' 0 C--N 1.342 0.26 0 C-N-CA 124.564 1.145 . . . . 0.0 110.857 179.875 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 98.0 p -78.5 168.05 20.37 Favored 'General case' 0 CA--C 1.532 0.273 0 N-CA-C 108.572 -0.899 . . . . 0.0 108.572 167.133 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 1.1 ttmp? -59.11 -38.12 78.8 Favored 'General case' 0 CA--C 1.535 0.395 0 O-C-N 122.017 -0.427 . . . . 0.0 110.739 177.985 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 26.9 mt-10 -68.24 -47.49 67.64 Favored 'General case' 0 N--CA 1.454 -0.23 0 CA-C-O 121.162 0.506 . . . . 0.0 110.516 -179.576 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 60.2 mt-10 -58.06 -43.94 87.22 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.027 -0.533 . . . . 0.0 109.814 176.183 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 12.3 mt -54.59 -47.37 73.42 Favored 'General case' 0 CA--C 1.507 -0.676 0 CA-C-N 118.387 0.54 . . . . 0.0 112.233 169.608 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 61.9 tttp -58.83 -47.59 84.31 Favored 'General case' 0 C--N 1.324 -0.531 0 CA-C-N 118.706 0.684 . . . . 0.0 109.876 -177.353 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 90.5 mt -59.75 -49.06 79.21 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.532 -0.304 . . . . 0.0 111.686 177.286 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 6.9 tt -50.62 -58.28 6.21 Favored 'General case' 0 N--CA 1.456 -0.148 0 C-N-CA 124.204 1.002 . . . . 0.0 109.327 175.545 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 42.8 mt -57.98 -52.35 65.87 Favored 'General case' 0 N--CA 1.451 -0.39 0 C-N-CA 123.86 0.864 . . . . 0.0 109.079 -176.291 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 23.6 tt0 -53.85 -51.03 64.92 Favored 'General case' 0 N--CA 1.453 -0.287 0 C-N-CA 123.639 0.776 . . . . 0.0 111.075 -178.204 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 11.4 m -75.65 -45.36 37.6 Favored 'General case' 0 N--CA 1.451 -0.381 0 CA-C-N 115.992 -0.549 . . . . 0.0 110.958 -171.583 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 74.0 mm-40 -94.57 -34.97 12.44 Favored 'General case' 0 N--CA 1.452 -0.357 0 C-N-CA 123.797 0.839 . . . . 0.0 112.406 -169.355 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 73.9 m-85 -144.88 68.27 14.14 Favored Pre-proline 0 CA--C 1.541 0.606 0 C-N-CA 123.832 0.853 . . . . 0.0 113.108 -169.875 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 85.6 Cg_exo -44.7 -36.48 10.5 Favored 'Trans proline' 0 CA--C 1.536 0.618 0 C-N-CA 123.431 2.754 . . . . 0.0 113.359 172.143 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -55.52 -43.1 75.4 Favored 'General case' 0 N--CA 1.45 -0.463 0 C-N-CA 125.568 1.547 . . . . 0.0 109.83 179.813 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 96.2 mt -84.72 -32.28 23.6 Favored 'General case' 0 N--CA 1.446 -0.671 0 C-N-CA 125.053 1.341 . . . . 0.0 110.498 -177.074 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 15.9 tp -54.04 -50.09 67.49 Favored 'General case' 0 N--CA 1.462 0.162 0 N-CA-C 109.387 -0.598 . . . . 0.0 109.387 171.364 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 8.2 mtmp? -64.68 -61.22 2.33 Favored 'General case' 0 N--CA 1.449 -0.499 0 N-CA-C 109.348 -0.612 . . . . 0.0 109.348 172.697 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . 70.51 -67.47 0.75 Allowed Glycine 0 CA--C 1.529 0.914 0 C-N-CA 125.02 1.295 . . . . 0.0 113.762 169.406 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 43' ' ' GLY . . . . . . . . . . . . . . . 135.29 -66.39 0.56 Allowed Glycine 0 CA--C 1.522 0.503 0 N-CA-C 106.164 -2.775 . . . . 0.0 106.164 -169.656 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 44' ' ' SER . . . . . . . . . . . . . 19.7 m -59.66 145.58 44.25 Favored 'General case' 0 N--CA 1.45 -0.442 0 N-CA-C 108.716 -0.846 . . . . 0.0 108.716 167.884 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 75.3 p -60.13 161.26 7.12 Favored 'General case' 0 CA--C 1.531 0.236 0 N-CA-C 109.209 -0.663 . . . . 0.0 109.209 169.406 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 57.4 tp -51.01 -44.39 60.97 Favored 'General case' 0 CA--C 1.528 0.118 0 CA-C-O 120.984 0.421 . . . . 0.0 110.709 172.08 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 4.8 m-20 -59.59 -54.04 51.15 Favored 'General case' 0 N--CA 1.45 -0.459 0 C-N-CA 123.905 0.882 . . . . 0.0 110.932 179.252 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 37.0 mt-10 -55.13 -48.52 73.55 Favored 'General case' 0 C--N 1.332 -0.191 0 CA-C-N 116.492 -0.322 . . . . 0.0 110.547 176.262 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 54.9 tp -56.39 -49.79 73.47 Favored 'General case' 0 C--N 1.331 -0.206 0 C-N-CA 123.035 0.534 . . . . 0.0 109.863 -179.904 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 50' ' ' PHE . . . . . . . . . . . . . 59.9 t80 -51.8 -50.42 60.82 Favored 'General case' 0 N--CA 1.453 -0.305 0 C-N-CA 124.041 0.936 . . . . 0.0 110.3 177.69 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 56.9 mm-40 -59.3 -47.5 85.14 Favored 'General case' 0 CA--C 1.534 0.364 0 CA-C-N 117.923 0.329 . . . . 0.0 111.627 175.373 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 39.8 mt-10 -54.81 -36.92 65.47 Favored 'General case' 0 CA--C 1.529 0.137 0 C-N-CA 123.375 0.67 . . . . 0.0 111.688 178.689 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 53.2 mt -75.21 -57.37 3.94 Favored 'General case' 0 N--CA 1.447 -0.611 0 CA-C-N 117.905 0.32 . . . . 0.0 110.626 174.808 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 33.2 t0 -75.55 59.32 1.11 Allowed 'General case' 0 CA--C 1.536 0.436 0 C-N-CA 124.612 1.165 . . . . 0.0 110.89 -178.947 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 13.5 mmmm -57.57 -37.83 73.82 Favored 'General case' 0 CA--C 1.53 0.199 0 C-N-CA 123.841 0.856 . . . . 0.0 111.465 178.643 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 56' ' ' ASN . . . . . . . . . . . . . 16.4 p-10 -66.12 -16.27 63.81 Favored 'General case' 0 CA--C 1.534 0.329 0 C-N-CA 125.383 1.473 . . . . 0.0 112.565 175.096 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . 64.16 40.86 98.43 Favored Glycine 0 CA--C 1.528 0.876 0 CA-C-N 118.704 0.684 . . . . 0.0 113.138 173.232 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 1.6 p30 -78.41 -15.88 58.2 Favored 'General case' 0 CA--C 1.534 0.363 0 CA-C-N 118.422 1.111 . . . . 0.0 112.249 177.629 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . 99.01 7.45 55.19 Favored Glycine 0 CA--C 1.53 0.994 0 C-N-CA 123.717 0.675 . . . . 0.0 112.805 177.645 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 33.4 mt-10 -154.65 173.99 15.6 Favored 'General case' 0 N--CA 1.454 -0.231 0 C-N-CA 128.311 2.644 . . . . 0.0 105.731 172.264 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 61' ' ' VAL . . . . . . . . . . . . . 25.4 t -109.94 114.63 47.53 Favored 'Isoleucine or valine' 0 N--CA 1.461 0.092 0 N-CA-C 109.419 -0.585 . . . . 0.0 109.419 -179.91 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 2.8 m -78.83 159.21 27.94 Favored 'General case' 0 CA--C 1.535 0.387 0 C-N-CA 123.519 0.728 . . . . 0.0 110.85 176.548 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 63' ' ' PHE . . . . . . . . . . . . . 73.8 t80 -59.17 -31.39 68.95 Favored 'General case' 0 CA--C 1.534 0.329 0 O-C-N 121.036 -1.04 . . . . 0.0 113.341 -176.996 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 29.3 mp0 -68.86 -62.95 1.16 Allowed 'General case' 0 N--CA 1.451 -0.403 0 N-CA-C 108.958 -0.756 . . . . 0.0 108.958 -177.595 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 1.5 pt-20 -59.68 -32.86 70.89 Favored 'General case' 0 CA--C 1.538 0.512 0 O-C-N 121.623 -0.673 . . . . 0.0 112.037 178.0 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 18.5 t80 -48.69 -29.84 4.86 Favored 'General case' 0 CA--C 1.537 0.467 0 O-C-N 121.429 -0.795 . . . . 0.0 112.741 169.194 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 67' ' ' GLN . . . . . . . . . . . . . 69.5 mm-40 -54.63 -22.29 13.09 Favored 'General case' 0 CA--C 1.539 0.543 0 CA-C-N 119.557 1.071 . . . . 0.0 112.872 174.685 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 76.2 t -55.49 -35.54 38.22 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.516 0 CA-C-N 119.751 1.159 . . . . 0.0 110.655 171.166 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 24.6 tp -71.95 -45.47 60.97 Favored 'General case' 0 N--CA 1.454 -0.26 0 N-CA-C 107.286 -1.376 . . . . 0.0 107.286 179.129 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 70' ' ' VAL . . . . . 0.421 HG22 HD13 ' A' ' 6' ' ' LEU . 23.4 t -57.02 -40.59 73.85 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.341 0 C-N-CA 123.036 0.535 . . . . 0.0 110.37 178.708 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 37.4 ttmt -56.63 -56.38 22.11 Favored 'General case' 0 N--CA 1.454 -0.243 0 C-N-CA 124.315 1.046 . . . . 0.0 110.273 171.385 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 6.1 mptp? -49.48 -40.19 36.43 Favored 'General case' 0 CA--C 1.536 0.416 0 N-CA-C 112.341 0.497 . . . . 0.0 112.341 174.934 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 73' ' ' ILE . . . . . . . . . . . . . 71.3 mt -62.4 -62.09 1.33 Allowed 'Isoleucine or valine' 0 CA--C 1.531 0.229 0 CA-C-N 118.412 0.551 . . . . 0.0 109.524 173.284 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 74' ' ' SER . . . . . 0.534 ' C ' ' OXT' ' A' ' 75' ' ' GLN . 4.1 m -173.85 -47.82 0.01 OUTLIER 'General case' 0 CA--C 1.533 0.297 0 C-N-CA 125.822 1.649 . . . . 0.0 111.842 -178.232 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 75' ' ' GLN . . . . . 0.534 ' OXT' ' C ' ' A' ' 74' ' ' SER . 19.5 tt0 . . . . . 0 C--O 1.27 2.151 0 C-N-CA 124.739 1.216 . . . . 0.0 111.016 -168.661 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 1' ' ' LYS . . . . . . . . . . . . . 73.7 mmtt . . . . . 0 N--CA 1.452 -0.371 0 N-CA-C 109.647 -0.501 . . . . 0.0 109.647 . . . . . . . . . 0 0 . 1 . 015 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 92.2 p -69.68 157.74 88.81 Favored Pre-proline 0 CA--C 1.532 0.267 0 N-CA-C 108.835 -0.802 . . . . 0.0 108.835 174.131 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 86.7 Cg_exo -48.43 -38.33 34.7 Favored 'Trans proline' 0 N--CA 1.456 -0.68 0 C-N-CA 122.379 2.053 . . . . 0.0 111.982 169.733 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 48.0 mt-10 -61.5 -49.54 76.34 Favored 'General case' 0 N--CA 1.456 -0.149 0 C-N-CA 123.587 0.755 . . . . 0.0 111.114 176.501 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 37.8 mm-40 -59.59 -47.18 86.59 Favored 'General case' 0 C--O 1.225 -0.204 0 N-CA-C 109.044 -0.724 . . . . 0.0 109.044 177.638 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 47.5 mt -58.29 -39.66 79.88 Favored 'General case' 0 N--CA 1.447 -0.589 0 C-N-CA 123.462 0.705 . . . . 0.0 111.802 178.857 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 21.8 tptm -61.62 -49.26 77.3 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 118.626 0.648 . . . . 0.0 110.744 171.673 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . -53.61 -52.17 43.57 Favored Glycine 0 CA--C 1.529 0.932 0 N-CA-C 110.272 -1.131 . . . . 0.0 110.272 -179.666 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 9' ' ' ILE . . . . . . . . . . . . . 80.3 mt -53.37 -56.41 8.49 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.245 0 C-N-CA 126.464 1.906 . . . . 0.0 109.704 172.442 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 10' ' ' PHE . . . . . . . . . . . . . 42.1 t80 -49.34 -49.66 43.24 Favored 'General case' 0 N--CA 1.447 -0.586 0 O-C-N 121.82 -0.55 . . . . 0.0 109.618 -178.144 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 52.4 mt-10 -63.65 -51.45 65.12 Favored 'General case' 0 CA--C 1.532 0.25 0 C-N-CA 123.165 0.586 . . . . 0.0 110.801 179.3 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 43.9 tttp -44.79 -51.23 9.64 Favored 'General case' 0 N--CA 1.461 0.113 0 C-N-CA 125.026 1.33 . . . . 0.0 110.909 177.163 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 57.2 m-85 -78.39 -47.37 17.74 Favored 'General case' 0 N--CA 1.448 -0.525 0 CA-C-N 116.362 -0.381 . . . . 0.0 110.355 -175.664 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -54.89 -38.14 67.19 Favored 'General case' 0 C--N 1.331 -0.204 0 C-N-CA 124.21 1.004 . . . . 0.0 112.418 179.218 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -49.65 -33.7 16.28 Favored 'General case' 0 CA--C 1.533 0.289 0 O-C-N 121.737 -0.602 . . . . 0.0 111.835 174.157 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 89.0 mttt -72.18 -29.62 64.17 Favored 'General case' 0 CA--C 1.535 0.389 0 C-N-CA 122.67 0.388 . . . . 0.0 110.97 -179.881 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 24.8 tt0 -65.4 -47.49 76.12 Favored 'General case' 0 C--N 1.341 0.236 0 N-CA-C 107.234 -1.395 . . . . 0.0 107.234 168.978 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 137.43 -56.21 0.68 Allowed Glycine 0 C--N 1.333 0.385 0 N-CA-C 108.422 -1.871 . . . . 0.0 108.422 178.478 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 35.3 t0 -74.3 110.6 9.87 Favored Pre-proline 0 CA--C 1.534 0.345 0 CA-C-O 118.39 -0.814 . . . . 0.0 108.906 176.079 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 20' ' ' PRO . . . . . . . . . . . . . 32.5 Cg_endo -58.49 -21.11 52.56 Favored 'Trans proline' 0 N--CA 1.458 -0.578 0 C-N-CA 122.279 1.986 . . . . 0.0 112.735 -179.516 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 43.2 m-80 -83.13 -4.51 58.45 Favored 'General case' 0 N--CA 1.451 -0.39 0 C-N-CA 124.35 1.06 . . . . 0.0 112.884 -177.268 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 26.3 tt0 -145.58 132.4 20.09 Favored 'General case' 0 CA--C 1.54 0.561 0 CA-C-N 119.699 1.136 . . . . 0.0 113.182 -168.771 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 84.7 mt -104.06 133.86 48.29 Favored 'General case' 0 C--N 1.342 0.257 0 C-N-CA 125.591 1.557 . . . . 0.0 110.804 176.941 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 82.4 p -79.77 175.63 10.45 Favored 'General case' 0 N--CA 1.452 -0.356 0 C-N-CA 123.76 0.824 . . . . 0.0 109.017 168.481 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 97.8 mttt -55.46 -46.3 76.82 Favored 'General case' 0 N--CA 1.455 -0.189 0 O-C-N 122.059 -0.401 . . . . 0.0 110.023 170.168 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 19.3 tp10 -64.96 -46.79 80.09 Favored 'General case' 0 N--CA 1.451 -0.422 0 CA-C-O 120.7 0.286 . . . . 0.0 110.353 -175.961 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -58.6 -44.08 89.78 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-O 118.806 -0.616 . . . . 0.0 110.45 175.822 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 14.2 mt -56.27 -44.58 79.88 Favored 'General case' 0 CA--C 1.509 -0.6 0 CA-C-N 119.273 0.942 . . . . 0.0 112.539 170.484 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 61.7 tttm -59.96 -49.66 76.81 Favored 'General case' 0 N--CA 1.449 -0.525 0 CA-C-N 118.572 0.624 . . . . 0.0 109.555 -177.849 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 9.2 mp -57.83 -49.64 75.98 Favored 'General case' 0 C--N 1.329 -0.292 0 C-N-CA 122.312 0.245 . . . . 0.0 111.376 177.591 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 7.3 tt -50.23 -57.79 7.04 Favored 'General case' 0 C--N 1.332 -0.166 0 C-N-CA 123.957 0.903 . . . . 0.0 109.552 176.051 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 38.0 mt -59.35 -49.15 78.92 Favored 'General case' 0 C--O 1.222 -0.376 0 C-N-CA 123.513 0.725 . . . . 0.0 109.622 -176.747 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 24.6 tt0 -56.96 -45.84 82.57 Favored 'General case' 0 N--CA 1.452 -0.349 0 C-N-CA 124.222 1.009 . . . . 0.0 110.885 -176.911 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 2.6 m -75.77 -52.34 10.65 Favored 'General case' 0 CA--C 1.533 0.318 0 C-N-CA 120.961 -0.296 . . . . 0.0 110.879 -177.107 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 58.4 mm-40 -90.15 -28.18 19.1 Favored 'General case' 0 N--CA 1.449 -0.483 0 N-CA-C 113.093 0.775 . . . . 0.0 113.093 -166.687 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 76.9 m-85 -145.34 56.91 3.86 Favored Pre-proline 0 CA--C 1.538 0.518 0 C-N-CA 123.965 0.906 . . . . 0.0 112.949 -173.252 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 38.3 Cg_endo -61.08 -34.33 90.04 Favored 'Trans proline' 0 N--CA 1.455 -0.789 0 C-N-CA 122.69 2.26 . . . . 0.0 111.052 -176.891 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 1.4 m -58.76 -39.25 80.44 Favored 'General case' 0 N--CA 1.45 -0.448 0 C-N-CA 124.277 1.031 . . . . 0.0 110.048 -179.142 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 76.9 mt -80.77 -37.96 29.41 Favored 'General case' 0 N--CA 1.451 -0.402 0 C-N-CA 123.95 0.9 . . . . 0.0 110.542 179.437 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 45.6 tp -53.58 -44.3 69.25 Favored 'General case' 0 N--CA 1.461 0.112 0 N-CA-C 110.134 -0.321 . . . . 0.0 110.134 174.474 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 68.9 mttm -70.13 -67.35 0.5 Allowed 'General case' 0 N--CA 1.45 -0.472 0 CA-C-O 121.722 0.773 . . . . 0.0 110.047 172.73 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . -79.74 67.57 3.36 Favored Glycine 0 CA--C 1.524 0.615 0 C-N-CA 124.267 0.937 . . . . 0.0 111.144 -175.456 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 43' ' ' GLY . . . . . . . . . . . . . . . -168.41 175.14 43.14 Favored Glycine 0 CA--C 1.524 0.637 0 N-CA-C 110.815 -0.914 . . . . 0.0 110.815 177.949 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 44' ' ' SER . . . . . . . . . . . . . 1.2 m -57.36 162.27 2.89 Favored 'General case' 0 N--CA 1.453 -0.308 0 C-N-CA 124.477 1.111 . . . . 0.0 110.659 174.062 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 67.0 p -59.79 155.49 16.01 Favored 'General case' 0 CA--C 1.53 0.209 0 C-N-CA 120.023 -0.671 . . . . 0.0 109.798 175.041 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 62.9 tp -49.72 -46.21 50.01 Favored 'General case' 0 N--CA 1.454 -0.247 0 C-N-CA 123.286 0.635 . . . . 0.0 111.078 177.939 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 6.0 m-20 -57.81 -54.75 43.41 Favored 'General case' 0 N--CA 1.451 -0.416 0 C-N-CA 123.792 0.837 . . . . 0.0 111.008 178.279 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 46.0 mt-10 -54.31 -47.77 72.07 Favored 'General case' 0 C--N 1.332 -0.158 0 CA-C-N 116.802 -0.181 . . . . 0.0 110.868 177.739 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 48.7 tp -60.4 -48.26 82.51 Favored 'General case' 0 N--CA 1.453 -0.315 0 CA-C-O 121.348 0.594 . . . . 0.0 109.632 -179.411 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 50' ' ' PHE . . . . . . . . . . . . . 59.2 t80 -53.98 -49.31 69.1 Favored 'General case' 0 N--CA 1.449 -0.483 0 C-N-CA 123.331 0.653 . . . . 0.0 110.266 178.848 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 34.7 mt-10 -60.9 -43.34 98.67 Favored 'General case' 0 N--CA 1.455 -0.209 0 C-N-CA 122.719 0.408 . . . . 0.0 110.996 177.648 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 32.7 tt0 -52.74 -42.31 64.79 Favored 'General case' 0 CA--C 1.529 0.172 0 C-N-CA 122.933 0.493 . . . . 0.0 110.708 176.456 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 82.1 mt -75.36 -63.12 1.35 Allowed 'General case' 0 N--CA 1.45 -0.471 0 C-N-CA 123.062 0.545 . . . . 0.0 111.229 179.046 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 29.4 t70 -110.24 96.61 6.32 Favored 'General case' 0 C--N 1.332 -0.181 0 C-N-CA 125.406 1.482 . . . . 0.0 108.711 -179.207 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 2.6 mptp? -63.44 -59.85 4.13 Favored 'General case' 0 N--CA 1.454 -0.26 0 CA-C-O 122.234 1.016 . . . . 0.0 110.047 -175.118 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 56' ' ' ASN . . . . . . . . . . . . . 37.1 p-10 -154.28 32.12 0.43 Allowed 'General case' 0 C--N 1.327 -0.409 0 C-N-CA 125.671 1.588 . . . . 0.0 107.517 172.777 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . -67.47 -70.43 1.13 Allowed Glycine 0 C--N 1.34 0.761 0 N-CA-C 110.002 -1.239 . . . . 0.0 110.002 -169.911 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 2.4 p30 -129.54 -0.99 4.95 Favored 'General case' 0 N--CA 1.447 -0.601 0 C-N-CA 124.354 1.062 . . . . 0.0 112.752 177.531 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . 85.41 1.45 87.95 Favored Glycine 0 CA--C 1.53 1.017 0 CA-C-O 119.216 -0.769 . . . . 0.0 113.08 178.727 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 45.7 mt-10 -146.13 175.78 10.22 Favored 'General case' 0 N--CA 1.454 -0.24 0 C-N-CA 127.804 2.442 . . . . 0.0 106.637 173.707 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 61' ' ' VAL . . . . . . . . . . . . . 73.0 t -111.59 106.56 21.0 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.236 0 C-N-CA 122.742 0.417 . . . . 0.0 110.161 -169.541 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 53.8 p -82.56 160.73 22.49 Favored 'General case' 0 CA--C 1.539 0.544 0 C-N-CA 123.875 0.87 . . . . 0.0 111.343 173.557 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 63' ' ' PHE . . . . . . . . . . . . . 49.7 t80 -51.16 -49.93 59.93 Favored 'General case' 0 N--CA 1.468 0.426 0 O-C-N 121.422 -0.799 . . . . 0.0 111.417 -173.921 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 12.5 pt-20 -53.26 -28.57 28.28 Favored 'General case' 0 CA--C 1.534 0.342 0 C-N-CA 124.654 1.181 . . . . 0.0 114.145 -178.373 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 14.3 pt-20 -100.15 -30.25 12.04 Favored 'General case' 0 CA--C 1.529 0.167 0 C-N-CA 123.593 0.757 . . . . 0.0 110.432 177.88 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 5.3 t80 -52.62 -32.42 41.6 Favored 'General case' 0 CA--C 1.535 0.372 0 O-C-N 121.412 -0.805 . . . . 0.0 110.121 167.687 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 67' ' ' GLN . . . . . . . . . . . . . 2.1 mp0 -46.44 -34.66 4.9 Favored 'General case' 0 CA--C 1.538 0.507 0 N-CA-C 113.747 1.018 . . . . 0.0 113.747 169.15 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 77.1 t -61.23 -29.54 46.04 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.541 0 CA-C-N 119.104 0.865 . . . . 0.0 110.667 175.945 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 1.4 tt -71.98 -50.69 26.65 Favored 'General case' 0 N--CA 1.455 -0.188 0 N-CA-C 106.447 -1.686 . . . . 0.0 106.447 178.14 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 70' ' ' VAL . . . . . . . . . . . . . 18.3 t -54.38 -44.62 67.38 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.389 0 C-N-CA 122.819 0.448 . . . . 0.0 110.175 177.701 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 21.2 ttmm -52.54 -57.99 8.2 Favored 'General case' 0 N--CA 1.453 -0.302 0 C-N-CA 123.616 0.766 . . . . 0.0 109.97 172.334 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 12.5 mptt -49.53 -42.51 44.09 Favored 'General case' 0 CA--C 1.535 0.394 0 N-CA-C 112.825 0.676 . . . . 0.0 112.825 176.6 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 73' ' ' ILE . . . . . . . . . . . . . 46.0 mt -59.1 -34.34 53.02 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.485 0 CA-C-N 118.399 0.545 . . . . 0.0 110.966 176.116 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 21.4 m 50.08 51.69 16.17 Favored 'General case' 0 CA--C 1.532 0.263 0 C-N-CA 124.694 1.198 . . . . 0.0 111.306 178.745 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 75' ' ' GLN . . . . . . . . . . . . . 32.7 mt-30 . . . . . 0 C--O 1.27 2.161 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.193 178.385 . . . . . . . . 0 0 . 1 . 016 nuclear build full ' A' A ' 1' ' ' LYS . . . . . . . . . . . . . 74.2 mmtt . . . . . 0 N--CA 1.45 -0.442 0 N-CA-C 108.528 -0.915 . . . . 0.0 108.528 . . . . . . . . . 0 0 . 1 . 016 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 86.3 p -69.09 154.54 94.91 Favored Pre-proline 0 CA--C 1.534 0.356 0 N-CA-C 109.758 -0.46 . . . . 0.0 109.758 175.996 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 80.0 Cg_exo -46.54 -39.58 22.77 Favored 'Trans proline' 0 N--CA 1.456 -0.702 0 C-N-CA 122.885 2.39 . . . . 0.0 112.378 169.548 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 2.8 mp0 -59.82 -49.35 78.07 Favored 'General case' 0 N--CA 1.456 -0.136 0 C-N-CA 123.956 0.902 . . . . 0.0 111.981 176.055 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 30.1 mt-10 -60.16 -45.44 93.06 Favored 'General case' 0 C--N 1.332 -0.188 0 N-CA-C 109.109 -0.7 . . . . 0.0 109.109 176.886 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 16.1 mt -61.52 -36.19 79.85 Favored 'General case' 0 N--CA 1.447 -0.579 0 C-N-CA 123.014 0.526 . . . . 0.0 112.28 179.17 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 55.8 tptt -61.31 -49.47 76.89 Favored 'General case' 0 C--N 1.329 -0.286 0 O-C-N 121.737 -0.602 . . . . 0.0 110.074 169.942 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . -50.65 -51.43 33.14 Favored Glycine 0 CA--C 1.531 1.067 0 N-CA-C 110.724 -0.95 . . . . 0.0 110.724 176.639 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 9' ' ' ILE . . . . . . . . . . . . . 3.4 mm -57.11 -55.53 20.0 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.197 0 C-N-CA 125.859 1.663 . . . . 0.0 109.417 176.628 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 10' ' ' PHE . . . . . . . . . . . . . 56.1 t80 -46.48 -52.22 13.66 Favored 'General case' 0 N--CA 1.45 -0.45 0 C-N-CA 123.49 0.716 . . . . 0.0 109.763 178.436 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 51.9 mt-10 -62.43 -50.87 69.78 Favored 'General case' 0 N--CA 1.454 -0.256 0 C-N-CA 123.214 0.606 . . . . 0.0 110.772 -179.614 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 18.1 ttmm -43.81 -53.76 5.73 Favored 'General case' 0 C--N 1.339 0.146 0 C-N-CA 124.657 1.183 . . . . 0.0 110.686 177.446 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 66.0 m-85 -78.24 -47.55 17.69 Favored 'General case' 0 N--CA 1.453 -0.32 0 C-N-CA 120.814 -0.355 . . . . 0.0 110.753 -175.922 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -52.84 -42.55 65.28 Favored 'General case' 0 C--N 1.329 -0.309 0 C-N-CA 123.493 0.717 . . . . 0.0 111.976 -179.116 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -66.05 -16.61 64.07 Favored 'General case' 0 C--N 1.332 -0.169 0 N-CA-C 113.367 0.877 . . . . 0.0 113.367 178.616 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 18.0 ttmm -71.05 83.82 0.7 Allowed 'General case' 0 N--CA 1.45 -0.432 0 N-CA-C 107.839 -1.171 . . . . 0.0 107.839 -179.011 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 38.2 mt-10 73.2 -37.21 0.38 Allowed 'General case' 0 CA--C 1.532 0.285 0 C-N-CA 126.96 2.104 . . . . 0.0 112.759 -178.134 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . -67.27 176.09 23.59 Favored Glycine 0 CA--C 1.532 1.131 0 N-CA-C 111.008 -0.837 . . . . 0.0 111.008 170.223 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 10.3 t70 -80.33 135.78 53.59 Favored Pre-proline 0 CA--C 1.533 0.305 0 N-CA-C 107.869 -1.16 . . . . 0.0 107.869 174.058 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 20' ' ' PRO . . . . . . . . . . . . . 19.5 Cg_endo -52.49 -25.8 26.37 Favored 'Trans proline' 0 CA--C 1.535 0.555 0 C-N-CA 123.205 2.603 . . . . 0.0 114.315 -178.973 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 50.7 m-80 -84.9 -6.35 59.34 Favored 'General case' 0 CA--C 1.533 0.321 0 CA-C-O 118.321 -0.847 . . . . 0.0 112.833 -178.654 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 17.6 tt0 -152.11 118.69 5.68 Favored 'General case' 0 CA--C 1.537 0.444 0 CA-C-N 119.66 1.118 . . . . 0.0 113.664 -167.929 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 52.0 mt -83.72 131.34 34.93 Favored 'General case' 0 N--CA 1.453 -0.292 0 C-N-CA 123.935 0.894 . . . . 0.0 111.186 177.764 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 92.2 p -79.71 175.63 10.45 Favored 'General case' 0 CA--C 1.536 0.431 0 N-CA-C 108.339 -0.986 . . . . 0.0 108.339 167.06 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 63.4 mttp -57.14 -41.92 79.98 Favored 'General case' 0 C--N 1.34 0.161 0 O-C-N 121.772 -0.58 . . . . 0.0 110.017 170.932 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 1.7 mp0 -63.67 -52.19 61.8 Favored 'General case' 0 N--CA 1.452 -0.366 0 C-N-CA 123.142 0.577 . . . . 0.0 110.214 -177.317 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -58.44 -41.59 85.44 Favored 'General case' 0 CA--C 1.536 0.406 0 CA-C-N 115.8 -0.636 . . . . 0.0 109.642 177.881 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 12.1 mt -56.2 -43.7 78.75 Favored 'General case' 0 C--O 1.219 -0.515 0 CA-C-N 119.174 0.897 . . . . 0.0 112.859 169.286 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 59.2 tttp -61.99 -45.93 91.47 Favored 'General case' 0 C--N 1.322 -0.593 0 CA-C-N 119.075 0.852 . . . . 0.0 110.19 -177.192 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 4.4 mm? -60.17 -50.92 71.79 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.148 -0.478 . . . . 0.0 111.159 175.556 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 7.7 tt -51.17 -55.21 19.08 Favored 'General case' 0 C--N 1.333 -0.111 0 C-N-CA 123.575 0.75 . . . . 0.0 109.711 176.876 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 47.2 mt -55.7 -56.29 22.15 Favored 'General case' 0 N--CA 1.451 -0.385 0 C-N-CA 124.346 1.058 . . . . 0.0 109.67 -177.647 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 27.5 mt-30 -55.28 -51.54 66.34 Favored 'General case' 0 N--CA 1.457 -0.086 0 CA-C-N 117.943 0.338 . . . . 0.0 111.232 -177.868 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 5.7 m -72.81 -45.8 56.52 Favored 'General case' 0 N--CA 1.451 -0.402 0 CA-C-N 116.15 -0.477 . . . . 0.0 111.077 -170.016 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 69.6 mm-40 -98.99 -39.05 8.74 Favored 'General case' 0 N--CA 1.451 -0.423 0 C-N-CA 123.757 0.823 . . . . 0.0 112.886 -169.365 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 16.8 m-85 -126.68 56.55 17.7 Favored Pre-proline 0 CA--C 1.531 0.235 0 C-N-CA 123.167 0.587 . . . . 0.0 111.505 -170.867 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 51.0 Cg_endo -61.57 -28.66 83.29 Favored 'Trans proline' 0 N--CA 1.453 -0.856 0 C-N-CA 122.294 1.996 . . . . 0.0 111.266 -175.789 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 9.0 t -57.21 -39.46 75.5 Favored 'General case' 0 CA--C 1.53 0.189 0 C-N-CA 123.354 0.661 . . . . 0.0 109.956 -179.006 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 26.3 mt -56.71 -31.79 64.85 Favored 'General case' 0 CA--C 1.533 0.293 0 O-C-N 121.617 -0.677 . . . . 0.0 111.603 177.909 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 68.2 mt -71.43 -5.56 33.74 Favored 'General case' 0 CA--C 1.533 0.302 0 O-C-N 121.606 -0.684 . . . . 0.0 112.519 -179.074 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 85.2 mttt -57.06 -41.29 78.45 Favored 'General case' 0 CA--C 1.53 0.182 0 CA-C-N 119.2 0.909 . . . . 0.0 110.198 169.234 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . 164.93 47.23 0.02 OUTLIER Glycine 0 CA--C 1.526 0.751 0 CA-C-N 116.537 -0.302 . . . . 0.0 112.882 174.27 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 43' ' ' GLY . . . . . . . . . . . . . . . -74.81 62.0 2.46 Favored Glycine 0 CA--C 1.528 0.885 0 N-CA-C 109.952 -1.259 . . . . 0.0 109.952 172.309 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 44' ' ' SER . . . . . . . . . . . . . 8.7 t 57.0 -162.21 0.2 Allowed 'General case' 0 CA--C 1.536 0.427 0 C-N-CA 125.03 1.332 . . . . 0.0 110.66 -169.432 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 20.1 p -86.9 160.77 18.6 Favored 'General case' 0 CA--C 1.527 0.092 0 N-CA-C 108.177 -1.046 . . . . 0.0 108.177 169.851 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 19.8 mt -61.96 -45.46 93.58 Favored 'General case' 0 N--CA 1.453 -0.307 0 N-CA-C 108.773 -0.825 . . . . 0.0 108.773 177.892 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 5.9 m-20 -60.25 -48.88 79.87 Favored 'General case' 0 N--CA 1.449 -0.523 0 CA-C-N 115.081 -0.963 . . . . 0.0 111.014 -179.448 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 7.9 tm-20 -64.79 -43.26 93.77 Favored 'General case' 0 N--CA 1.453 -0.317 0 N-CA-C 109.839 -0.43 . . . . 0.0 109.839 179.328 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 59.8 tp -57.34 -49.73 75.19 Favored 'General case' 0 C--N 1.333 -0.141 0 N-CA-C 109.657 -0.497 . . . . 0.0 109.657 176.829 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 50' ' ' PHE . . . . . . . . . . . . . 57.3 t80 -52.2 -46.24 65.54 Favored 'General case' 0 N--CA 1.452 -0.367 0 C-N-CA 124.043 0.937 . . . . 0.0 109.595 176.223 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 26.6 tt0 -56.66 -49.34 75.35 Favored 'General case' 0 N--CA 1.453 -0.299 0 CA-C-O 119.735 -0.174 . . . . 0.0 111.383 174.739 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 50.4 mt-10 -51.99 -47.92 64.65 Favored 'General case' 0 N--CA 1.465 0.3 0 CA-C-N 118.159 0.436 . . . . 0.0 111.353 177.582 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 80.8 mt -64.6 -55.51 19.86 Favored 'General case' 0 N--CA 1.452 -0.365 0 CA-C-O 121.269 0.557 . . . . 0.0 110.631 179.777 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 13.0 t70 -116.42 73.89 0.88 Allowed 'General case' 0 N--CA 1.452 -0.333 0 C-N-CA 126.954 2.102 . . . . 0.0 108.992 -171.093 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 17.1 mmtp -60.82 -57.29 13.28 Favored 'General case' 0 CA--C 1.523 -0.066 0 CA-C-O 121.9 0.857 . . . . 0.0 110.335 179.448 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 56' ' ' ASN . . . . . . . . . . . . . 34.3 p-10 -148.2 32.32 0.82 Allowed 'General case' 0 C--N 1.327 -0.39 0 C-N-CA 125.368 1.467 . . . . 0.0 108.099 175.217 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . -65.35 -69.43 1.35 Allowed Glycine 0 CA--C 1.525 0.69 0 N-CA-C 109.984 -1.246 . . . . 0.0 109.984 -174.693 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -145.92 -18.79 0.46 Allowed 'General case' 0 CA--C 1.54 0.584 0 C-N-CA 123.677 0.791 . . . . 0.0 112.259 -178.602 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . 106.55 -5.58 37.86 Favored Glycine 0 CA--C 1.531 1.083 0 CA-C-N 118.976 0.807 . . . . 0.0 112.575 -175.692 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 53.6 mt-10 -143.81 178.44 7.82 Favored 'General case' 0 N--CA 1.453 -0.325 0 C-N-CA 128.25 2.62 . . . . 0.0 106.764 171.823 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 61' ' ' VAL . . . . . . . . . . . . . 90.1 t -109.54 102.12 13.55 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.273 0 N-CA-C 109.794 -0.447 . . . . 0.0 109.794 -170.634 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 98.7 p -77.99 170.73 16.11 Favored 'General case' 0 CA--C 1.539 0.556 0 C-N-CA 123.196 0.598 . . . . 0.0 110.609 173.193 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 63' ' ' PHE . . . . . . . . . . . . . 54.9 t80 -59.61 -41.56 90.64 Favored 'General case' 0 CA--C 1.531 0.227 0 O-C-N 121.661 -0.65 . . . . 0.0 112.572 -172.313 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 1.9 pp20? -59.08 -57.65 12.13 Favored 'General case' 0 CA--C 1.534 0.362 0 O-C-N 121.942 -0.474 . . . . 0.0 110.918 179.782 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 10.8 pt-20 -62.42 -35.13 78.26 Favored 'General case' 0 CA--C 1.535 0.372 0 O-C-N 121.694 -0.629 . . . . 0.0 111.599 179.296 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 14.2 t80 -49.81 -34.02 18.34 Favored 'General case' 0 CA--C 1.536 0.442 0 O-C-N 121.343 -0.848 . . . . 0.0 112.47 169.53 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 67' ' ' GLN . . . . . . . . . . . . . 98.9 mm-40 -60.39 -23.26 64.19 Favored 'General case' 0 CA--C 1.537 0.459 0 O-C-N 120.697 -1.252 . . . . 0.0 112.68 176.311 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 58.5 t -62.77 -29.43 47.03 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.502 0 O-C-N 120.918 -1.114 . . . . 0.0 110.215 170.69 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 1.8 tt -72.38 -46.3 55.92 Favored 'General case' 0 N--CA 1.457 -0.095 0 N-CA-C 106.769 -1.567 . . . . 0.0 106.769 177.571 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 70' ' ' VAL . . . . . . . . . . . . . 36.3 t -57.64 -39.37 69.57 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.502 0 O-C-N 121.952 -0.468 . . . . 0.0 110.525 175.499 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 71' ' ' LYS . . . . . 0.774 ' O ' ' OXT' ' A' ' 75' ' ' GLN . 35.0 ttpt -58.5 -52.38 65.91 Favored 'General case' 0 CA--C 1.53 0.203 0 O-C-N 121.822 -0.548 . . . . 0.0 110.926 171.76 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 5.3 mptp? -47.14 -50.43 20.38 Favored 'General case' 0 CA--C 1.534 0.363 0 C-N-CA 123.062 0.545 . . . . 0.0 111.592 173.179 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 73' ' ' ILE . . . . . . . . . . . . . 61.9 mt -55.92 -52.97 43.47 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.33 0 N-CA-C 109.069 -0.715 . . . . 0.0 109.069 175.751 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 74' ' ' SER . . . . . 0.427 ' C ' ' OXT' ' A' ' 75' ' ' GLN . 4.7 m -77.71 47.25 0.6 Allowed 'General case' 0 CA--C 1.534 0.36 0 C-N-CA 124.629 1.171 . . . . 0.0 110.498 178.557 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 75' ' ' GLN . . . . . 0.774 ' OXT' ' O ' ' A' ' 71' ' ' LYS . 0.4 OUTLIER . . . . . 0 C--O 1.269 2.126 0 C-N-CA 125.591 1.557 . . . . 0.0 112.436 -169.592 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 1' ' ' LYS . . . . . . . . . . . . . 7.7 mptt . . . . . 0 N--CA 1.449 -0.504 0 N-CA-C 107.179 -1.415 . . . . 0.0 107.179 . . . . . . . . . 0 0 . 1 . 017 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 84.2 p -64.13 155.61 78.26 Favored Pre-proline 0 CA--C 1.537 0.48 0 CA-C-O 118.792 -0.623 . . . . 0.0 110.179 -179.749 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 83.4 Cg_exo -43.15 -42.7 9.87 Favored 'Trans proline' 0 N--CA 1.458 -0.572 0 C-N-CA 123.314 2.676 . . . . 0.0 113.001 172.077 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 3.0 mp0 -59.35 -47.87 83.78 Favored 'General case' 0 N--CA 1.455 -0.216 0 C-N-CA 123.934 0.894 . . . . 0.0 111.93 176.164 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 36.9 mt-10 -62.95 -43.97 97.35 Favored 'General case' 0 N--CA 1.453 -0.304 0 N-CA-C 109.349 -0.611 . . . . 0.0 109.349 178.41 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 47.7 mt -60.88 -39.7 90.22 Favored 'General case' 0 N--CA 1.45 -0.466 0 C-N-CA 123.386 0.674 . . . . 0.0 111.528 177.921 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 27.5 tptp -59.38 -46.17 89.43 Favored 'General case' 0 C--N 1.331 -0.215 0 O-C-N 121.806 -0.559 . . . . 0.0 110.348 170.05 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . -54.66 -53.51 38.61 Favored Glycine 0 CA--C 1.529 0.933 0 N-CA-C 110.338 -1.105 . . . . 0.0 110.338 179.129 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 9' ' ' ILE . . . . . . . . . . . . . 46.5 mt -51.33 -56.51 4.99 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.145 0 C-N-CA 125.641 1.576 . . . . 0.0 109.88 172.206 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 10' ' ' PHE . . . . . . . . . . . . . 49.1 t80 -49.24 -50.71 37.38 Favored 'General case' 0 N--CA 1.446 -0.673 0 N-CA-C 109.925 -0.398 . . . . 0.0 109.925 -178.438 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 57.3 mt-10 -61.99 -52.94 61.98 Favored 'General case' 0 CA--C 1.531 0.219 0 C-N-CA 122.444 0.298 . . . . 0.0 110.712 179.249 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 24.7 ttpt -43.32 -53.82 5.02 Favored 'General case' 0 C--N 1.339 0.126 0 C-N-CA 124.92 1.288 . . . . 0.0 110.736 178.645 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 66.6 m-85 -77.78 -47.63 18.5 Favored 'General case' 0 N--CA 1.45 -0.443 0 CA-C-N 116.578 -0.283 . . . . 0.0 110.408 -175.839 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -58.87 -37.18 75.95 Favored 'General case' 0 C--N 1.33 -0.275 0 O-C-N 121.417 -0.802 . . . . 0.0 112.743 -175.857 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -71.23 -22.81 61.94 Favored 'General case' 0 N--CA 1.454 -0.269 0 N-CA-C 112.211 0.448 . . . . 0.0 112.211 176.464 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 38.5 ttpt -77.01 70.37 3.41 Favored 'General case' 0 CA--C 1.534 0.336 0 N-CA-C 107.971 -1.122 . . . . 0.0 107.971 -178.89 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . 0.346 10.3 pt-20 54.85 109.71 0.01 OUTLIER 'General case' 0 N--CA 1.453 -0.304 0 C-N-CA 127.941 2.496 . . . . 0.0 113.776 -167.654 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 152.41 -159.0 28.16 Favored Glycine 0 CA--C 1.524 0.606 0 N-CA-C 104.734 -3.347 . . . . 0.0 104.734 -169.442 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 10.4 t70 -109.06 137.87 20.25 Favored Pre-proline 0 C--O 1.225 -0.235 0 N-CA-C 105.947 -1.872 . . . . 0.0 105.947 169.215 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 20' ' ' PRO . . . . . . . . . . . . . 16.5 Cg_endo -53.13 -26.4 32.93 Favored 'Trans proline' 0 CA--C 1.539 0.726 0 C-N-CA 121.896 1.731 . . . . 0.0 113.519 179.81 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 37.0 m-80 -92.01 -4.1 54.95 Favored 'General case' 0 N--CA 1.454 -0.275 0 C-N-CA 124.694 1.197 . . . . 0.0 111.937 -178.025 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 7.4 tt0 -155.13 116.66 4.05 Favored 'General case' 0 CA--C 1.539 0.533 0 CA-C-N 118.838 0.744 . . . . 0.0 112.485 -168.392 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 26.0 mt -78.29 131.49 37.09 Favored 'General case' 0 N--CA 1.455 -0.191 0 C-N-CA 123.127 0.571 . . . . 0.0 111.352 -172.642 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -77.77 158.86 29.39 Favored 'General case' 0 CA--C 1.54 0.56 0 C-N-CA 126.377 1.871 . . . . 0.0 108.867 168.766 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 31.7 ttmt -60.28 -46.02 91.29 Favored 'General case' 0 CA--C 1.534 0.342 0 O-C-N 121.546 -0.721 . . . . 0.0 112.098 -170.471 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 57.6 mm-40 -65.61 -41.35 92.85 Favored 'General case' 0 N--CA 1.454 -0.241 0 CA-C-O 121.729 0.776 . . . . 0.0 110.199 -179.216 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 4.6 mp0 -57.79 -48.08 80.73 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-N 115.527 -0.76 . . . . 0.0 109.219 175.756 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 5.0 mt -52.91 -45.33 67.55 Favored 'General case' 0 C--O 1.219 -0.546 0 N-CA-C 113.097 0.777 . . . . 0.0 113.097 168.24 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 5.7 ttpm? -58.51 -50.96 71.85 Favored 'General case' 0 C--N 1.324 -0.505 0 CA-C-N 118.883 0.765 . . . . 0.0 110.636 -178.947 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 4.1 mm? -59.58 -46.78 87.92 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.169 -0.469 . . . . 0.0 111.212 177.766 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 6.8 tt -51.45 -58.17 6.99 Favored 'General case' 0 N--CA 1.455 -0.212 0 C-N-CA 124.031 0.933 . . . . 0.0 109.064 174.787 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 38.7 mt -54.02 -58.55 6.88 Favored 'General case' 0 C--N 1.33 -0.259 0 C-N-CA 123.708 0.803 . . . . 0.0 109.421 -178.021 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 5.7 tm0? -52.56 -53.55 44.8 Favored 'General case' 0 N--CA 1.453 -0.288 0 C-N-CA 123.514 0.726 . . . . 0.0 111.2 -177.401 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 11.1 m -73.24 -47.56 42.17 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.657 -0.247 . . . . 0.0 110.997 -171.105 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 69.3 mm-40 -90.69 -37.93 13.41 Favored 'General case' 0 N--CA 1.448 -0.548 0 C-N-CA 123.647 0.779 . . . . 0.0 112.021 -169.033 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 87.0 m-85 -137.48 62.96 39.27 Favored Pre-proline 0 CA--C 1.531 0.247 0 C-N-CA 123.855 0.862 . . . . 0.0 111.784 -170.614 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 51.4 Cg_endo -60.7 -22.18 72.16 Favored 'Trans proline' 0 N--CA 1.456 -0.693 0 C-N-CA 122.382 2.054 . . . . 0.0 111.307 178.213 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 1.6 p -47.48 -52.5 17.02 Favored 'General case' 0 N--CA 1.449 -0.522 0 C-N-CA 125.886 1.674 . . . . 0.0 110.322 170.178 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 56.2 mt -62.68 -23.02 66.91 Favored 'General case' 0 C--N 1.33 -0.243 0 C-N-CA 123.524 0.729 . . . . 0.0 112.666 -177.844 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 50.7 mt -72.84 -23.92 60.82 Favored 'General case' 0 CA--C 1.529 0.167 0 CA-C-N 118.462 0.574 . . . . 0.0 111.563 173.507 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 81.1 mttt -67.62 149.09 50.52 Favored 'General case' 0 N--CA 1.445 -0.677 0 N-CA-C 106.776 -1.564 . . . . 0.0 106.776 168.985 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . 72.51 -65.31 1.38 Allowed Glycine 0 CA--C 1.533 1.159 0 N-CA-C 108.049 -2.021 . . . . 0.0 108.049 -167.212 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 43' ' ' GLY . . . . . . . . . . . . . . . 73.74 -55.82 2.13 Favored Glycine 0 CA--C 1.527 0.816 0 C-N-CA 125.029 1.299 . . . . 0.0 115.316 167.154 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 44' ' ' SER . . . . . . . . . . . . . 30.8 p 55.78 -105.0 0.24 Allowed 'General case' 0 N--CA 1.442 -0.83 0 C-N-CA 125.35 1.46 . . . . 0.0 108.914 -167.925 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 44.4 p -139.51 145.77 39.12 Favored 'General case' 0 N--CA 1.451 -0.395 0 N-CA-C 107.175 -1.417 . . . . 0.0 107.175 167.067 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 50.5 tp -49.61 -42.67 45.43 Favored 'General case' 0 N--CA 1.454 -0.265 0 C-N-CA 122.916 0.486 . . . . 0.0 109.909 170.017 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 6.1 m-20 -57.28 -53.74 54.66 Favored 'General case' 0 N--CA 1.448 -0.563 0 C-N-CA 123.907 0.883 . . . . 0.0 111.08 177.28 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 14.7 tp10 -55.93 -49.17 74.24 Favored 'General case' 0 C--N 1.332 -0.193 0 N-CA-C 110.123 -0.325 . . . . 0.0 110.123 178.741 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 43.5 tp -59.41 -47.95 83.51 Favored 'General case' 0 CA--C 1.532 0.254 0 CA-C-O 121.304 0.573 . . . . 0.0 110.152 -179.882 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 50' ' ' PHE . . . . . . . . . . . . . 74.3 t80 -55.53 -49.05 73.66 Favored 'General case' 0 N--CA 1.451 -0.378 0 C-N-CA 124.165 0.986 . . . . 0.0 110.534 178.423 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 32.9 mt-10 -59.06 -49.29 78.44 Favored 'General case' 0 N--CA 1.455 -0.208 0 C-N-CA 123.217 0.607 . . . . 0.0 110.591 177.34 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 30.5 tp10 -53.92 -44.88 70.95 Favored 'General case' 0 N--CA 1.456 -0.167 0 C-N-CA 123.463 0.705 . . . . 0.0 110.977 178.544 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 95.1 mt -72.37 -47.53 48.72 Favored 'General case' 0 N--CA 1.45 -0.453 0 CA-C-O 120.802 0.334 . . . . 0.0 111.495 -179.767 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 37.7 t0 -75.6 68.5 2.22 Favored 'General case' 0 CA--C 1.533 0.303 0 C-N-CA 124.412 1.085 . . . . 0.0 110.267 -179.942 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 34.3 mmtm -60.8 -35.12 75.68 Favored 'General case' 0 CA--C 1.534 0.363 0 C-N-CA 123.41 0.684 . . . . 0.0 111.273 170.42 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 56' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER -59.65 -39.44 84.41 Favored 'General case' 0 CA--C 1.536 0.412 0 C-N-CA 123.03 0.532 . . . . 0.0 111.203 -177.401 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . 104.16 -11.43 51.79 Favored Glycine 0 CA--C 1.53 0.97 0 C-N-CA 124.278 0.942 . . . . 0.0 114.116 170.184 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 3.0 p-10 -78.32 10.0 3.41 Favored 'General case' 0 CA--C 1.535 0.381 0 CA-C-N 119.746 1.773 . . . . 0.0 114.376 -169.885 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . 79.44 32.44 38.21 Favored Glycine 0 CA--C 1.526 0.728 0 CA-C-N 118.596 0.634 . . . . 0.0 112.347 174.298 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 51.2 mt-10 -161.0 162.54 31.86 Favored 'General case' 0 CA--C 1.534 0.348 0 C-N-CA 126.325 1.85 . . . . 0.0 106.15 168.781 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 61' ' ' VAL . . . . . . . . . . . . . 26.5 t -108.8 115.67 50.0 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.455 0 CA-C-N 118.706 0.685 . . . . 0.0 110.896 -175.833 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -78.92 150.85 32.0 Favored 'General case' 0 CA--C 1.537 0.45 0 C-N-CA 124.863 1.265 . . . . 0.0 111.362 179.411 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 63' ' ' PHE . . . . . . . . . . . . . 66.7 t80 -51.53 -44.7 62.71 Favored 'General case' 0 N--CA 1.468 0.427 0 O-C-N 121.446 -0.784 . . . . 0.0 112.586 -173.746 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 2.9 pm0 -59.77 -31.15 69.39 Favored 'General case' 0 N--CA 1.449 -0.524 0 N-CA-C 113.092 0.775 . . . . 0.0 113.092 -179.395 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 21.6 pt-20 -95.04 -27.65 15.51 Favored 'General case' 0 CA--C 1.531 0.222 0 CA-C-N 118.679 0.672 . . . . 0.0 110.797 179.001 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 9.5 t80 -53.21 -25.66 14.78 Favored 'General case' 0 CA--C 1.536 0.426 0 C-N-CA 123.6 0.76 . . . . 0.0 110.201 166.992 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 67' ' ' GLN . . . . . . . . . . . . . 66.4 mm-40 -51.58 -25.04 6.13 Favored 'General case' 0 CA--C 1.538 0.5 0 N-CA-C 113.633 0.975 . . . . 0.0 113.633 169.869 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 99.4 t -60.86 -33.06 53.9 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.556 0 CA-C-N 119.653 1.115 . . . . 0.0 110.735 172.136 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 10.5 tt -72.16 -46.16 57.53 Favored 'General case' 0 N--CA 1.457 -0.117 0 N-CA-C 107.056 -1.461 . . . . 0.0 107.056 176.694 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 70' ' ' VAL . . . . . . . . . . . . . 21.6 t -55.66 -42.05 67.54 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.457 0 N-CA-C 110.272 -0.27 . . . . 0.0 110.272 176.775 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 37.3 ttmt -56.79 -55.62 32.01 Favored 'General case' 0 N--CA 1.455 -0.205 0 C-N-CA 124.068 0.947 . . . . 0.0 110.588 173.431 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 14.0 mptt -50.1 -47.7 53.73 Favored 'General case' 0 CA--C 1.537 0.448 0 C-N-CA 122.341 0.257 . . . . 0.0 111.678 175.785 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 73' ' ' ILE . . . . . . . . . . . . . 25.3 mm -56.97 -50.13 77.08 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.265 0 C-N-CA 123.183 0.593 . . . . 0.0 109.959 176.507 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 14.2 t 71.21 -63.76 0.41 Allowed 'General case' 0 CA--C 1.531 0.249 0 C-N-CA 126.966 2.106 . . . . 0.0 111.923 175.022 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 75' ' ' GLN . . . . . . . . . . . . . 3.0 pt20 . . . . . 0 C--O 1.271 2.192 0 C-N-CA 124.816 1.246 . . . . 0.0 111.477 -179.735 . . . . . . . . 0 0 . 1 . 018 nuclear build full ' A' A ' 1' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 N--CA 1.449 -0.485 0 N-CA-C 108.69 -0.855 . . . . 0.0 108.69 . . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 77.4 p -71.32 160.93 81.03 Favored Pre-proline 0 CA--C 1.532 0.274 0 N-CA-C 109.208 -0.664 . . . . 0.0 109.208 176.686 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 82.6 Cg_exo -47.5 -42.16 29.01 Favored 'Trans proline' 0 CA--C 1.536 0.625 0 C-N-CA 122.814 2.343 . . . . 0.0 112.14 169.648 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 42.3 tt0 -58.31 -53.84 53.74 Favored 'General case' 0 N--CA 1.455 -0.175 0 C-N-CA 123.777 0.831 . . . . 0.0 111.189 177.022 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 47.0 mm-40 -62.84 -40.95 99.01 Favored 'General case' 0 N--CA 1.452 -0.367 0 N-CA-C 109.149 -0.686 . . . . 0.0 109.149 -179.265 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 40.8 mt -59.49 -38.16 80.14 Favored 'General case' 0 N--CA 1.448 -0.558 0 C-N-CA 124.286 1.035 . . . . 0.0 111.896 176.609 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 23.2 tptm -60.66 -49.92 75.58 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-N 119.069 0.85 . . . . 0.0 110.712 169.982 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . -53.45 -52.96 37.82 Favored Glycine 0 CA--C 1.531 1.039 0 N-CA-C 110.519 -1.032 . . . . 0.0 110.519 -179.542 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 9' ' ' ILE . . . . . . . . . . . . . 78.3 mt -51.89 -57.25 3.83 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.259 0 C-N-CA 126.081 1.752 . . . . 0.0 109.935 172.044 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 10' ' ' PHE . . . . . . . . . . . . . 44.4 t80 -48.84 -50.03 36.47 Favored 'General case' 0 N--CA 1.446 -0.663 0 N-CA-C 109.239 -0.652 . . . . 0.0 109.239 -177.389 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 51.0 mt-10 -61.61 -53.25 58.67 Favored 'General case' 0 CA--C 1.532 0.268 0 C-N-CA 123.047 0.539 . . . . 0.0 110.717 178.709 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 1.4 ttpm? -45.14 -50.74 11.05 Favored 'General case' 0 C--N 1.34 0.167 0 C-N-CA 124.197 0.999 . . . . 0.0 110.979 178.075 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 54.6 m-85 -77.74 -52.87 8.26 Favored 'General case' 0 N--CA 1.448 -0.561 0 N-CA-C 110.072 -0.344 . . . . 0.0 110.072 -175.397 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -50.41 -37.67 38.99 Favored 'General case' 0 C--N 1.33 -0.253 0 C-N-CA 125.278 1.431 . . . . 0.0 112.762 -179.79 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -43.6 -42.78 5.33 Favored 'General case' 0 CA--C 1.535 0.379 0 C-N-CA 123.309 0.644 . . . . 0.0 111.874 173.832 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 10.2 mtpp -66.61 -23.81 66.23 Favored 'General case' 0 CA--C 1.534 0.338 0 N-CA-C 112.599 0.592 . . . . 0.0 112.599 -177.959 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 27.8 tt0 -66.06 -27.61 68.22 Favored 'General case' 0 CA--C 1.535 0.37 0 CA-C-N 118.512 0.596 . . . . 0.0 110.041 170.37 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 108.87 -46.88 1.1 Allowed Glycine 0 CA--C 1.525 0.682 0 N-CA-C 108.582 -1.807 . . . . 0.0 108.582 -169.685 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 43.8 t0 -90.61 105.01 10.38 Favored Pre-proline 0 CA--C 1.538 0.504 0 CA-C-O 118.519 -0.753 . . . . 0.0 110.323 177.909 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 20' ' ' PRO . . . . . . . . . . . . . 29.4 Cg_endo -57.72 -21.17 46.37 Favored 'Trans proline' 0 N--CA 1.461 -0.437 0 C-N-CA 122.448 2.098 . . . . 0.0 113.365 178.338 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 42.7 m-80 -79.85 -4.92 54.29 Favored 'General case' 0 N--CA 1.45 -0.435 0 CA-C-O 117.849 -1.072 . . . . 0.0 112.74 -178.194 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 28.1 tt0 -147.57 135.08 20.83 Favored 'General case' 0 CA--C 1.539 0.536 0 CA-C-N 119.758 1.163 . . . . 0.0 113.385 -168.717 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 81.9 mt -104.17 133.12 49.63 Favored 'General case' 0 C--N 1.343 0.317 0 C-N-CA 125.171 1.389 . . . . 0.0 111.154 177.524 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 78.8 p -80.4 174.78 11.27 Favored 'General case' 0 CA--C 1.533 0.304 0 C-N-CA 123.876 0.87 . . . . 0.0 108.929 168.297 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 60.1 mttp -56.43 -40.97 75.64 Favored 'General case' 0 C--N 1.34 0.16 0 O-C-N 122.043 -0.411 . . . . 0.0 110.215 169.97 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 26.4 mt-10 -68.56 -47.1 67.7 Favored 'General case' 0 CA--C 1.517 -0.299 0 CA-C-O 120.813 0.339 . . . . 0.0 110.242 -175.764 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -56.97 -46.91 81.86 Favored 'General case' 0 N--CA 1.453 -0.312 0 CA-C-N 115.986 -0.552 . . . . 0.0 109.751 174.815 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 12.1 mt -56.27 -43.77 79.08 Favored 'General case' 0 CA--C 1.512 -0.518 0 CA-C-N 119.035 0.834 . . . . 0.0 112.988 171.827 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 65.1 tttm -61.58 -48.31 81.52 Favored 'General case' 0 C--N 1.323 -0.573 0 CA-C-N 118.672 0.669 . . . . 0.0 109.697 -176.726 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 92.0 mt -61.51 -46.7 88.86 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.232 -0.44 . . . . 0.0 111.3 177.763 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 7.1 tt -50.1 -58.16 6.13 Favored 'General case' 0 CA--C 1.521 -0.147 0 C-N-CA 124.213 1.005 . . . . 0.0 109.443 174.577 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 45.1 mt -57.68 -53.09 62.07 Favored 'General case' 0 N--CA 1.45 -0.433 0 N-CA-C 109.091 -0.707 . . . . 0.0 109.091 -178.332 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 25.5 tt0 -52.74 -47.13 67.62 Favored 'General case' 0 N--CA 1.453 -0.309 0 O-C-N 121.651 -0.656 . . . . 0.0 111.879 -177.41 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 2.5 m -75.46 -51.27 13.42 Favored 'General case' 0 CA--C 1.534 0.358 0 C-N-CA 121.058 -0.257 . . . . 0.0 111.144 -176.21 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 38.8 mm-40 -90.69 -31.25 16.67 Favored 'General case' 0 N--CA 1.451 -0.425 0 C-N-CA 123.6 0.76 . . . . 0.0 112.828 -166.724 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 82.2 m-85 -145.9 69.37 13.25 Favored Pre-proline 0 CA--C 1.537 0.45 0 C-N-CA 124.863 1.265 . . . . 0.0 111.581 -172.801 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 41.1 Cg_endo -61.41 -16.74 49.29 Favored 'Trans proline' 0 N--CA 1.457 -0.651 0 C-N-CA 122.772 2.315 . . . . 0.0 112.504 -179.421 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 4.0 p -66.55 -62.73 1.3 Allowed 'General case' 0 N--CA 1.448 -0.536 0 C-N-CA 124.377 1.071 . . . . 0.0 108.564 169.389 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 96.6 mt -58.65 -28.0 65.28 Favored 'General case' 0 CA--C 1.531 0.227 0 C-N-CA 123.879 0.872 . . . . 0.0 111.948 -178.858 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 28.4 tp -51.09 -45.59 61.52 Favored 'General case' 0 N--CA 1.463 0.198 0 CA-C-N 118.121 0.419 . . . . 0.0 110.871 169.877 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 64.4 mttm -71.21 -54.19 11.8 Favored 'General case' 0 N--CA 1.448 -0.574 0 N-CA-C 107.951 -1.129 . . . . 0.0 107.951 173.913 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . 72.88 -67.57 1.35 Allowed Glycine 0 CA--C 1.527 0.795 0 C-N-CA 124.311 0.958 . . . . 0.0 112.274 170.582 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 43' ' ' GLY . . . . . . . . . . . . . . . 163.75 -60.57 0.26 Allowed Glycine 0 CA--C 1.524 0.601 0 N-CA-C 110.002 -1.239 . . . . 0.0 110.002 179.74 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 44' ' ' SER . . . . . . . . . . . . . 17.7 p -96.69 -89.57 0.27 Allowed 'General case' 0 N--CA 1.452 -0.348 0 C-N-CA 123.979 0.911 . . . . 0.0 110.195 -175.616 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 66.2 p -150.67 156.21 40.88 Favored 'General case' 0 C--O 1.233 0.201 0 C-N-CA 123.999 0.919 . . . . 0.0 109.827 179.424 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 20.3 mt -55.74 -42.94 76.11 Favored 'General case' 0 C--O 1.223 -0.309 0 N-CA-C 108.645 -0.872 . . . . 0.0 108.645 170.474 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 5.1 m-20 -52.28 -60.59 3.03 Favored 'General case' 0 N--CA 1.449 -0.504 0 C-N-CA 124.311 1.044 . . . . 0.0 110.32 176.161 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 34.2 tt0 -53.64 -46.54 70.56 Favored 'General case' 0 N--CA 1.455 -0.205 0 O-C-N 122.425 -0.172 . . . . 0.0 110.806 179.863 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 87.9 mt -56.38 -49.68 73.76 Favored 'General case' 0 C--O 1.224 -0.277 0 C-N-CA 121.069 -0.252 . . . . 0.0 110.384 176.632 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 50' ' ' PHE . . . . . . . . . . . . . 55.0 t80 -54.67 -51.61 64.94 Favored 'General case' 0 C--N 1.329 -0.319 0 C-N-CA 124.567 1.147 . . . . 0.0 110.45 -178.927 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 1.8 mp0 -56.13 -48.25 76.58 Favored 'General case' 0 CA--C 1.531 0.245 0 CA-C-O 120.641 0.258 . . . . 0.0 110.548 174.784 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 37.0 tt0 -55.23 -43.77 74.85 Favored 'General case' 0 N--CA 1.456 -0.155 0 C-N-CA 123.047 0.539 . . . . 0.0 111.437 -179.745 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 48.3 mt -65.64 -56.59 11.36 Favored 'General case' 0 N--CA 1.448 -0.573 0 N-CA-C 109.838 -0.43 . . . . 0.0 109.838 176.028 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 47.2 t0 -79.71 60.76 3.47 Favored 'General case' 0 CA--C 1.532 0.255 0 C-N-CA 123.856 0.862 . . . . 0.0 110.909 -174.601 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 33.3 mmtm -53.93 -40.59 66.88 Favored 'General case' 0 C--N 1.34 0.163 0 C-N-CA 124.003 0.921 . . . . 0.0 111.131 174.272 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 56' ' ' ASN . . . . . . . . . . . . . 12.3 p-10 -65.46 -13.45 58.81 Favored 'General case' 0 CA--C 1.534 0.34 0 C-N-CA 125.316 1.447 . . . . 0.0 112.573 176.879 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . 58.45 40.65 94.61 Favored Glycine 0 CA--C 1.526 0.771 0 C-N-CA 124.107 0.861 . . . . 0.0 112.966 173.51 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 1.5 p30 -77.84 -26.08 49.2 Favored 'General case' 0 N--CA 1.452 -0.347 0 CA-C-N 118.252 1.026 . . . . 0.0 111.436 -179.988 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . 122.71 -19.85 7.86 Favored Glycine 0 CA--C 1.528 0.847 0 CA-C-O 118.712 -1.049 . . . . 0.0 112.873 176.815 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 50.9 mt-10 -145.85 175.99 10.01 Favored 'General case' 0 CA--C 1.529 0.149 0 C-N-CA 126.751 2.02 . . . . 0.0 107.99 178.446 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 61' ' ' VAL . . . . . . . . . . . . . 5.5 t -112.18 106.13 20.15 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.295 0 CA-C-N 118.129 0.422 . . . . 0.0 111.017 -169.621 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 59.9 p -78.87 167.72 20.75 Favored 'General case' 0 CA--C 1.539 0.531 0 C-N-CA 122.995 0.518 . . . . 0.0 111.322 173.578 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 63' ' ' PHE . . . . . . . . . . . . . 57.2 t80 -60.93 -38.15 84.81 Favored 'General case' 0 CA--C 1.533 0.294 0 O-C-N 121.447 -0.783 . . . . 0.0 112.754 -172.81 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 1.9 pp20? -63.95 -56.66 13.52 Favored 'General case' 0 CA--C 1.536 0.408 0 O-C-N 121.8 -0.562 . . . . 0.0 111.061 -178.926 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 9.1 pt-20 -60.55 -36.86 79.46 Favored 'General case' 0 CA--C 1.537 0.443 0 O-C-N 121.425 -0.797 . . . . 0.0 111.408 176.805 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 21.5 t80 -52.32 -26.87 13.31 Favored 'General case' 0 CA--C 1.538 0.489 0 O-C-N 121.551 -0.718 . . . . 0.0 112.209 170.938 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 67' ' ' GLN . . . . . . . . . . . . . 58.6 mm-40 -55.04 -23.21 18.83 Favored 'General case' 0 CA--C 1.535 0.37 0 CA-C-N 119.768 1.167 . . . . 0.0 113.43 172.821 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 92.7 t -58.59 -32.95 47.19 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.555 0 CA-C-N 119.861 1.21 . . . . 0.0 110.468 171.428 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 22.1 tp -73.81 -48.43 31.42 Favored 'General case' 0 N--CA 1.453 -0.304 0 N-CA-C 107.404 -1.332 . . . . 0.0 107.404 176.976 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 70' ' ' VAL . . . . . . . . . . . . . 38.4 t -55.03 -39.06 48.26 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.476 0 C-N-CA 122.543 0.337 . . . . 0.0 110.67 179.501 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 71' ' ' LYS . . . . . 1.016 ' O ' ' OXT' ' A' ' 75' ' ' GLN . 20.9 ttmm -56.12 -55.88 27.61 Favored 'General case' 0 N--CA 1.453 -0.322 0 C-N-CA 124.016 0.926 . . . . 0.0 110.36 171.835 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 1.2 mptm? -53.31 -45.15 68.89 Favored 'General case' 0 CA--C 1.536 0.413 0 N-CA-C 111.985 0.365 . . . . 0.0 111.985 176.276 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 73' ' ' ILE . . . . . . . . . . . . . 71.5 mt -55.84 -50.49 68.18 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.216 0 N-CA-C 108.539 -0.911 . . . . 0.0 108.539 175.29 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 6.0 m -76.74 47.2 0.49 Allowed 'General case' 0 CA--C 1.536 0.411 0 C-N-CA 124.743 1.217 . . . . 0.0 110.323 174.872 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 75' ' ' GLN . . . . . 1.016 ' OXT' ' O ' ' A' ' 71' ' ' LYS . 19.6 tt0 . . . . . 0 C--O 1.27 2.17 0 C-N-CA 123.937 0.895 . . . . 0.0 109.439 -168.52 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 1' ' ' LYS . . . . . 1.07 ' O ' ' OXT' ' A' ' 75' ' ' GLN . 11.7 mptt . . . . . 0 N--CA 1.45 -0.456 0 N-CA-C 108.889 -0.782 . . . . 0.0 108.889 . . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 2.0 p -96.89 168.98 9.39 Favored Pre-proline 0 C--O 1.238 0.477 0 N-CA-C 107.384 -1.339 . . . . 0.0 107.384 168.003 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 90.3 Cg_exo -45.69 -32.69 9.04 Favored 'Trans proline' 0 N--CA 1.455 -0.765 0 C-N-CA 123.451 2.768 . . . . 0.0 112.972 169.072 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 19.0 mt-10 -67.58 -49.0 65.23 Favored 'General case' 0 N--CA 1.455 -0.18 0 CA-C-O 121.302 0.572 . . . . 0.0 110.273 -178.145 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 5.6 mp0 -65.51 -43.18 90.9 Favored 'General case' 0 N--CA 1.452 -0.353 0 N-CA-C 107.835 -1.172 . . . . 0.0 107.835 178.821 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 14.7 mt -57.2 -37.81 72.73 Favored 'General case' 0 N--CA 1.452 -0.341 0 N-CA-C 112.321 0.489 . . . . 0.0 112.321 177.012 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 55.7 tptt -61.83 -51.15 69.44 Favored 'General case' 0 C--N 1.332 -0.152 0 CA-C-N 118.873 0.76 . . . . 0.0 110.967 170.366 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . -52.51 -50.76 46.8 Favored Glycine 0 CA--C 1.531 1.051 0 N-CA-C 110.521 -1.032 . . . . 0.0 110.521 179.869 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 9' ' ' ILE . . . . . . . . . . . . . 88.0 mt -54.79 -54.75 20.26 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.298 0 C-N-CA 126.663 1.985 . . . . 0.0 109.923 173.745 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 10' ' ' PHE . . . . . . . . . . . . . 52.0 t80 -48.63 -52.8 21.29 Favored 'General case' 0 N--CA 1.453 -0.279 0 CA-C-N 118.29 0.495 . . . . 0.0 109.807 179.081 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 52.5 mt-10 -61.26 -52.69 63.7 Favored 'General case' 0 N--CA 1.455 -0.221 0 C-N-CA 123.075 0.55 . . . . 0.0 110.271 -177.986 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 25.9 ttpt -47.79 -57.74 5.23 Favored 'General case' 0 CA--C 1.53 0.191 0 C-N-CA 124.624 1.17 . . . . 0.0 110.838 177.409 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 38.6 m-85 -75.28 -34.62 61.35 Favored 'General case' 0 N--CA 1.45 -0.474 0 CA-C-O 119.193 -0.432 . . . . 0.0 110.522 -170.105 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -57.31 -63.95 1.05 Allowed 'General case' 0 N--CA 1.453 -0.299 0 N-CA-C 109.422 -0.585 . . . . 0.0 109.422 170.87 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -51.49 -31.88 25.29 Favored 'General case' 0 CA--C 1.529 0.143 0 C-N-CA 125.311 1.445 . . . . 0.0 112.682 -177.154 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 21.2 ttmm -53.56 -29.56 37.68 Favored 'General case' 0 CA--C 1.536 0.416 0 C-N-CA 123.274 0.63 . . . . 0.0 112.486 -179.851 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 26.9 tt0 -141.93 -43.49 0.34 Allowed 'General case' 0 CA--C 1.532 0.287 0 CA-C-N 118.429 0.559 . . . . 0.0 111.909 -173.898 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . -110.41 -173.65 20.31 Favored Glycine 0 CA--C 1.526 0.731 0 C-N-CA 124.85 1.214 . . . . 0.0 111.279 -173.545 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 9.3 t70 -63.93 135.01 96.12 Favored Pre-proline 0 CA--C 1.536 0.404 0 CA-C-O 118.203 -0.904 . . . . 0.0 108.617 174.769 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 20' ' ' PRO . . . . . . . . . . . . . 11.9 Cg_endo -51.59 -24.94 18.4 Favored 'Trans proline' 0 CA--C 1.535 0.574 0 C-N-CA 123.656 2.904 . . . . 0.0 114.824 -176.499 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 58.0 m-80 -84.2 3.76 33.73 Favored 'General case' 0 CA--C 1.531 0.222 0 C-N-CA 124.008 0.923 . . . . 0.0 112.017 -178.021 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 0.7 OUTLIER -151.02 127.51 10.73 Favored 'General case' 0 N--CA 1.452 -0.368 0 O-C-N 121.395 -0.816 . . . . 0.0 112.629 -169.223 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 80.8 mt -93.44 129.43 39.61 Favored 'General case' 0 N--CA 1.452 -0.372 0 C-N-CA 122.883 0.473 . . . . 0.0 111.11 171.222 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 41.3 p -78.92 174.12 11.85 Favored 'General case' 0 CA--C 1.534 0.343 0 C-N-CA 124.255 1.022 . . . . 0.0 108.577 166.952 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 98.4 mttt -57.9 -44.84 87.0 Favored 'General case' 0 C--O 1.226 -0.153 0 O-C-N 121.837 -0.539 . . . . 0.0 110.483 172.408 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 24.3 mt-10 -66.73 -42.66 85.94 Favored 'General case' 0 N--CA 1.454 -0.253 0 CA-C-O 121.282 0.563 . . . . 0.0 110.168 -176.713 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 26.6 mt-10 -58.39 -49.42 77.31 Favored 'General case' 0 N--CA 1.451 -0.4 0 CA-C-N 115.738 -0.664 . . . . 0.0 109.211 176.152 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 10.7 mt -54.08 -42.73 69.65 Favored 'General case' 0 CA--C 1.512 -0.483 0 N-CA-C 113.28 0.845 . . . . 0.0 113.28 169.868 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 5.9 ttpm? -60.46 -53.04 62.33 Favored 'General case' 0 C--N 1.323 -0.554 0 CA-C-N 118.637 0.653 . . . . 0.0 109.845 -177.641 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 10.5 mp -59.16 -44.85 92.14 Favored 'General case' 0 C--O 1.235 0.301 0 CA-C-O 120.647 0.261 . . . . 0.0 111.294 178.433 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 6.5 tt -51.14 -57.89 7.56 Favored 'General case' 0 N--CA 1.456 -0.125 0 C-N-CA 123.682 0.793 . . . . 0.0 109.6 174.242 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 43.3 mt -54.86 -54.05 47.45 Favored 'General case' 0 N--CA 1.455 -0.203 0 C-N-CA 124.052 0.941 . . . . 0.0 109.956 -178.887 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 42.7 mt-30 -50.25 -53.11 30.61 Favored 'General case' 0 N--CA 1.457 -0.096 0 C-N-CA 123.098 0.559 . . . . 0.0 111.363 179.732 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 2.0 m -73.22 -49.64 26.83 Favored 'General case' 0 N--CA 1.454 -0.264 0 C-N-CA 120.28 -0.568 . . . . 0.0 111.259 -172.015 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 62.0 mm-40 -95.78 -31.02 13.39 Favored 'General case' 0 N--CA 1.449 -0.509 0 N-CA-C 113.382 0.882 . . . . 0.0 113.382 -166.644 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 67.9 m-85 -143.18 66.37 16.19 Favored Pre-proline 0 CA--C 1.536 0.415 0 N-CA-C 113.198 0.814 . . . . 0.0 113.198 -171.577 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 83.9 Cg_exo -48.7 -33.29 24.07 Favored 'Trans proline' 0 CA--C 1.535 0.568 0 C-N-CA 123.191 2.594 . . . . 0.0 112.598 168.884 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 2.8 p -53.97 -57.06 12.41 Favored 'General case' 0 N--CA 1.447 -0.58 0 C-N-CA 125.719 1.607 . . . . 0.0 109.497 176.657 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 79.1 mt -65.53 -39.88 92.3 Favored 'General case' 0 N--CA 1.452 -0.344 0 CA-C-N 115.51 -0.768 . . . . 0.0 111.117 177.75 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 13.2 tp -52.52 -49.44 64.82 Favored 'General case' 0 CA--C 1.529 0.169 0 CA-C-O 120.917 0.389 . . . . 0.0 110.2 177.798 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 61.5 mtpt -67.18 -53.06 33.91 Favored 'General case' 0 N--CA 1.451 -0.4 0 C-N-CA 123.309 0.644 . . . . 0.0 110.168 175.791 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . -76.24 57.75 3.24 Favored Glycine 0 CA--C 1.528 0.873 0 C-N-CA 124.856 1.217 . . . . 0.0 112.08 -177.567 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 43' ' ' GLY . . . . . . . . . . . . . . . -160.79 103.39 0.22 Allowed Glycine 0 CA--C 1.524 0.638 0 N-CA-C 108.311 -1.915 . . . . 0.0 108.311 179.32 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 44' ' ' SER . . . . . . . . . . . . . 3.4 m -41.73 -48.8 4.27 Favored 'General case' 0 CA--C 1.53 0.209 0 C-N-CA 125.442 1.497 . . . . 0.0 112.137 -174.535 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 68.8 p -145.93 154.52 42.03 Favored 'General case' 0 N--CA 1.45 -0.447 0 N-CA-C 105.733 -1.951 . . . . 0.0 105.733 166.646 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 20.9 mt -56.93 -42.37 79.9 Favored 'General case' 0 N--CA 1.452 -0.35 0 N-CA-C 107.961 -1.126 . . . . 0.0 107.961 172.604 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 5.3 m-20 -53.26 -57.07 11.82 Favored 'General case' 0 N--CA 1.449 -0.509 0 C-N-CA 124.812 1.245 . . . . 0.0 111.345 177.294 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 29.9 mm-40 -55.48 -45.88 76.95 Favored 'General case' 0 C--N 1.333 -0.135 0 O-C-N 122.438 -0.164 . . . . 0.0 110.924 177.447 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 1.1 tt -57.02 -50.0 74.08 Favored 'General case' 0 CA--C 1.537 0.46 0 CA-C-O 121.827 0.822 . . . . 0.0 109.854 178.306 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 50' ' ' PHE . . . . . . . . . . . . . 55.6 t80 -55.5 -50.64 69.39 Favored 'General case' 0 N--CA 1.45 -0.463 0 C-N-CA 125.078 1.351 . . . . 0.0 110.222 -179.195 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 74.6 mm-40 -59.38 -43.16 92.93 Favored 'General case' 0 N--CA 1.454 -0.229 0 CA-C-O 120.6 0.238 . . . . 0.0 111.317 176.185 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 7.7 tm-20 -54.26 -44.36 71.76 Favored 'General case' 0 CA--C 1.531 0.242 0 C-N-CA 122.374 0.27 . . . . 0.0 110.614 177.255 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 85.0 mt -69.43 -62.04 1.54 Allowed 'General case' 0 N--CA 1.453 -0.32 0 C-N-CA 122.436 0.295 . . . . 0.0 111.251 176.86 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 12.6 t0 -99.57 103.04 14.74 Favored 'General case' 0 N--CA 1.455 -0.192 0 C-N-CA 124.961 1.304 . . . . 0.0 109.39 178.999 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 45.3 mmtm -70.83 73.26 0.57 Allowed 'General case' 0 CA--C 1.535 0.368 0 CA-C-O 122.274 1.035 . . . . 0.0 111.728 176.771 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 56' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER 37.28 35.71 0.06 Allowed 'General case' 0 C--N 1.321 -0.644 0 C-N-CA 130.232 3.413 . . . . 0.0 114.606 -176.994 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . -83.41 -80.37 1.01 Allowed Glycine 0 CA--C 1.525 0.715 0 N-CA-C 111.016 -0.834 . . . . 0.0 111.016 -172.558 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 28.7 p-10 -91.73 -16.84 26.32 Favored 'General case' 0 CA--C 1.532 0.265 0 C-N-CA 125.142 1.377 . . . . 0.0 111.802 -178.532 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . 82.8 16.75 69.51 Favored Glycine 0 CA--C 1.529 0.938 0 CA-C-O 119.22 -0.767 . . . . 0.0 112.715 174.326 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 33.2 mt-10 -154.23 173.65 15.84 Favored 'General case' 0 CA--C 1.529 0.135 0 C-N-CA 127.2 2.2 . . . . 0.0 106.233 172.388 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 61' ' ' VAL . . . . . . . . . . . . . 46.6 t -112.1 108.63 25.99 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.318 0 CA-C-N 118.118 0.417 . . . . 0.0 110.591 -171.905 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 1.8 m -76.27 158.85 31.15 Favored 'General case' 0 CA--C 1.536 0.429 0 C-N-CA 125.517 1.527 . . . . 0.0 110.552 170.785 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 63' ' ' PHE . . . . . . . . . . . . . 54.7 t80 -53.12 -48.14 68.1 Favored 'General case' 0 CA--C 1.533 0.29 0 O-C-N 121.665 -0.647 . . . . 0.0 111.914 -174.47 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 2.8 pm0 -61.32 -25.46 67.15 Favored 'General case' 0 CA--C 1.537 0.458 0 N-CA-C 113.871 1.063 . . . . 0.0 113.871 -177.324 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 9.0 pt-20 -90.73 -37.81 13.45 Favored 'General case' 0 CA--C 1.532 0.279 0 CA-C-N 118.81 0.732 . . . . 0.0 109.225 174.977 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 9.5 t80 -51.5 -33.31 30.95 Favored 'General case' 0 CA--C 1.538 0.481 0 O-C-N 121.609 -0.682 . . . . 0.0 110.716 167.391 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 67' ' ' GLN . . . . . . . . . . . . . 23.0 mm100 -54.09 -23.04 12.47 Favored 'General case' 0 CA--C 1.538 0.503 0 O-C-N 120.841 -1.162 . . . . 0.0 113.495 174.145 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 92.1 t -62.72 -34.46 65.65 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.584 0 CA-C-N 120.039 1.29 . . . . 0.0 110.304 171.454 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 9.1 tt -71.96 -42.29 66.74 Favored 'General case' 0 N--CA 1.456 -0.152 0 N-CA-C 107.402 -1.333 . . . . 0.0 107.402 177.505 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 70' ' ' VAL . . . . . . . . . . . . . 64.4 t -58.48 -41.25 81.2 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.271 0 O-C-N 121.908 -0.495 . . . . 0.0 111.148 173.942 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 51.0 tptt -54.2 -52.43 61.28 Favored 'General case' 0 CA--C 1.53 0.199 0 O-C-N 121.554 -0.716 . . . . 0.0 110.006 173.342 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 2.1 mptm? -51.27 -46.85 62.57 Favored 'General case' 0 CA--C 1.538 0.501 0 N-CA-C 112.149 0.426 . . . . 0.0 112.149 173.27 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 73' ' ' ILE . . . . . . . . . . . . . 76.8 mt -59.21 -38.78 76.4 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.491 0 O-C-N 121.785 -0.572 . . . . 0.0 110.667 175.101 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 36.7 p 68.87 -51.43 0.58 Allowed 'General case' 0 N--CA 1.455 -0.191 0 C-N-CA 129.044 2.937 . . . . 0.0 112.458 -170.722 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 75' ' ' GLN . . . . . 1.07 ' OXT' ' O ' ' A' ' 1' ' ' LYS . 50.2 mm-40 . . . . . 0 C--O 1.27 2.163 0 C-N-CA 123.776 0.83 . . . . 0.0 110.692 176.568 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 1' ' ' LYS . . . . . . . . . . . . . 36.2 mttp . . . . . 0 N--CA 1.452 -0.372 0 N-CA-C 108.562 -0.903 . . . . 0.0 108.562 . . . . . . . . . 0 0 . 1 . 020 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -83.53 159.93 60.23 Favored Pre-proline 0 CA--C 1.54 0.574 0 C-N-CA 124.035 0.934 . . . . 0.0 110.484 -179.143 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 53.4 Cg_exo -43.54 -47.94 8.96 Favored 'Trans proline' 0 C--N 1.348 0.539 0 C-N-CA 124.443 3.429 . . . . 0.0 114.989 -174.261 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 46.3 mt-10 -60.75 -41.3 95.14 Favored 'General case' 0 CA--C 1.532 0.265 0 CA-C-O 121.323 0.582 . . . . 0.0 111.293 179.989 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 10.4 mp0 -69.41 -42.24 75.32 Favored 'General case' 0 N--CA 1.451 -0.414 0 N-CA-C 107.633 -1.247 . . . . 0.0 107.633 -178.688 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 18.7 mt -58.24 -38.71 77.39 Favored 'General case' 0 N--CA 1.448 -0.539 0 CA-C-O 119.075 -0.488 . . . . 0.0 111.674 173.004 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 2.1 tmtt? -62.88 -48.67 77.99 Favored 'General case' 0 CA--C 1.533 0.297 0 CA-C-N 119.111 0.869 . . . . 0.0 109.955 173.844 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . -54.78 -51.51 52.41 Favored Glycine 0 CA--C 1.533 1.2 0 N-CA-C 111.092 -0.803 . . . . 0.0 111.092 177.946 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 9' ' ' ILE . . . . . . . . . . . . . 3.2 mm -56.27 -50.23 72.4 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.262 0 C-N-CA 125.714 1.606 . . . . 0.0 109.359 175.549 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 10' ' ' PHE . . . . . . . . . . . . . 25.6 t80 -51.66 -49.94 61.35 Favored 'General case' 0 N--CA 1.444 -0.745 0 O-C-N 121.689 -0.632 . . . . 0.0 109.3 178.126 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 68.8 mt-10 -60.6 -50.77 72.21 Favored 'General case' 0 CA--C 1.531 0.241 0 CA-C-O 119.065 -0.493 . . . . 0.0 111.36 178.836 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 20.3 tptm -39.79 -53.98 2.17 Favored 'General case' 0 N--CA 1.464 0.238 0 C-N-CA 124.568 1.147 . . . . 0.0 110.941 175.466 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 79.0 m-85 -81.9 -46.85 13.51 Favored 'General case' 0 N--CA 1.454 -0.235 0 N-CA-C 111.655 0.242 . . . . 0.0 111.655 -176.172 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -54.25 -38.19 65.5 Favored 'General case' 0 C--N 1.329 -0.311 0 C-N-CA 124.413 1.085 . . . . 0.0 112.309 -179.333 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -49.66 -34.96 19.89 Favored 'General case' 0 CA--C 1.534 0.362 0 C-N-CA 122.961 0.504 . . . . 0.0 111.697 174.132 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 60.5 mttm -71.11 -32.47 69.07 Favored 'General case' 0 CA--C 1.533 0.323 0 C-N-CA 123.144 0.578 . . . . 0.0 110.933 -179.948 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 22.3 tt0 -63.84 -48.12 78.05 Favored 'General case' 0 C--N 1.342 0.244 0 N-CA-C 107.625 -1.25 . . . . 0.0 107.625 169.702 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 138.82 -59.18 0.6 Allowed Glycine 0 CA--C 1.519 0.329 0 N-CA-C 108.622 -1.791 . . . . 0.0 108.622 177.982 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 32.4 t0 -72.77 111.15 10.13 Favored Pre-proline 0 CA--C 1.535 0.373 0 CA-C-O 118.351 -0.833 . . . . 0.0 108.931 176.55 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 20' ' ' PRO . . . . . . . . . . . . . 30.0 Cg_endo -58.85 -19.29 46.39 Favored 'Trans proline' 0 N--CA 1.458 -0.61 0 C-N-CA 122.207 1.938 . . . . 0.0 112.985 -178.884 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 40.6 m-80 -87.36 -4.93 59.05 Favored 'General case' 0 N--CA 1.453 -0.307 0 C-N-CA 125.032 1.333 . . . . 0.0 113.27 -176.778 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 29.8 tt0 -140.75 134.11 29.78 Favored 'General case' 0 CA--C 1.541 0.61 0 CA-C-N 119.109 0.868 . . . . 0.0 112.754 -170.713 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 81.8 mt -108.8 136.36 48.49 Favored 'General case' 0 C--N 1.344 0.361 0 C-N-CA 125.339 1.455 . . . . 0.0 111.426 178.09 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 73.0 p -81.09 174.81 11.22 Favored 'General case' 0 CA--C 1.532 0.263 0 C-N-CA 124.29 1.036 . . . . 0.0 109.388 168.794 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 98.3 mttt -57.13 -46.6 82.54 Favored 'General case' 0 C--O 1.226 -0.156 0 O-C-N 122.088 -0.382 . . . . 0.0 110.129 172.143 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 45.2 tt0 -64.53 -46.2 83.93 Favored 'General case' 0 N--CA 1.452 -0.348 0 N-CA-C 110.2 -0.296 . . . . 0.0 110.2 -177.037 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -59.33 -44.63 92.58 Favored 'General case' 0 N--CA 1.45 -0.433 0 C-N-CA 120.256 -0.577 . . . . 0.0 109.872 176.97 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 11.3 mt -56.77 -43.57 80.96 Favored 'General case' 0 CA--C 1.511 -0.538 0 CA-C-N 119.168 0.894 . . . . 0.0 113.014 170.865 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 63.0 tttm -59.96 -52.3 66.0 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-N 118.754 0.706 . . . . 0.0 109.483 -178.425 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 10.3 mp -58.31 -47.83 82.45 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 116.36 -0.382 . . . . 0.0 110.92 179.237 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 7.4 tt -50.64 -58.4 5.94 Favored 'General case' 0 N--CA 1.455 -0.19 0 C-N-CA 123.531 0.732 . . . . 0.0 109.83 175.331 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 47.7 mt -54.94 -57.7 10.59 Favored 'General case' 0 C--N 1.332 -0.174 0 C-N-CA 123.654 0.782 . . . . 0.0 109.448 -177.708 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 53.0 tt0 -61.55 -45.41 94.28 Favored 'General case' 0 N--CA 1.449 -0.499 0 C-N-CA 124.729 1.212 . . . . 0.0 111.169 -170.888 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 17.9 m -76.41 -48.75 18.7 Favored 'General case' 0 N--CA 1.451 -0.377 0 CA-C-N 116.341 -0.39 . . . . 0.0 110.738 -175.191 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 71.7 mm-40 -93.26 -32.5 14.31 Favored 'General case' 0 N--CA 1.449 -0.496 0 N-CA-C 112.646 0.61 . . . . 0.0 112.646 -168.108 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 85.7 m-85 -129.1 59.09 41.74 Favored Pre-proline 0 CA--C 1.53 0.203 0 C-N-CA 123.761 0.825 . . . . 0.0 110.668 -176.251 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 46.5 Cg_endo -57.24 -30.37 87.17 Favored 'Trans proline' 0 N--CA 1.456 -0.694 0 C-N-CA 122.446 2.097 . . . . 0.0 110.901 -178.505 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -57.81 -27.66 63.34 Favored 'General case' 0 N--CA 1.449 -0.48 0 C-N-CA 126.334 1.854 . . . . 0.0 111.648 -178.187 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 45.8 mt -74.86 -26.85 59.98 Favored 'General case' 0 N--CA 1.451 -0.424 0 C-N-CA 123.298 0.639 . . . . 0.0 111.393 178.719 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 8.4 mp -78.98 78.69 5.4 Favored 'General case' 0 N--CA 1.457 -0.118 0 CA-C-O 122.868 1.318 . . . . 0.0 109.949 -177.662 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 25.9 mtpp -107.62 -65.81 1.08 Allowed 'General case' 0 C--N 1.319 -0.723 0 C-N-CA 127.705 2.402 . . . . 0.0 108.632 178.491 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . 157.12 164.44 13.63 Favored Glycine 0 CA--C 1.526 0.736 0 N-CA-C 106.888 -2.485 . . . . 0.0 106.888 -173.342 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 43' ' ' GLY . . . . . . . . . . . . . . . 141.63 -153.31 24.04 Favored Glycine 0 CA--C 1.524 0.621 0 N-CA-C 108.167 -1.973 . . . . 0.0 108.167 -175.25 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 44' ' ' SER . . . . . . . . . . . . . 2.3 m -53.14 144.33 15.86 Favored 'General case' 0 N--CA 1.451 -0.379 0 C-N-CA 123.876 0.871 . . . . 0.0 110.858 173.279 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 75.3 p -60.66 157.53 14.41 Favored 'General case' 0 CA--C 1.53 0.207 0 O-C-N 122.358 -0.214 . . . . 0.0 110.718 178.569 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 59.5 tp -47.26 -43.15 21.83 Favored 'General case' 0 C--O 1.223 -0.307 0 C-N-CA 123.29 0.636 . . . . 0.0 110.517 169.14 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 5.4 m-20 -57.84 -56.5 21.22 Favored 'General case' 0 N--CA 1.452 -0.367 0 C-N-CA 124.16 0.984 . . . . 0.0 111.132 178.182 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 33.4 mt-10 -54.63 -45.7 73.79 Favored 'General case' 0 CA--C 1.53 0.187 0 CA-C-O 120.883 0.373 . . . . 0.0 110.93 176.614 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -57.88 -51.54 69.17 Favored 'General case' 0 CA--C 1.532 0.263 0 N-CA-C 109.17 -0.678 . . . . 0.0 109.17 179.596 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 50' ' ' PHE . . . . . . . . . . . . . 68.8 t80 -53.32 -50.41 65.03 Favored 'General case' 0 N--CA 1.453 -0.307 0 C-N-CA 125.143 1.377 . . . . 0.0 110.404 178.667 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 33.1 mt-10 -55.73 -48.91 74.41 Favored 'General case' 0 CA--C 1.531 0.222 0 C-N-CA 122.974 0.51 . . . . 0.0 110.658 176.799 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 33.4 tp10 -55.99 -45.43 78.98 Favored 'General case' 0 CA--C 1.531 0.214 0 C-N-CA 123.184 0.593 . . . . 0.0 111.375 177.284 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 32.0 mt -66.32 -45.09 81.51 Favored 'General case' 0 N--CA 1.45 -0.45 0 O-C-N 122.054 -0.404 . . . . 0.0 111.778 179.138 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 51.9 t0 -74.25 59.41 0.76 Allowed 'General case' 0 CA--C 1.539 0.542 0 C-N-CA 124.961 1.305 . . . . 0.0 111.315 -174.185 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 70.4 mmtt -55.19 -39.34 69.49 Favored 'General case' 0 CA--C 1.529 0.164 0 C-N-CA 124.705 1.202 . . . . 0.0 112.456 -178.533 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 56' ' ' ASN . . . . . . . . . . . . . 26.8 p30 -73.69 -10.86 60.12 Favored 'General case' 0 CA--C 1.536 0.421 0 N-CA-C 112.115 0.413 . . . . 0.0 112.115 179.891 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . 61.59 32.49 81.54 Favored Glycine 0 CA--C 1.53 0.989 0 C-N-CA 123.894 0.759 . . . . 0.0 113.192 178.956 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 1.2 p30 -77.74 -12.93 60.02 Favored 'General case' 0 CA--C 1.531 0.237 0 CA-C-N 118.94 1.37 . . . . 0.0 111.906 -179.702 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . 103.65 -8.12 50.88 Favored Glycine 0 CA--C 1.527 0.814 0 CA-C-O 119.165 -0.797 . . . . 0.0 112.326 176.918 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 50.4 mt-10 -145.03 173.33 11.98 Favored 'General case' 0 N--CA 1.453 -0.287 0 C-N-CA 127.648 2.379 . . . . 0.0 106.859 174.985 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 61' ' ' VAL . . . . . . . . . . . . . 3.7 t -108.77 112.3 39.83 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.174 0 N-CA-C 109.767 -0.456 . . . . 0.0 109.767 -171.186 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 78.1 p -78.62 158.21 28.5 Favored 'General case' 0 CA--C 1.536 0.438 0 C-N-CA 122.804 0.441 . . . . 0.0 110.874 176.369 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 63' ' ' PHE . . . . . . . . . . . . . 69.6 t80 -55.21 -34.09 63.62 Favored 'General case' 0 N--CA 1.468 0.458 0 N-CA-C 113.248 0.833 . . . . 0.0 113.248 -177.81 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 45.7 mm-40 -65.2 -60.37 3.08 Favored 'General case' 0 N--CA 1.451 -0.424 0 O-C-N 121.85 -0.531 . . . . 0.0 109.822 179.735 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 12.8 pt-20 -66.1 -28.45 68.83 Favored 'General case' 0 CA--C 1.537 0.462 0 O-C-N 121.14 -0.975 . . . . 0.0 111.391 -177.421 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 15.9 t80 -51.85 -25.58 8.15 Favored 'General case' 0 CA--C 1.536 0.406 0 C-N-CA 123.8 0.84 . . . . 0.0 112.345 169.016 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 67' ' ' GLN . . . . . . . . . . . . . 59.3 mm-40 -54.09 -25.62 22.82 Favored 'General case' 0 CA--C 1.541 0.607 0 CA-C-N 119.532 1.06 . . . . 0.0 112.859 172.593 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 97.0 t -56.4 -33.93 39.62 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.543 0 O-C-N 121.369 -0.832 . . . . 0.0 110.853 171.626 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 25.1 tp -75.04 -47.65 27.93 Favored 'General case' 0 N--CA 1.457 -0.108 0 N-CA-C 107.993 -1.114 . . . . 0.0 107.993 175.159 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 70' ' ' VAL . . . . . . . . . . . . . 84.5 t -52.31 -37.68 23.63 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.242 0 C-N-CA 122.46 0.304 . . . . 0.0 111.112 -179.793 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 71' ' ' LYS . . . . . 0.774 ' O ' ' OXT' ' A' ' 75' ' ' GLN . 21.3 ttmm -53.01 -57.72 9.4 Favored 'General case' 0 CA--C 1.531 0.234 0 C-N-CA 123.011 0.524 . . . . 0.0 111.291 171.365 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 13.6 mptt -55.43 -44.79 76.6 Favored 'General case' 0 CA--C 1.531 0.234 0 C-N-CA 122.608 0.363 . . . . 0.0 111.181 177.54 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 73' ' ' ILE . . . . . . . . . . . . . 65.9 mt -56.74 -47.79 82.03 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.338 0 N-CA-C 109.047 -0.723 . . . . 0.0 109.047 177.301 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 8.8 m -77.43 50.09 0.77 Allowed 'General case' 0 CA--C 1.534 0.345 0 C-N-CA 124.816 1.247 . . . . 0.0 109.644 174.712 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 75' ' ' GLN . . . . . 0.774 ' OXT' ' O ' ' A' ' 71' ' ' LYS . 0.9 OUTLIER . . . . . 0 C--O 1.27 2.132 0 C-N-CA 123.828 0.851 . . . . 0.0 109.105 -168.688 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 1' ' ' LYS . . . . . . . . . . . . . 1.7 mptp? . . . . . 0 N--CA 1.45 -0.464 0 N-CA-C 108.466 -0.939 . . . . 0.0 108.466 . . . . . . . . . 0 0 . 1 . 021 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 17.1 p -88.2 170.39 11.56 Favored Pre-proline 0 CA--C 1.537 0.454 0 N-CA-C 107.842 -1.17 . . . . 0.0 107.842 169.15 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 96.0 Cg_exo -45.36 -38.85 15.88 Favored 'Trans proline' 0 N--CA 1.458 -0.618 0 C-N-CA 123.512 2.808 . . . . 0.0 113.038 176.158 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 35.1 tt0 -62.67 -45.14 94.17 Favored 'General case' 0 N--CA 1.454 -0.266 0 C-N-CA 122.82 0.448 . . . . 0.0 111.464 178.839 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 6.9 mp0 -70.34 -40.86 73.85 Favored 'General case' 0 N--CA 1.451 -0.405 0 N-CA-C 108.35 -0.982 . . . . 0.0 108.35 179.532 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 7.3 mt -56.3 -38.35 71.14 Favored 'General case' 0 N--CA 1.452 -0.336 0 C-N-CA 122.786 0.434 . . . . 0.0 111.751 175.03 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 22.8 tptm -61.8 -54.31 44.07 Favored 'General case' 0 C--N 1.333 -0.144 0 CA-C-N 118.961 0.801 . . . . 0.0 111.083 170.508 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . -49.87 -48.71 37.05 Favored Glycine 0 CA--C 1.534 1.254 0 N-CA-C 111.202 -0.759 . . . . 0.0 111.202 178.846 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 9' ' ' ILE . . . . . . . . . . . . . 2.8 mm -59.59 -54.44 34.46 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.315 0 C-N-CA 127.156 2.182 . . . . 0.0 109.209 176.999 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 10' ' ' PHE . . . . . . . . . . . . . 55.8 t80 -46.96 -53.07 13.15 Favored 'General case' 0 N--CA 1.45 -0.45 0 N-CA-C 109.45 -0.574 . . . . 0.0 109.45 177.744 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 50.4 mt-10 -59.72 -52.67 64.48 Favored 'General case' 0 N--CA 1.454 -0.251 0 C-N-CA 123.015 0.526 . . . . 0.0 110.55 179.666 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 44.5 tttp -44.13 -52.82 6.97 Favored 'General case' 0 CA--C 1.528 0.12 0 C-N-CA 124.567 1.147 . . . . 0.0 111.307 178.375 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 69.9 m-85 -78.39 -46.41 20.0 Favored 'General case' 0 CA--C 1.532 0.287 0 C-N-CA 121.182 -0.207 . . . . 0.0 110.877 -175.88 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -56.59 -31.94 64.74 Favored 'General case' 0 CA--C 1.535 0.382 0 C-N-CA 125.019 1.327 . . . . 0.0 112.583 -179.778 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -65.07 -27.83 69.05 Favored 'General case' 0 N--CA 1.452 -0.373 0 O-C-N 121.68 -0.638 . . . . 0.0 112.419 176.095 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 98.3 mttt -64.43 -50.7 66.53 Favored 'General case' 0 C--N 1.341 0.221 0 CA-C-N 119.388 0.995 . . . . 0.0 112.122 -169.506 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 26.2 tt0 -71.6 -22.93 61.65 Favored 'General case' 0 CA--C 1.533 0.289 0 O-C-N 122.215 -0.303 . . . . 0.0 110.283 175.394 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 102.51 30.85 5.44 Favored Glycine 0 C--N 1.337 0.62 0 C-N-CA 124.488 1.042 . . . . 0.0 111.188 175.739 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 65.4 t0 -128.25 67.71 75.61 Favored Pre-proline 0 N--CA 1.452 -0.371 0 N-CA-C 108.323 -0.992 . . . . 0.0 108.323 176.619 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 20' ' ' PRO . . . . . . . . . . . . . 18.9 Cg_endo -52.92 -26.68 32.31 Favored 'Trans proline' 0 CA--C 1.534 0.499 0 C-N-CA 123.315 2.676 . . . . 0.0 113.621 -172.955 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 69.0 m-80 -79.83 -20.18 46.67 Favored 'General case' 0 N--CA 1.452 -0.367 0 C-N-CA 124.306 1.042 . . . . 0.0 113.075 -178.541 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 12.0 tt0 -154.13 124.32 6.9 Favored 'General case' 0 CA--C 1.538 0.481 0 CA-C-N 119.147 0.885 . . . . 0.0 112.631 -168.098 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 42.6 mt -81.65 141.2 33.87 Favored 'General case' 0 C--O 1.234 0.276 0 C-N-CA 124.083 0.953 . . . . 0.0 112.101 -177.775 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 90.5 p -86.57 173.08 9.8 Favored 'General case' 0 CA--C 1.537 0.442 0 C-N-CA 124.42 1.088 . . . . 0.0 109.373 167.312 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 92.9 mttt -55.0 -44.18 74.27 Favored 'General case' 0 C--O 1.225 -0.224 0 O-C-N 121.814 -0.554 . . . . 0.0 110.731 173.685 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 46.4 mp0 -66.02 -50.27 64.82 Favored 'General case' 0 N--CA 1.45 -0.443 0 CA-C-O 121.389 0.614 . . . . 0.0 109.769 -174.136 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 65.5 mt-10 -53.13 -48.88 67.54 Favored 'General case' 0 N--CA 1.451 -0.376 0 CA-C-N 114.874 -1.057 . . . . 0.0 109.867 174.131 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 11.5 mt -57.18 -40.67 77.81 Favored 'General case' 0 CA--C 1.514 -0.418 0 N-CA-C 113.386 0.884 . . . . 0.0 113.386 172.959 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 5.1 ttpm? -63.23 -49.72 73.05 Favored 'General case' 0 C--N 1.322 -0.601 0 CA-C-N 118.817 0.735 . . . . 0.0 109.836 -177.572 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 4.1 mm? -60.01 -48.52 81.38 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.752 177.369 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 8.6 tt -50.26 -56.81 9.59 Favored 'General case' 0 N--CA 1.456 -0.143 0 C-N-CA 123.869 0.867 . . . . 0.0 109.568 175.476 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 39.1 mt -55.73 -58.63 7.02 Favored 'General case' 0 C--N 1.331 -0.22 0 C-N-CA 123.696 0.798 . . . . 0.0 109.58 -178.809 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 23.0 tt0 -55.9 -47.48 77.38 Favored 'General case' 0 N--CA 1.452 -0.328 0 C-N-CA 123.231 0.612 . . . . 0.0 111.337 -174.171 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 12.7 m -76.98 -45.82 26.12 Favored 'General case' 0 N--CA 1.451 -0.381 0 CA-C-N 116.224 -0.444 . . . . 0.0 111.229 -172.538 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 71.3 mm-40 -97.35 -33.37 11.45 Favored 'General case' 0 N--CA 1.451 -0.42 0 N-CA-C 112.685 0.624 . . . . 0.0 112.685 -168.32 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 54.2 m-85 -138.37 61.85 27.64 Favored Pre-proline 0 C--O 1.236 0.343 0 C-N-CA 123.521 0.728 . . . . 0.0 111.409 -174.408 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 57.1 Cg_endo -61.39 -25.29 79.87 Favored 'Trans proline' 0 N--CA 1.455 -0.781 0 C-N-CA 122.549 2.166 . . . . 0.0 110.682 176.354 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 2.7 p -51.12 -56.81 10.8 Favored 'General case' 0 N--CA 1.448 -0.543 0 C-N-CA 125.976 1.711 . . . . 0.0 109.247 170.337 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 39.5 mt -66.65 -40.02 88.49 Favored 'General case' 0 N--CA 1.454 -0.268 0 C-N-CA 123.51 0.724 . . . . 0.0 111.315 177.422 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 9.1 tp -51.77 -48.74 63.62 Favored 'General case' 0 CA--C 1.529 0.167 0 CA-C-O 120.75 0.31 . . . . 0.0 110.356 178.919 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 36.4 mtmm -71.98 -65.2 0.8 Allowed 'General case' 0 N--CA 1.45 -0.426 0 CA-C-O 121.738 0.78 . . . . 0.0 110.199 174.845 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . -77.29 65.53 3.04 Favored Glycine 0 CA--C 1.525 0.668 0 C-N-CA 125.019 1.295 . . . . 0.0 110.866 -176.97 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 43' ' ' GLY . . . . . . . . . . . . . . . -151.5 -110.42 0.47 Allowed Glycine 0 CA--C 1.524 0.608 0 N-CA-C 109.679 -1.368 . . . . 0.0 109.679 177.133 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 44' ' ' SER . . . . . . . . . . . . . 32.8 t -171.09 -160.53 0.19 Allowed 'General case' 0 N--CA 1.453 -0.297 0 N-CA-C 105.969 -1.864 . . . . 0.0 105.969 178.033 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 53.1 p -60.1 145.97 44.76 Favored 'General case' 0 N--CA 1.454 -0.25 0 CA-C-O 121.193 0.521 . . . . 0.0 110.061 177.042 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 52.0 tp -49.24 -43.54 42.87 Favored 'General case' 0 C--O 1.224 -0.249 0 CA-C-N 116.0 -0.545 . . . . 0.0 110.058 171.335 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 6.6 m-20 -53.16 -61.18 2.47 Favored 'General case' 0 N--CA 1.448 -0.563 0 C-N-CA 124.053 0.941 . . . . 0.0 110.588 175.7 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 25.5 mt-10 -51.33 -49.89 60.52 Favored 'General case' 0 C--N 1.332 -0.169 0 N-CA-C 111.308 0.114 . . . . 0.0 111.308 178.765 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 8.8 mp -55.87 -48.08 76.2 Favored 'General case' 0 C--N 1.334 -0.105 0 CA-C-O 120.747 0.308 . . . . 0.0 110.454 178.032 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 50' ' ' PHE . . . . . . . . . . . . . 63.8 t80 -58.34 -48.94 78.95 Favored 'General case' 0 N--CA 1.448 -0.533 0 C-N-CA 123.198 0.599 . . . . 0.0 110.481 -178.989 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 1.2 mp0 -56.77 -50.27 72.8 Favored 'General case' 0 N--CA 1.455 -0.224 0 N-CA-C 110.51 -0.182 . . . . 0.0 110.51 176.854 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 39.1 mt-10 -54.04 -47.18 71.86 Favored 'General case' 0 CA--C 1.529 0.166 0 CA-C-O 121.1 0.476 . . . . 0.0 110.972 178.597 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 90.8 mt -68.96 -42.38 76.71 Favored 'General case' 0 N--CA 1.451 -0.424 0 C-N-CA 123.509 0.724 . . . . 0.0 111.931 -177.05 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 52.5 t0 -73.65 64.66 0.92 Allowed 'General case' 0 CA--C 1.537 0.461 0 C-N-CA 124.286 1.034 . . . . 0.0 111.31 -175.545 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 32.6 mmtp -76.41 71.92 3.11 Favored 'General case' 0 N--CA 1.453 -0.291 0 CA-C-O 122.694 1.235 . . . . 0.0 110.087 168.883 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 56' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -167.17 -47.85 0.02 OUTLIER 'General case' 0 C--N 1.322 -0.628 0 C-N-CA 127.725 2.41 . . . . 0.0 108.527 173.693 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . 101.95 4.29 51.39 Favored Glycine 0 CA--C 1.531 1.043 0 CA-C-O 118.988 -0.896 . . . . 0.0 114.553 170.31 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 5.3 p-10 -77.29 -0.21 24.58 Favored 'General case' 0 CA--C 1.532 0.273 0 CA-C-N 119.653 1.726 . . . . 0.0 112.584 -179.827 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . 77.45 38.02 29.75 Favored Glycine 0 CA--C 1.525 0.661 0 CA-C-O 119.256 -0.747 . . . . 0.0 111.37 176.996 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 35.3 mt-10 -161.07 173.43 15.21 Favored 'General case' 0 CA--C 1.533 0.322 0 C-N-CA 127.696 2.398 . . . . 0.0 106.809 169.82 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 61' ' ' VAL . . . . . . . . . . . . . 3.4 t -129.08 108.76 17.51 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.516 0 CA-C-N 118.469 0.577 . . . . 0.0 112.125 -172.418 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 75.7 m -77.82 163.76 25.79 Favored 'General case' 0 CA--C 1.538 0.483 0 C-N-CA 124.467 1.107 . . . . 0.0 111.512 173.813 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 63' ' ' PHE . . . . . . . . . . . . . 61.7 t80 -59.69 -38.26 81.08 Favored 'General case' 0 CA--C 1.534 0.353 0 N-CA-C 113.028 0.751 . . . . 0.0 113.028 -172.806 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 50.0 mt-10 -61.74 -59.57 4.97 Favored 'General case' 0 CA--C 1.532 0.256 0 O-C-N 121.902 -0.499 . . . . 0.0 110.167 -179.067 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 16.6 pt-20 -61.55 -35.94 79.19 Favored 'General case' 0 CA--C 1.539 0.536 0 O-C-N 121.458 -0.776 . . . . 0.0 111.644 178.561 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 18.5 t80 -52.74 -22.89 5.77 Favored 'General case' 0 CA--C 1.536 0.426 0 C-N-CA 123.703 0.801 . . . . 0.0 112.439 169.932 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 67' ' ' GLN . . . . . . . . . . . . . 34.2 mm-40 -53.69 -21.55 7.25 Favored 'General case' 0 CA--C 1.537 0.453 0 CA-C-N 119.789 1.177 . . . . 0.0 113.001 171.063 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 70.8 t -55.49 -36.7 42.49 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.651 0 CA-C-N 119.886 1.221 . . . . 0.0 110.464 169.454 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 12.4 tp -72.59 -44.22 62.31 Favored 'General case' 0 N--CA 1.457 -0.108 0 N-CA-C 108.061 -1.088 . . . . 0.0 108.061 177.662 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 70' ' ' VAL . . . . . . . . . . . . . 54.3 t -54.04 -40.04 44.04 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.36 0 N-CA-C 110.157 -0.312 . . . . 0.0 110.157 175.946 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 21.4 ttmm -59.8 -56.62 19.48 Favored 'General case' 0 CA--C 1.53 0.193 0 C-N-CA 123.297 0.639 . . . . 0.0 110.799 171.433 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 2.6 mptm? -48.64 -34.5 11.87 Favored 'General case' 0 CA--C 1.539 0.527 0 N-CA-C 112.583 0.586 . . . . 0.0 112.583 175.837 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 73' ' ' ILE . . . . . . . . . . . . . 27.9 mm -72.39 -66.08 0.6 Allowed 'Isoleucine or valine' 0 CA--C 1.533 0.323 0 CA-C-N 118.423 0.556 . . . . 0.0 110.583 173.288 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 74' ' ' SER . . . . . 0.702 ' O ' ' OXT' ' A' ' 75' ' ' GLN . 61.3 p -63.17 -35.22 79.57 Favored 'General case' 0 C--N 1.332 -0.169 0 N-CA-C 113.885 1.068 . . . . 0.0 113.885 -168.342 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 75' ' ' GLN . . . . . 0.702 ' OXT' ' O ' ' A' ' 74' ' ' SER . 35.3 mt-30 . . . . . 0 C--O 1.27 2.15 0 C-N-CA 125.078 1.351 . . . . 0.0 111.744 175.184 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 1' ' ' LYS . . . . . . . . . . . . . 9.4 mptt . . . . . 0 N--CA 1.45 -0.452 0 N-CA-C 107.46 -1.311 . . . . 0.0 107.46 . . . . . . . . . 0 0 . 1 . 022 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 6.3 p -71.79 156.94 90.56 Favored Pre-proline 0 CA--C 1.536 0.442 0 CA-C-O 118.834 -0.603 . . . . 0.0 109.41 176.737 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 85.1 Cg_exo -44.78 -42.7 15.08 Favored 'Trans proline' 0 N--CA 1.46 -0.495 0 C-N-CA 123.491 2.794 . . . . 0.0 113.665 177.95 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 3.2 mp0 -58.13 -48.92 78.74 Favored 'General case' 0 N--CA 1.456 -0.135 0 C-N-CA 123.88 0.872 . . . . 0.0 111.531 176.893 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 58.5 mm-40 -66.38 -38.5 87.68 Favored 'General case' 0 N--CA 1.448 -0.565 0 N-CA-C 109.085 -0.709 . . . . 0.0 109.085 179.343 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 48.2 mt -62.32 -35.62 79.62 Favored 'General case' 0 N--CA 1.451 -0.415 0 C-N-CA 123.436 0.694 . . . . 0.0 112.536 174.877 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 23.4 tptm -61.07 -49.18 78.39 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 118.88 0.764 . . . . 0.0 109.599 169.045 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . -49.7 -51.57 27.94 Favored Glycine 0 CA--C 1.534 1.22 0 N-CA-C 111.092 -0.803 . . . . 0.0 111.092 176.055 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 9' ' ' ILE . . . . . . . . . . . . . 2.8 mm -58.12 -54.22 35.2 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.241 0 C-N-CA 126.28 1.832 . . . . 0.0 109.327 177.117 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 10' ' ' PHE . . . . . . . . . . . . . 50.6 t80 -47.9 -52.21 20.21 Favored 'General case' 0 N--CA 1.449 -0.476 0 C-N-CA 123.503 0.721 . . . . 0.0 109.219 178.693 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 52.0 mt-10 -61.22 -51.4 69.16 Favored 'General case' 0 CA--C 1.532 0.281 0 C-N-CA 123.063 0.545 . . . . 0.0 110.553 179.724 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 37.7 tttm -45.1 -53.26 8.19 Favored 'General case' 0 C--N 1.338 0.108 0 C-N-CA 124.42 1.088 . . . . 0.0 111.124 177.981 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 68.2 m-85 -78.6 -43.78 25.58 Favored 'General case' 0 N--CA 1.454 -0.24 0 C-N-CA 121.041 -0.264 . . . . 0.0 110.97 -175.832 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -58.55 -28.73 65.76 Favored 'General case' 0 CA--C 1.532 0.284 0 C-N-CA 124.181 0.992 . . . . 0.0 112.228 179.779 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -58.6 -32.7 69.23 Favored 'General case' 0 N--CA 1.452 -0.342 0 C-N-CA 122.999 0.519 . . . . 0.0 112.191 174.106 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 3.9 mptp? -64.25 151.5 43.47 Favored 'General case' 0 CA--C 1.532 0.287 0 N-CA-C 108.591 -0.892 . . . . 0.0 108.591 178.871 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 37.2 mt-10 68.87 -60.43 0.45 Allowed 'General case' 0 CA--C 1.532 0.28 0 C-N-CA 125.834 1.654 . . . . 0.0 109.672 -168.34 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 139.02 50.61 0.05 OUTLIER Glycine 0 CA--C 1.524 0.599 0 C-N-CA 124.756 1.169 . . . . 0.0 111.927 169.285 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 44.7 t0 -135.51 64.51 58.73 Favored Pre-proline 0 C--N 1.34 0.185 0 CA-C-N 118.467 1.133 . . . . 0.0 110.782 177.094 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 20' ' ' PRO . . . . . . . . . . . . . 12.8 Cg_endo -50.38 -23.57 10.49 Favored 'Trans proline' 0 CA--C 1.537 0.656 0 C-N-CA 123.846 3.03 . . . . 0.0 114.385 -177.312 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -80.84 -25.26 37.85 Favored 'General case' 0 N--CA 1.451 -0.42 0 C-N-CA 125.591 1.556 . . . . 0.0 111.814 -174.685 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 59.1 tt0 -153.33 121.62 6.22 Favored 'General case' 0 N--CA 1.451 -0.409 0 N-CA-C 110.013 -0.366 . . . . 0.0 110.013 -165.9 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 50.0 mt -77.65 131.81 37.93 Favored 'General case' 0 N--CA 1.449 -0.511 0 N-CA-C 109.338 -0.616 . . . . 0.0 109.338 -174.798 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 50.9 p -75.2 167.02 22.71 Favored 'General case' 0 N--CA 1.448 -0.538 0 N-CA-C 108.448 -0.945 . . . . 0.0 108.448 169.038 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 30.9 ttmt -58.06 -37.84 75.18 Favored 'General case' 0 CA--C 1.538 0.505 0 O-C-N 121.984 -0.448 . . . . 0.0 110.104 173.963 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 24.6 mt-10 -67.68 -47.2 70.15 Favored 'General case' 0 N--CA 1.455 -0.212 0 O-C-N 121.529 -0.732 . . . . 0.0 110.667 179.008 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 23.7 mt-10 -57.49 -44.7 85.16 Favored 'General case' 0 CA--C 1.534 0.364 0 N-CA-C 109.525 -0.546 . . . . 0.0 109.525 177.455 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 15.3 mt -54.0 -48.23 70.64 Favored 'General case' 0 CA--C 1.508 -0.646 0 CA-C-N 118.317 0.508 . . . . 0.0 112.192 169.205 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 52.4 tttp -60.64 -43.12 97.91 Favored 'General case' 0 C--N 1.322 -0.593 0 CA-C-N 118.602 0.637 . . . . 0.0 110.268 -176.505 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 87.7 mt -60.88 -52.01 66.88 Favored 'General case' 0 C--N 1.328 -0.355 0 O-C-N 122.18 -0.325 . . . . 0.0 111.324 175.263 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 7.1 tt -48.15 -58.22 4.81 Favored 'General case' 0 C--N 1.334 -0.108 0 C-N-CA 124.38 1.072 . . . . 0.0 109.27 175.887 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 46.6 mt -59.14 -54.16 50.15 Favored 'General case' 0 N--CA 1.449 -0.512 0 C-N-CA 123.96 0.904 . . . . 0.0 109.868 -175.6 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 25.7 mt-30 -56.55 -48.91 76.31 Favored 'General case' 0 C--O 1.227 -0.13 0 CA-C-N 118.548 0.613 . . . . 0.0 110.996 -177.515 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 11.2 m -72.36 -47.52 48.88 Favored 'General case' 0 N--CA 1.453 -0.298 0 CA-C-N 116.325 -0.398 . . . . 0.0 110.691 -171.983 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 76.3 mm-40 -91.77 -33.4 15.01 Favored 'General case' 0 N--CA 1.451 -0.425 0 C-N-CA 123.553 0.741 . . . . 0.0 112.295 -169.438 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 79.8 m-85 -142.74 63.44 13.88 Favored Pre-proline 0 CA--C 1.539 0.54 0 C-N-CA 123.969 0.907 . . . . 0.0 112.857 -171.105 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 88.9 Cg_exo -43.83 -39.17 10.44 Favored 'Trans proline' 0 CA--C 1.534 0.504 0 C-N-CA 123.734 2.956 . . . . 0.0 114.053 176.297 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 1.5 m -60.5 -43.25 97.25 Favored 'General case' 0 N--CA 1.448 -0.561 0 C-N-CA 124.502 1.121 . . . . 0.0 110.9 -169.824 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 40.1 mt -56.53 -29.94 62.5 Favored 'General case' 0 CA--C 1.53 0.199 0 C-N-CA 124.754 1.222 . . . . 0.0 112.9 -169.822 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 9.8 mp -58.22 -35.4 71.62 Favored 'General case' 0 CA--C 1.533 0.291 0 C-N-CA 122.576 0.351 . . . . 0.0 110.802 176.771 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 58.7 mtmt -105.77 -68.76 0.85 Allowed 'General case' 0 N--CA 1.449 -0.504 0 C-N-CA 125.39 1.476 . . . . 0.0 109.187 -176.559 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . -76.53 64.31 2.92 Favored Glycine 0 CA--C 1.525 0.669 0 N-CA-C 109.393 -1.483 . . . . 0.0 109.393 175.718 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 43' ' ' GLY . . . . . . . . . . . . . . . 174.96 -89.77 0.08 OUTLIER Glycine 0 N--CA 1.449 -0.451 0 N-CA-C 108.378 -1.889 . . . . 0.0 108.378 179.494 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 44' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -177.56 165.65 2.15 Favored 'General case' 0 N--CA 1.448 -0.554 0 C-N-CA 124.13 0.972 . . . . 0.0 108.897 -177.885 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 69.5 p -70.34 163.35 26.78 Favored 'General case' 0 CA--C 1.532 0.267 0 CA-C-O 121.65 0.738 . . . . 0.0 110.772 179.298 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 49.3 tp -51.13 -51.6 52.02 Favored 'General case' 0 N--CA 1.454 -0.27 0 C-N-CA 124.074 0.95 . . . . 0.0 111.833 177.735 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 13.5 m-20 -59.48 -49.41 77.91 Favored 'General case' 0 N--CA 1.45 -0.458 0 C-N-CA 123.104 0.561 . . . . 0.0 109.908 -177.627 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 47.8 mt-10 -51.94 -53.13 44.78 Favored 'General case' 0 N--CA 1.454 -0.253 0 CA-C-N 116.357 -0.383 . . . . 0.0 110.644 174.413 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 6.0 mp -53.6 -52.44 59.81 Favored 'General case' 0 CA--C 1.527 0.068 0 CA-C-O 121.256 0.551 . . . . 0.0 110.428 178.304 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 50' ' ' PHE . . . . . . . . . . . . . 39.3 t80 -55.76 -45.37 78.08 Favored 'General case' 0 N--CA 1.446 -0.647 0 O-C-N 122.015 -0.428 . . . . 0.0 110.584 -178.065 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 35.5 mt-10 -67.6 -40.76 84.74 Favored 'General case' 0 N--CA 1.456 -0.17 0 CA-C-N 118.237 0.471 . . . . 0.0 112.069 179.67 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 30.8 mt-10 -53.15 -46.95 69.09 Favored 'General case' 0 N--CA 1.456 -0.128 0 C-N-CA 122.964 0.506 . . . . 0.0 110.147 174.326 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 76.2 mt -80.85 -55.89 4.5 Favored 'General case' 0 N--CA 1.45 -0.426 0 C-N-CA 122.849 0.46 . . . . 0.0 111.462 -173.358 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 14.3 t0 -102.47 102.61 12.92 Favored 'General case' 0 N--CA 1.448 -0.538 0 C-N-CA 126.173 1.789 . . . . 0.0 107.624 -179.156 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 1.6 tppt? -66.51 -9.57 35.97 Favored 'General case' 0 CA--C 1.535 0.369 0 N-CA-C 113.429 0.9 . . . . 0.0 113.429 179.878 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 56' ' ' ASN . . . . . . . . . . . . . 6.5 p30 129.7 -25.26 0.01 OUTLIER 'General case' 0 N--CA 1.467 0.401 0 C-N-CA 131.499 3.92 . . . . 0.0 109.152 -174.914 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . -52.82 -57.7 13.62 Favored Glycine 0 C--N 1.338 0.667 0 C-N-CA 124.168 0.89 . . . . 0.0 112.609 -168.697 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 24.3 p-10 -95.6 -9.66 31.6 Favored 'General case' 0 CA--C 1.536 0.436 0 N-CA-C 112.666 0.617 . . . . 0.0 112.666 -175.434 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . 68.19 -8.51 1.98 Allowed Glycine 0 CA--C 1.531 1.032 0 C-N-CA 125.725 1.631 . . . . 0.0 116.468 168.077 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 7.3 mm-40 -149.9 164.64 34.87 Favored 'General case' 0 CA--C 1.535 0.376 0 C-N-CA 129.65 3.18 . . . . 0.0 102.94 169.543 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 61' ' ' VAL . . . . . . . . . . . . . 91.8 t -96.21 111.56 26.67 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.432 0 CA-C-N 120.365 1.439 . . . . 0.0 112.992 -167.791 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 60.4 p -80.41 161.46 24.94 Favored 'General case' 0 CA--C 1.541 0.606 0 O-C-N 121.428 -0.795 . . . . 0.0 112.173 175.866 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 63' ' ' PHE . . . . . . . . . . . . . 63.6 t80 -58.65 -40.29 83.0 Favored 'General case' 0 N--CA 1.464 0.246 0 C-N-CA 123.026 0.53 . . . . 0.0 112.428 -172.885 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 20.8 pm0 -61.82 -50.64 71.47 Favored 'General case' 0 N--CA 1.448 -0.535 0 O-C-N 121.865 -0.522 . . . . 0.0 111.355 -178.267 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 10.5 pt-20 -71.38 -31.55 67.43 Favored 'General case' 0 CA--C 1.53 0.195 0 O-C-N 121.398 -0.814 . . . . 0.0 110.948 178.232 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 25.0 t80 -51.83 -27.93 14.14 Favored 'General case' 0 CA--C 1.54 0.591 0 CA-C-N 118.526 0.603 . . . . 0.0 111.747 169.472 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 67' ' ' GLN . . . . . . . . . . . . . 46.7 mm-40 -54.54 -29.79 51.97 Favored 'General case' 0 N--CA 1.469 0.492 0 O-C-N 120.742 -1.224 . . . . 0.0 113.022 171.393 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 82.9 t -61.38 -32.8 54.24 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.405 0 O-C-N 121.173 -0.954 . . . . 0.0 110.028 172.575 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 1.2 tt -71.78 -48.75 44.44 Favored 'General case' 0 N--CA 1.454 -0.243 0 N-CA-C 106.206 -1.776 . . . . 0.0 106.206 177.788 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 70' ' ' VAL . . . . . . . . . . . . . 42.9 t -50.64 -45.87 27.3 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.373 0 C-N-CA 122.176 0.19 . . . . 0.0 110.494 175.922 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 5.7 ttpm? -57.08 -54.51 45.89 Favored 'General case' 0 CA--C 1.532 0.276 0 C-N-CA 123.267 0.627 . . . . 0.0 111.08 173.674 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 1.9 mptm? -50.13 -38.68 40.26 Favored 'General case' 0 CA--C 1.534 0.342 0 N-CA-C 112.608 0.596 . . . . 0.0 112.608 176.318 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 73' ' ' ILE . . . . . . . . . . . . . 19.2 mt -66.06 -58.8 5.33 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.27 0 N-CA-C 109.022 -0.733 . . . . 0.0 109.022 171.576 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 43.0 t -74.19 58.13 0.69 Allowed 'General case' 0 CA--C 1.533 0.317 0 C-N-CA 126.74 2.016 . . . . 0.0 111.879 -173.072 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 75' ' ' GLN . . . . . . . . . . . . . 13.7 mt-30 . . . . . 0 C--O 1.271 2.195 0 C-N-CA 124.592 1.157 . . . . 0.0 110.062 177.572 . . . . . . . . 0 0 . 1 . 023 nuclear build full ' A' A ' 1' ' ' LYS . . . . . . . . . . . . . 36.9 mttm . . . . . 0 N--CA 1.449 -0.476 0 N-CA-C 108.651 -0.87 . . . . 0.0 108.651 . . . . . . . . . 0 0 . 1 . 023 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 92.6 p -73.12 160.58 82.44 Favored Pre-proline 0 CA--C 1.532 0.267 0 N-CA-C 109.13 -0.693 . . . . 0.0 109.13 177.414 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 79.8 Cg_exo -50.21 -36.18 45.54 Favored 'Trans proline' 0 N--CA 1.456 -0.702 0 C-N-CA 122.311 2.008 . . . . 0.0 112.284 169.585 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 48.2 mt-10 -63.74 -49.68 72.1 Favored 'General case' 0 CA--C 1.529 0.166 0 C-N-CA 123.59 0.756 . . . . 0.0 110.923 177.209 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 46.9 mm-40 -58.65 -45.76 88.64 Favored 'General case' 0 N--CA 1.455 -0.204 0 N-CA-C 108.959 -0.756 . . . . 0.0 108.959 176.016 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 66.9 mt -60.83 -37.96 83.83 Favored 'General case' 0 N--CA 1.447 -0.579 0 C-N-CA 124.141 0.976 . . . . 0.0 112.56 179.848 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 2.6 tppp? -57.99 -53.85 53.55 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 119.249 0.932 . . . . 0.0 109.575 168.832 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . -49.17 -52.99 20.94 Favored Glycine 0 CA--C 1.536 1.344 0 N-CA-C 111.651 -0.58 . . . . 0.0 111.651 178.005 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 9' ' ' ILE . . . . . . . . . . . . . 1.9 mm -56.83 -51.38 68.34 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.231 0 C-N-CA 127.056 2.142 . . . . 0.0 109.265 176.205 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 10' ' ' PHE . . . . . . . . . . . . . 21.7 t80 -51.62 -48.95 63.1 Favored 'General case' 0 N--CA 1.445 -0.68 0 O-C-N 121.365 -0.834 . . . . 0.0 108.955 179.659 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 49.8 mt-10 -63.77 -49.39 73.16 Favored 'General case' 0 CA--C 1.531 0.237 0 CA-C-O 118.679 -0.677 . . . . 0.0 111.281 179.344 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 48.2 tptt -39.09 -51.47 1.87 Allowed 'General case' 0 N--CA 1.467 0.41 0 C-N-CA 124.74 1.216 . . . . 0.0 110.662 174.072 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 80.8 m-85 -81.43 -57.69 3.37 Favored 'General case' 0 N--CA 1.451 -0.4 0 C-N-CA 121.074 -0.25 . . . . 0.0 111.532 -177.632 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -48.63 -43.63 36.57 Favored 'General case' 0 C--N 1.331 -0.204 0 C-N-CA 124.665 1.186 . . . . 0.0 112.374 -177.242 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -47.11 -33.78 5.38 Favored 'General case' 0 CA--C 1.53 0.183 0 C-N-CA 124.272 1.029 . . . . 0.0 112.921 -179.821 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 24.5 mtmm -59.97 -26.66 66.19 Favored 'General case' 0 CA--C 1.539 0.531 0 CA-C-N 118.946 0.794 . . . . 0.0 112.427 179.926 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 42.3 mt-10 -79.56 -15.29 57.95 Favored 'General case' 0 CA--C 1.529 0.159 0 C-N-CA 124.395 1.078 . . . . 0.0 111.986 174.707 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 97.47 -56.49 1.2 Allowed Glycine 0 CA--C 1.523 0.556 0 N-CA-C 108.532 -1.827 . . . . 0.0 108.532 -169.759 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 9.9 t70 -62.96 117.83 36.46 Favored Pre-proline 0 CA--C 1.538 0.494 0 CA-C-O 118.977 -0.535 . . . . 0.0 110.062 178.235 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 20' ' ' PRO . . . . . . . . . . . . . 68.8 Cg_endo -79.75 -25.38 5.37 Favored 'Trans proline' 0 N--CA 1.456 -0.72 0 C-N-CA 122.303 2.002 . . . . 0.0 112.855 -177.53 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 35.7 m120 -91.24 -5.2 55.16 Favored 'General case' 0 C--O 1.234 0.267 0 C-N-CA 125.207 1.403 . . . . 0.0 113.763 -168.716 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 49.2 tt0 -141.42 129.6 22.19 Favored 'General case' 0 CA--C 1.541 0.599 0 C-N-CA 123.674 0.79 . . . . 0.0 111.69 -169.684 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 63.0 mt -102.42 137.39 40.73 Favored 'General case' 0 C--N 1.344 0.359 0 C-N-CA 125.107 1.363 . . . . 0.0 111.958 -179.358 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 78.1 p -79.51 172.95 13.09 Favored 'General case' 0 C--O 1.234 0.25 0 C-N-CA 124.609 1.164 . . . . 0.0 109.368 168.542 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 58.7 mttm -56.66 -47.58 79.48 Favored 'General case' 0 N--CA 1.456 -0.161 0 O-C-N 122.124 -0.36 . . . . 0.0 110.031 172.007 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 41.5 tt0 -64.2 -46.39 84.14 Favored 'General case' 0 N--CA 1.45 -0.433 0 N-CA-C 110.286 -0.264 . . . . 0.0 110.286 -175.911 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 1.1 mp0 -61.6 -41.69 97.8 Favored 'General case' 0 N--CA 1.45 -0.47 0 CA-C-O 118.532 -0.746 . . . . 0.0 110.098 177.671 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 12.8 mt -57.0 -44.89 83.19 Favored 'General case' 0 CA--C 1.512 -0.519 0 CA-C-N 119.746 1.157 . . . . 0.0 112.611 169.476 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 4.8 ttpm? -61.7 -47.55 84.77 Favored 'General case' 0 C--N 1.323 -0.549 0 CA-C-N 118.495 0.589 . . . . 0.0 109.905 -176.113 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 9.8 mp -60.53 -48.23 82.68 Favored 'General case' 0 C--N 1.329 -0.289 0 C-N-CA 122.539 0.336 . . . . 0.0 111.198 176.715 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 7.4 tt -50.38 -58.25 6.12 Favored 'General case' 0 C--N 1.333 -0.138 0 C-N-CA 123.7 0.8 . . . . 0.0 109.552 175.441 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 42.0 mt -57.45 -53.46 57.85 Favored 'General case' 0 N--CA 1.452 -0.339 0 CA-C-N 115.656 -0.702 . . . . 0.0 109.295 -177.527 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 22.2 tt0 -54.6 -49.31 70.75 Favored 'General case' 0 N--CA 1.453 -0.301 0 C-N-CA 123.683 0.793 . . . . 0.0 111.659 -177.281 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 2.7 m -72.8 -50.4 24.5 Favored 'General case' 0 CA--C 1.532 0.269 0 C-N-CA 120.968 -0.293 . . . . 0.0 110.869 -175.416 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 65.5 mm-40 -92.67 -30.02 15.79 Favored 'General case' 0 N--CA 1.45 -0.453 0 N-CA-C 113.254 0.835 . . . . 0.0 113.254 -165.966 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 80.8 m-85 -142.19 61.45 12.14 Favored Pre-proline 0 CA--C 1.535 0.368 0 C-N-CA 124.019 0.928 . . . . 0.0 111.413 -175.256 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 39.2 Cg_endo -60.54 -30.49 90.77 Favored 'Trans proline' 0 N--CA 1.457 -0.668 0 C-N-CA 122.825 2.35 . . . . 0.0 111.19 -178.42 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 2.9 p -53.59 -57.22 11.52 Favored 'General case' 0 N--CA 1.446 -0.627 0 C-N-CA 125.523 1.529 . . . . 0.0 109.173 174.834 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 93.1 mt -66.82 -38.41 86.4 Favored 'General case' 0 N--CA 1.452 -0.346 0 C-N-CA 123.962 0.905 . . . . 0.0 111.484 179.119 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 2.9 tm? -53.08 -49.6 66.09 Favored 'General case' 0 N--CA 1.462 0.135 0 N-CA-C 110.018 -0.364 . . . . 0.0 110.018 177.425 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 58.9 mtmt -70.15 -65.74 0.69 Allowed 'General case' 0 N--CA 1.451 -0.388 0 CA-C-O 121.765 0.793 . . . . 0.0 110.228 175.539 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . -79.13 67.84 3.2 Favored Glycine 0 CA--C 1.525 0.689 0 C-N-CA 124.559 1.076 . . . . 0.0 110.62 -177.833 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 43' ' ' GLY . . . . . . . . . . . . . . . -154.57 175.25 32.76 Favored Glycine 0 CA--C 1.524 0.65 0 N-CA-C 110.461 -1.056 . . . . 0.0 110.461 178.882 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 44' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -63.61 160.05 17.57 Favored 'General case' 0 N--CA 1.45 -0.472 0 C-N-CA 123.72 0.808 . . . . 0.0 109.74 171.195 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 11.7 p -59.45 144.15 47.85 Favored 'General case' 0 N--CA 1.452 -0.345 0 N-CA-C 108.82 -0.807 . . . . 0.0 108.82 174.101 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 65.6 tp -50.27 -45.78 54.55 Favored 'General case' 0 C--O 1.227 -0.115 0 C-N-CA 123.314 0.646 . . . . 0.0 111.923 -170.464 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 16.0 m-20 -60.02 -51.9 67.68 Favored 'General case' 0 N--CA 1.447 -0.624 0 CA-C-O 120.918 0.39 . . . . 0.0 111.305 -179.839 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 44.0 tt0 -56.05 -48.26 76.35 Favored 'General case' 0 N--CA 1.451 -0.419 0 CA-C-N 115.998 -0.546 . . . . 0.0 109.759 177.157 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 62.1 tp -56.02 -50.94 69.5 Favored 'General case' 0 N--CA 1.452 -0.362 0 C-N-CA 122.893 0.477 . . . . 0.0 110.216 178.943 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 50' ' ' PHE . . . . . . . . . . . . . 64.3 t80 -54.77 -50.44 68.44 Favored 'General case' 0 N--CA 1.45 -0.444 0 C-N-CA 123.649 0.78 . . . . 0.0 110.217 179.54 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 35.4 mt-10 -59.21 -47.26 86.0 Favored 'General case' 0 N--CA 1.454 -0.252 0 CA-C-O 120.677 0.275 . . . . 0.0 110.905 179.552 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 35.3 mm-40 -62.34 -37.0 83.95 Favored 'General case' 0 C--N 1.332 -0.17 0 C-N-CA 123.025 0.53 . . . . 0.0 111.75 179.962 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 79.9 mt -72.97 -44.95 60.51 Favored 'General case' 0 N--CA 1.449 -0.478 0 O-C-N 122.038 -0.414 . . . . 0.0 111.53 178.176 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 27.4 t70 -78.78 60.16 2.73 Favored 'General case' 0 C--O 1.235 0.298 0 CA-C-O 121.023 0.439 . . . . 0.0 111.795 -170.01 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 29.7 mmmt -74.97 77.74 2.18 Favored 'General case' 0 N--CA 1.452 -0.354 0 CA-C-O 122.941 1.353 . . . . 0.0 110.956 -179.66 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 56' ' ' ASN . . . . . . . . . . . . . 3.8 p30 -172.28 -37.65 0.02 OUTLIER 'General case' 0 C--N 1.322 -0.595 0 C-N-CA 129.206 3.003 . . . . 0.0 108.6 175.862 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . 94.43 14.17 51.56 Favored Glycine 0 CA--C 1.53 0.99 0 CA-C-O 118.732 -1.038 . . . . 0.0 114.844 170.222 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 1.3 p-10 -74.35 -36.33 63.61 Favored 'General case' 0 CA--C 1.532 0.253 0 CA-C-N 119.756 1.778 . . . . 0.0 109.395 172.116 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . 127.9 -66.53 0.56 Allowed Glycine 0 N--CA 1.443 -0.868 0 C-N-CA 126.107 1.813 . . . . 0.0 108.813 178.289 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 36.4 mt-10 -77.69 130.95 37.45 Favored 'General case' 0 C--N 1.331 -0.199 0 CA-C-O 121.211 0.529 . . . . 0.0 110.062 -168.331 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 61' ' ' VAL . . . . . . . . . . . . . 3.6 t -80.42 117.69 26.78 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.251 0 C-N-CA 123.827 0.851 . . . . 0.0 110.955 -166.361 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 87.0 p -76.71 157.01 32.06 Favored 'General case' 0 CA--C 1.532 0.267 0 CA-C-N 118.161 0.437 . . . . 0.0 110.466 177.484 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 63' ' ' PHE . . . . . . . . . . . . . 79.3 t80 -55.22 -32.13 62.01 Favored 'General case' 0 CA--C 1.533 0.291 0 O-C-N 121.762 -0.586 . . . . 0.0 112.394 177.087 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 44.3 mt-10 -64.95 -61.63 2.05 Favored 'General case' 0 N--CA 1.451 -0.404 0 O-C-N 121.803 -0.56 . . . . 0.0 110.12 178.329 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 8.4 pt-20 -66.21 -27.53 68.05 Favored 'General case' 0 CA--C 1.538 0.508 0 O-C-N 121.143 -0.973 . . . . 0.0 111.522 -177.824 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 18.0 t80 -52.22 -25.26 8.8 Favored 'General case' 0 CA--C 1.537 0.468 0 C-N-CA 123.848 0.859 . . . . 0.0 111.931 168.449 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 67' ' ' GLN . . . . . . . . . . . . . 67.9 mm-40 -55.17 -23.95 24.26 Favored 'General case' 0 CA--C 1.538 0.482 0 CA-C-N 119.678 1.126 . . . . 0.0 113.01 171.435 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 91.6 t -60.86 -36.32 70.79 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.532 0 CA-C-N 119.575 1.08 . . . . 0.0 110.233 169.914 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 1.4 tt -72.38 -46.05 57.04 Favored 'General case' 0 N--CA 1.453 -0.283 0 N-CA-C 106.694 -1.595 . . . . 0.0 106.694 178.659 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 70' ' ' VAL . . . . . . . . . . . . . 40.3 t -54.16 -42.4 55.86 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.408 0 O-C-N 122.092 -0.38 . . . . 0.0 110.743 175.193 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 48.8 tttp -55.81 -53.54 55.47 Favored 'General case' 0 N--CA 1.452 -0.331 0 CA-C-O 119.124 -0.465 . . . . 0.0 110.243 172.983 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 14.2 mptt -52.07 -47.88 64.96 Favored 'General case' 0 CA--C 1.535 0.394 0 CA-C-N 118.049 0.386 . . . . 0.0 111.913 176.668 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 73' ' ' ILE . . . . . . . . . . . . . 76.3 mt -53.09 -49.01 52.34 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.378 0 N-CA-C 108.671 -0.863 . . . . 0.0 108.671 175.082 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 74' ' ' SER . . . . . 0.987 ' O ' ' OXT' ' A' ' 75' ' ' GLN . 4.2 m -83.02 19.17 1.45 Allowed 'General case' 0 CA--C 1.536 0.432 0 C-N-CA 124.462 1.105 . . . . 0.0 112.402 179.462 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 75' ' ' GLN . . . . . 0.987 ' OXT' ' O ' ' A' ' 74' ' ' SER . 32.2 mm-40 . . . . . 0 C--O 1.271 2.19 0 C-N-CA 125.691 1.597 . . . . 0.0 112.242 -169.26 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 1' ' ' LYS . . . . . 0.612 ' O ' ' OXT' ' A' ' 75' ' ' GLN . 42.0 mmtm . . . . . 0 CA--C 1.533 0.301 0 N-CA-C 109.727 -0.472 . . . . 0.0 109.727 . . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 56.2 p -83.16 163.33 51.05 Favored Pre-proline 0 CA--C 1.534 0.36 0 C-N-CA 123.198 0.599 . . . . 0.0 109.388 174.916 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 92.8 Cg_exo -45.35 -44.09 16.6 Favored 'Trans proline' 0 N--CA 1.459 -0.505 0 C-N-CA 123.382 2.721 . . . . 0.0 113.037 173.917 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 3.0 mp0 -57.43 -50.71 72.12 Favored 'General case' 0 N--CA 1.455 -0.191 0 C-N-CA 123.957 0.903 . . . . 0.0 111.51 177.978 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 54.0 mm-40 -60.86 -44.46 97.0 Favored 'General case' 0 N--CA 1.451 -0.389 0 N-CA-C 108.667 -0.864 . . . . 0.0 108.667 177.693 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 21.0 mt -60.46 -35.75 76.62 Favored 'General case' 0 N--CA 1.447 -0.579 0 C-N-CA 123.492 0.717 . . . . 0.0 112.212 -179.023 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 23.9 tptm -61.09 -51.9 67.18 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 118.799 0.727 . . . . 0.0 110.731 169.369 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . -53.27 -52.16 42.39 Favored Glycine 0 CA--C 1.53 1.028 0 N-CA-C 110.412 -1.075 . . . . 0.0 110.412 -179.434 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 9' ' ' ILE . . . . . . . . . . . . . 77.5 mt -53.34 -54.61 17.05 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.345 0 C-N-CA 126.466 1.906 . . . . 0.0 110.1 173.289 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 10' ' ' PHE . . . . . . . . . . . . . 53.5 t80 -49.36 -53.34 22.89 Favored 'General case' 0 N--CA 1.45 -0.475 0 N-CA-C 108.84 -0.8 . . . . 0.0 108.84 -179.075 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 51.3 mt-10 -60.81 -52.93 63.0 Favored 'General case' 0 N--CA 1.455 -0.213 0 C-N-CA 122.623 0.369 . . . . 0.0 110.333 -178.273 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 17.2 ttpp -45.88 -54.84 7.51 Favored 'General case' 0 C--O 1.23 0.074 0 C-N-CA 125.142 1.377 . . . . 0.0 111.322 178.73 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 57.9 m-85 -77.18 -48.21 18.24 Favored 'General case' 0 N--CA 1.451 -0.415 0 N-CA-C 110.009 -0.367 . . . . 0.0 110.009 -175.191 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -47.91 -50.08 27.92 Favored 'General case' 0 N--CA 1.463 0.215 0 C-N-CA 124.641 1.176 . . . . 0.0 111.413 179.461 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -50.52 -37.92 41.7 Favored 'General case' 0 N--CA 1.453 -0.279 0 C-N-CA 123.717 0.807 . . . . 0.0 112.526 177.279 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 37.4 ttpt -76.18 70.36 2.82 Favored 'General case' 0 N--CA 1.45 -0.444 0 C-N-CA 123.72 0.808 . . . . 0.0 109.245 -177.924 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 34.4 tt0 120.2 -56.65 0.0 OUTLIER 'General case' 0 N--CA 1.468 0.457 0 C-N-CA 129.803 3.241 . . . . 0.0 111.314 173.564 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . -88.95 14.05 61.46 Favored Glycine 0 CA--C 1.525 0.678 0 CA-C-O 119.128 -0.818 . . . . 0.0 114.221 -167.436 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER 58.1 150.95 0.07 OUTLIER Pre-proline 0 CA--C 1.543 0.68 0 C-N-CA 125.728 1.611 . . . . 0.0 112.091 -169.707 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 20' ' ' PRO . . . . . . . . . . . . . 4.8 Cg_endo -47.02 -22.0 1.88 Allowed 'Trans proline' 0 CA--C 1.536 0.597 0 C-N-CA 123.914 3.076 . . . . 0.0 116.576 -174.317 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 53.1 m-80 -91.49 -5.66 53.85 Favored 'General case' 0 N--CA 1.449 -0.523 0 C-N-CA 123.695 0.798 . . . . 0.0 112.023 -171.969 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -152.43 127.52 9.75 Favored 'General case' 0 CA--C 1.538 0.493 0 CA-C-N 119.671 1.123 . . . . 0.0 112.852 -167.942 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 70.2 mt -94.54 124.82 38.8 Favored 'General case' 0 C--O 1.235 0.328 0 O-C-N 121.501 -0.749 . . . . 0.0 110.555 174.761 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 4.9 p -79.02 177.67 8.62 Favored 'General case' 0 C--O 1.238 0.463 0 N-CA-C 107.841 -1.17 . . . . 0.0 107.841 166.411 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 98.7 mttt -54.94 -39.77 69.22 Favored 'General case' 0 N--CA 1.451 -0.377 0 O-C-N 122.192 -0.318 . . . . 0.0 110.338 173.304 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 28.5 mt-10 -69.94 -45.61 67.1 Favored 'General case' 0 N--CA 1.454 -0.272 0 N-CA-C 109.65 -0.5 . . . . 0.0 109.65 -173.113 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 1.6 mp0 -55.17 -50.14 70.1 Favored 'General case' 0 N--CA 1.45 -0.464 0 N-CA-C 109.24 -0.652 . . . . 0.0 109.24 173.676 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 8.0 mt -56.33 -41.59 76.31 Favored 'General case' 0 CA--C 1.513 -0.473 0 N-CA-C 113.198 0.814 . . . . 0.0 113.198 174.365 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 64.7 tttm -62.6 -51.84 65.74 Favored 'General case' 0 C--N 1.321 -0.651 0 CA-C-N 118.485 0.584 . . . . 0.0 110.026 -177.383 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 4.0 mm? -60.41 -46.15 91.03 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.115 -0.493 . . . . 0.0 111.143 178.008 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 6.6 tt -51.23 -57.49 8.68 Favored 'General case' 0 C--N 1.333 -0.152 0 C-N-CA 124.217 1.007 . . . . 0.0 109.399 174.649 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 35.1 mt -55.07 -56.78 15.95 Favored 'General case' 0 C--N 1.331 -0.22 0 C-N-CA 123.23 0.612 . . . . 0.0 109.557 -178.065 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 23.5 mt-30 -52.25 -53.48 43.27 Favored 'General case' 0 N--CA 1.456 -0.135 0 C-N-CA 123.088 0.555 . . . . 0.0 111.671 -178.67 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 13.4 m -74.07 -47.73 34.64 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 116.266 -0.424 . . . . 0.0 110.822 -169.96 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 69.8 mm-40 -85.71 -34.59 21.21 Favored 'General case' 0 N--CA 1.449 -0.513 0 C-N-CA 123.207 0.603 . . . . 0.0 111.313 -170.986 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 82.5 m-85 -139.78 61.07 17.37 Favored Pre-proline 0 CA--C 1.536 0.438 0 C-N-CA 123.67 0.788 . . . . 0.0 112.278 -171.562 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 49.2 Cg_endo -62.33 -21.13 72.21 Favored 'Trans proline' 0 N--CA 1.458 -0.611 0 C-N-CA 123.169 2.58 . . . . 0.0 111.952 -179.558 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 4.8 p -73.39 -68.7 0.48 Allowed 'General case' 0 N--CA 1.445 -0.687 0 C-N-CA 124.217 1.007 . . . . 0.0 108.363 175.403 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 91.1 mt -58.51 -24.11 59.75 Favored 'General case' 0 CA--C 1.53 0.185 0 C-N-CA 124.384 1.073 . . . . 0.0 112.197 -173.709 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 57.9 tp -44.1 -37.85 3.31 Favored 'General case' 0 CA--C 1.537 0.45 0 C-N-CA 123.649 0.78 . . . . 0.0 112.56 169.104 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 53.4 mtpt 26.36 -93.76 0.01 OUTLIER 'General case' 0 N--CA 1.446 -0.629 0 C-N-CA 128.276 2.63 . . . . 0.0 114.623 -176.642 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . 151.72 -148.38 19.32 Favored Glycine 0 CA--C 1.525 0.664 0 N-CA-C 107.499 -2.241 . . . . 0.0 107.499 -173.468 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 43' ' ' GLY . . . . . . . . . . . . . . . 71.45 -74.63 0.71 Allowed Glycine 0 CA--C 1.526 0.755 0 N-CA-C 109.42 -1.472 . . . . 0.0 109.42 -176.725 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 44' ' ' SER . . . . . . . . . . . . . 17.2 m -68.6 139.89 55.53 Favored 'General case' 0 N--CA 1.452 -0.328 0 N-CA-C 108.428 -0.953 . . . . 0.0 108.428 169.913 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 69.8 p -80.45 154.49 27.59 Favored 'General case' 0 CA--C 1.531 0.225 0 N-CA-C 109.668 -0.493 . . . . 0.0 109.668 179.426 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 58.2 tp -52.5 -43.5 65.08 Favored 'General case' 0 C--O 1.225 -0.204 0 N-CA-C 109.739 -0.467 . . . . 0.0 109.739 169.807 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 5.6 m-20 -56.77 -53.51 56.96 Favored 'General case' 0 N--CA 1.45 -0.472 0 C-N-CA 124.067 0.947 . . . . 0.0 110.868 177.285 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 76.5 tt0 -54.78 -50.55 68.2 Favored 'General case' 0 C--N 1.33 -0.254 0 C-N-CA 122.942 0.497 . . . . 0.0 110.528 177.929 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 59.5 tp -57.31 -48.36 79.13 Favored 'General case' 0 N--CA 1.455 -0.18 0 CA-C-O 121.27 0.557 . . . . 0.0 109.979 178.856 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 50' ' ' PHE . . . . . . . . . . . . . 80.3 t80 -56.18 -48.12 76.99 Favored 'General case' 0 N--CA 1.45 -0.469 0 C-N-CA 123.777 0.831 . . . . 0.0 110.43 179.492 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 33.6 mt-10 -59.6 -46.77 87.98 Favored 'General case' 0 N--CA 1.455 -0.207 0 C-N-CA 122.883 0.473 . . . . 0.0 110.612 177.641 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 44.5 tt0 -54.47 -49.22 70.62 Favored 'General case' 0 CA--C 1.53 0.182 0 C-N-CA 123.065 0.546 . . . . 0.0 110.589 177.416 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 72.8 mt -70.1 -44.49 68.89 Favored 'General case' 0 N--CA 1.45 -0.449 0 C-N-CA 123.229 0.612 . . . . 0.0 111.672 -177.102 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 52.1 t0 -73.58 57.18 0.55 Allowed 'General case' 0 CA--C 1.535 0.371 0 C-N-CA 125.34 1.456 . . . . 0.0 109.655 177.108 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 12.3 tptm -65.36 -28.82 69.55 Favored 'General case' 0 N--CA 1.452 -0.361 0 O-C-N 121.611 -0.681 . . . . 0.0 111.449 -172.627 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 56' ' ' ASN . . . . . . . . . . . . . 30.0 p30 -75.09 -11.34 60.07 Favored 'General case' 0 CA--C 1.536 0.422 0 N-CA-C 112.178 0.436 . . . . 0.0 112.178 174.827 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . 63.75 32.83 85.49 Favored Glycine 0 CA--C 1.53 0.981 0 C-N-CA 124.043 0.83 . . . . 0.0 113.345 179.28 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 2.2 p30 -78.31 -15.17 59.01 Favored 'General case' 0 CA--C 1.533 0.314 0 CA-C-N 118.948 1.374 . . . . 0.0 112.237 -179.509 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . 108.21 -8.44 35.67 Favored Glycine 0 CA--C 1.53 0.975 0 C-N-CA 123.909 0.766 . . . . 0.0 112.653 177.521 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 37.3 mt-10 -146.29 177.38 9.05 Favored 'General case' 0 N--CA 1.455 -0.223 0 C-N-CA 127.265 2.226 . . . . 0.0 107.087 175.286 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 61' ' ' VAL . . . . . . . . . . . . . 3.0 t -108.47 115.32 48.96 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.244 0 N-CA-C 109.865 -0.42 . . . . 0.0 109.865 -177.554 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 78.1 p -79.52 161.68 25.87 Favored 'General case' 0 CA--C 1.536 0.405 0 C-N-CA 123.842 0.857 . . . . 0.0 110.086 171.272 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 63' ' ' PHE . . . . . . . . . . . . . 60.4 t80 -59.15 -38.56 79.98 Favored 'General case' 0 N--CA 1.462 0.172 0 O-C-N 121.613 -0.679 . . . . 0.0 111.732 -176.064 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 22.0 mp0 -63.38 -57.29 10.81 Favored 'General case' 0 N--CA 1.447 -0.613 0 N-CA-C 109.163 -0.68 . . . . 0.0 109.163 -175.071 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 15.5 pt-20 -66.4 -32.81 74.43 Favored 'General case' 0 CA--C 1.537 0.464 0 O-C-N 121.545 -0.722 . . . . 0.0 111.459 179.007 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 18.6 t80 -53.22 -24.85 12.12 Favored 'General case' 0 CA--C 1.538 0.502 0 O-C-N 121.467 -0.771 . . . . 0.0 111.73 169.553 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 67' ' ' GLN . . . . . . . . . . . . . 33.8 mm-40 -54.05 -22.96 11.99 Favored 'General case' 0 CA--C 1.535 0.389 0 CA-C-N 119.569 1.077 . . . . 0.0 113.291 172.218 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 69.7 t -53.25 -37.92 29.71 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.487 0 CA-C-N 119.484 1.038 . . . . 0.0 110.38 170.073 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 19.9 tp -74.6 -48.55 25.9 Favored 'General case' 0 N--CA 1.456 -0.165 0 N-CA-C 108.3 -1.0 . . . . 0.0 108.3 177.53 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 70' ' ' VAL . . . . . . . . . . . . . 56.5 t -51.25 -41.5 24.74 Favored 'Isoleucine or valine' 0 C--O 1.225 -0.233 0 C-N-CA 122.574 0.35 . . . . 0.0 110.641 -179.718 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 21.7 tptm -51.97 -58.21 7.18 Favored 'General case' 0 N--CA 1.454 -0.248 0 C-N-CA 123.331 0.652 . . . . 0.0 110.993 174.392 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 4.4 mptp? -54.23 -45.74 72.37 Favored 'General case' 0 CA--C 1.531 0.23 0 C-N-CA 122.528 0.331 . . . . 0.0 111.144 177.816 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 73' ' ' ILE . . . . . 0.861 HG22 ' OXT' ' A' ' 75' ' ' GLN . 50.1 mm -63.24 -39.92 87.08 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.323 0 O-C-N 122.333 -0.23 . . . . 0.0 110.933 -179.766 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 85.4 p 57.72 -84.71 0.02 OUTLIER 'General case' 0 CA--C 1.533 0.319 0 C-N-CA 127.555 2.342 . . . . 0.0 110.233 -169.137 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 75' ' ' GLN . . . . . 0.861 ' OXT' HG22 ' A' ' 73' ' ' ILE . 14.1 mm100 . . . . . 0 C--O 1.27 2.148 0 C-N-CA 125.81 1.644 . . . . 0.0 107.645 169.293 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 95.4 Cg_exo . . . . . 0 N--CA 1.458 -0.614 0 N-CA-C 112.657 0.214 . . . . 0.0 112.657 . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild core ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 2.9 mp0 -60.38 -48.74 80.47 Favored 'General case' 0 N--CA 1.455 -0.216 0 C-N-CA 124.005 0.922 . . . . 0.0 112.04 176.114 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 32.8 mt-10 -62.18 -44.41 96.66 Favored 'General case' 0 N--CA 1.453 -0.282 0 N-CA-C 109.19 -0.67 . . . . 0.0 109.19 177.802 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 40.9 mt -60.48 -38.01 82.88 Favored 'General case' 0 N--CA 1.449 -0.504 0 C-N-CA 123.455 0.702 . . . . 0.0 111.869 177.648 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 20.8 tptm -60.62 -49.72 76.39 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 118.442 0.564 . . . . 0.0 110.221 170.635 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . -50.84 -50.1 39.1 Favored Glycine 0 CA--C 1.531 1.061 0 N-CA-C 110.63 -0.988 . . . . 0.0 110.63 177.176 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 9' ' ' ILE . . . . . . . . . . . . . 19.5 mm -58.98 -54.76 29.63 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.235 0 C-N-CA 125.826 1.65 . . . . 0.0 109.958 176.904 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 10' ' ' PHE . . . . . . . . . . . . . 32.3 t80 -47.66 -52.78 16.97 Favored 'General case' 0 N--CA 1.451 -0.419 0 O-C-N 121.605 -0.685 . . . . 0.0 109.703 177.762 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 52.9 mt-10 -60.02 -51.19 70.71 Favored 'General case' 0 N--CA 1.453 -0.318 0 C-N-CA 123.668 0.787 . . . . 0.0 110.359 -179.578 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 58.4 tttt -44.27 -59.91 2.16 Favored 'General case' 0 C--N 1.339 0.115 0 C-N-CA 124.126 0.97 . . . . 0.0 110.214 175.913 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 63.0 m-85 -75.42 -38.73 59.63 Favored 'General case' 0 N--CA 1.452 -0.345 0 C-N-CA 120.449 -0.5 . . . . 0.0 110.88 -169.124 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -57.24 -58.85 6.44 Favored 'General case' 0 C--O 1.237 0.411 0 CA-C-O 122.013 0.911 . . . . 0.0 110.015 174.939 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.454 -0.267 0 C-N-CA 124.282 1.033 . . . . 0.0 111.441 178.972 . . . . . . . . 0 0 . 1 . 001 nuclear nobuild core ' A' A ' 20' ' ' PRO . . . . . . . . . . . . . 72.2 Cg_endo . . . . . 0 N--CA 1.455 -0.793 0 N-CA-C 112.781 0.262 . . . . 0.0 112.781 . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild core ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 92.9 m-20 -97.69 -15.15 20.51 Favored 'General case' 0 N--CA 1.454 -0.242 0 C-N-CA 124.464 1.106 . . . . 0.0 113.325 -166.772 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 7.1 tp60 -138.67 127.23 23.27 Favored 'General case' 0 CA--C 1.537 0.443 0 C-N-CA 123.725 0.81 . . . . 0.0 109.992 -168.307 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 74.8 mt -95.07 129.32 42.21 Favored 'General case' 0 CA--C 1.531 0.241 0 C-N-CA 124.301 1.041 . . . . 0.0 110.782 178.666 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 1.5 p -79.16 176.02 10.06 Favored 'General case' 0 C--O 1.238 0.472 0 N-CA-C 108.301 -1.0 . . . . 0.0 108.301 167.103 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 58.1 mttp -54.24 -38.77 66.14 Favored 'General case' 0 N--CA 1.451 -0.39 0 CA-C-O 119.352 -0.356 . . . . 0.0 110.902 175.162 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 31.3 mm-40 -71.42 -47.4 56.21 Favored 'General case' 0 CA--C 1.518 -0.26 0 CA-C-N 118.436 0.562 . . . . 0.0 110.557 -171.243 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 2.2 mp0 -53.97 -48.96 69.81 Favored 'General case' 0 N--CA 1.451 -0.418 0 CA-C-N 115.87 -0.605 . . . . 0.0 109.549 172.368 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 13.1 mt -56.97 -43.52 81.71 Favored 'General case' 0 C--O 1.218 -0.554 0 C-N-CA 120.023 -0.671 . . . . 0.0 112.304 174.59 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 37.6 ttpt -61.67 -47.86 83.44 Favored 'General case' 0 C--N 1.32 -0.702 0 CA-C-N 118.5 0.591 . . . . 0.0 110.121 -176.641 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 11.8 tp -65.56 -43.8 88.76 Favored 'General case' 0 CA--C 1.533 0.326 0 CA-C-O 120.609 0.242 . . . . 0.0 110.877 179.823 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 7.1 tt -50.73 -58.71 5.25 Favored 'General case' 0 CA--C 1.522 -0.119 0 C-N-CA 124.146 0.979 . . . . 0.0 109.549 173.521 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 31.0 mt -58.93 -52.73 64.52 Favored 'General case' 0 C--O 1.219 -0.501 0 N-CA-C 108.782 -0.821 . . . . 0.0 108.782 -177.882 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 22.9 tt0 -49.5 -45.62 47.28 Favored 'General case' 0 C--N 1.332 -0.194 0 O-C-N 121.37 -0.831 . . . . 0.0 111.775 179.25 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 7.9 m -74.09 -54.74 7.18 Favored 'General case' 0 CA--C 1.533 0.325 0 CA-C-O 120.61 0.243 . . . . 0.0 111.612 -177.81 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 29.5 mm-40 -91.98 -33.4 14.86 Favored 'General case' 0 N--CA 1.452 -0.339 0 C-N-CA 124.008 0.923 . . . . 0.0 113.138 -166.36 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 79.6 m-85 . . . . . 0 CA--C 1.536 0.439 0 C-N-CA 124.98 1.312 . . . . 0.0 111.525 -171.912 . . . . . . . . 0 0 . 1 . 001 nuclear nobuild core ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 48.3 tp . . . . . 0 CA--C 1.519 -0.242 0 N-CA-C 112.842 0.682 . . . . 0.0 112.842 . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild core ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 7.4 m-20 -64.07 -43.38 95.64 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-N 115.843 -0.617 . . . . 0.0 111.1 -174.898 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 29.7 mm-40 -71.14 -42.24 69.42 Favored 'General case' 0 N--CA 1.45 -0.45 0 N-CA-C 109.263 -0.643 . . . . 0.0 109.263 177.219 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 56.5 tp -53.96 -47.64 71.13 Favored 'General case' 0 N--CA 1.452 -0.367 0 N-CA-C 109.539 -0.541 . . . . 0.0 109.539 177.448 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 50' ' ' PHE . . . . . . . . . . . . . 82.9 t80 -51.69 -53.73 35.93 Favored 'General case' 0 N--CA 1.454 -0.266 0 C-N-CA 123.657 0.783 . . . . 0.0 110.614 177.987 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 72.2 mm-40 -56.06 -49.12 74.64 Favored 'General case' 0 CA--C 1.532 0.283 0 CA-C-O 120.605 0.24 . . . . 0.0 110.968 177.429 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 50.2 mm-40 -57.73 -40.99 80.92 Favored 'General case' 0 CA--C 1.531 0.219 0 C-N-CA 122.779 0.432 . . . . 0.0 112.138 179.801 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 62.2 mt -71.44 -41.15 69.83 Favored 'General case' 0 N--CA 1.45 -0.464 0 C-N-CA 122.857 0.463 . . . . 0.0 111.011 179.16 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 19.6 t70 . . . . . 0 CA--C 1.541 0.621 0 C-N-CA 125.966 1.707 . . . . 0.0 112.136 -178.386 . . . . . . . . 0 0 . 1 . 001 nuclear nobuild core ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 56.5 mt-10 . . . . . 0 N--CA 1.452 -0.345 0 N-CA-C 109.42 -0.585 . . . . 0.0 109.42 . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild core ' A' A ' 61' ' ' VAL . . . . . . . . . . . . . 3.7 t -103.91 120.94 54.81 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.422 0 C-N-CA 123.332 0.653 . . . . 0.0 111.354 -167.183 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 95.1 p -77.45 163.7 26.11 Favored 'General case' 0 N--CA 1.463 0.195 0 C-N-CA 123.196 0.598 . . . . 0.0 110.492 174.931 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 63' ' ' PHE . . . . . . . . . . . . . 68.9 t80 -59.38 -32.99 70.65 Favored 'General case' 0 CA--C 1.528 0.133 0 O-C-N 122.032 -0.418 . . . . 0.0 111.879 176.091 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 39.2 mm-40 -66.97 -59.1 3.78 Favored 'General case' 0 N--CA 1.446 -0.639 0 N-CA-C 109.363 -0.606 . . . . 0.0 109.363 -179.437 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 8.3 pt-20 -66.91 -29.58 69.49 Favored 'General case' 0 CA--C 1.54 0.578 0 O-C-N 121.5 -0.75 . . . . 0.0 111.313 -177.656 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 13.3 t80 -50.63 -28.53 9.01 Favored 'General case' 0 CA--C 1.536 0.417 0 C-N-CA 123.825 0.85 . . . . 0.0 111.891 168.779 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 67' ' ' GLN . . . . . . . . . . . . . 80.5 mm-40 -55.32 -23.32 23.08 Favored 'General case' 0 CA--C 1.535 0.401 0 CA-C-N 119.696 1.135 . . . . 0.0 112.962 174.668 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 88.4 t -55.25 -32.38 28.42 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.526 0 CA-C-N 119.472 1.033 . . . . 0.0 110.765 171.701 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 37.2 tp -71.33 -47.72 54.81 Favored 'General case' 0 N--CA 1.454 -0.257 0 N-CA-C 107.159 -1.423 . . . . 0.0 107.159 179.47 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 70' ' ' VAL . . . . . . . . . . . . . 18.5 t . . . . . 0 CA--C 1.534 0.348 0 C-N-CA 122.88 0.472 . . . . 0.0 110.142 -179.983 . . . . . . . . 0 0 . 1 . 002 nuclear nobuild core ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 86.9 Cg_exo . . . . . 0 N--CA 1.457 -0.664 0 CA-C-O 120.429 0.095 . . . . 0.0 112.338 . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild core ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 40.3 tt0 -61.11 -49.37 77.56 Favored 'General case' 0 CA--C 1.529 0.17 0 C-N-CA 123.389 0.676 . . . . 0.0 111.103 177.534 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 29.7 mt-10 -60.75 -45.63 93.54 Favored 'General case' 0 N--CA 1.454 -0.272 0 N-CA-C 109.009 -0.738 . . . . 0.0 109.009 177.943 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 19.9 mt -58.41 -40.19 81.8 Favored 'General case' 0 N--CA 1.447 -0.611 0 C-N-CA 123.755 0.822 . . . . 0.0 111.192 179.142 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 21.4 tptm -60.12 -53.05 62.36 Favored 'General case' 0 C--N 1.333 -0.131 0 CA-C-N 118.798 0.726 . . . . 0.0 110.898 171.054 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . -50.5 -52.2 29.55 Favored Glycine 0 CA--C 1.533 1.192 0 N-CA-C 111.269 -0.732 . . . . 0.0 111.269 179.15 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 9' ' ' ILE . . . . . . . . . . . . . 2.4 mm -56.04 -55.04 20.43 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.305 0 C-N-CA 126.475 1.91 . . . . 0.0 108.944 175.818 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 10' ' ' PHE . . . . . . . . . . . . . 38.6 t80 -49.1 -49.89 39.63 Favored 'General case' 0 N--CA 1.448 -0.534 0 O-C-N 121.725 -0.609 . . . . 0.0 109.846 179.797 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 51.0 mt-10 -62.05 -50.99 69.77 Favored 'General case' 0 N--CA 1.455 -0.197 0 C-N-CA 123.081 0.553 . . . . 0.0 110.567 179.417 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 68.9 tttt -44.52 -51.62 8.7 Favored 'General case' 0 CA--C 1.53 0.21 0 C-N-CA 124.341 1.057 . . . . 0.0 110.9 177.167 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 63.1 m-85 -78.4 -46.31 20.21 Favored 'General case' 0 CA--C 1.53 0.206 0 O-C-N 122.341 -0.224 . . . . 0.0 111.296 -176.403 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -57.23 -42.35 81.26 Favored 'General case' 0 C--N 1.329 -0.318 0 O-C-N 121.384 -0.823 . . . . 0.0 111.659 -178.427 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.533 0.308 0 C-N-CA 123.603 0.761 . . . . 0.0 111.921 173.772 . . . . . . . . 0 0 . 1 . 002 nuclear nobuild core ' A' A ' 20' ' ' PRO . . . . . . . . . . . . . 36.4 Cg_endo . . . . . 0 N--CA 1.457 -0.62 0 N-CA-C 112.63 0.204 . . . . 0.0 112.63 . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild core ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 48.5 m-80 -85.06 -1.16 56.52 Favored 'General case' 0 N--CA 1.453 -0.288 0 C-N-CA 124.481 1.112 . . . . 0.0 113.137 -173.17 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 23.6 tt0 -151.27 124.99 9.05 Favored 'General case' 0 CA--C 1.542 0.637 0 CA-C-N 119.749 1.159 . . . . 0.0 113.887 -169.271 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 82.7 mt -98.82 138.11 36.44 Favored 'General case' 0 C--N 1.345 0.386 0 C-N-CA 125.296 1.438 . . . . 0.0 111.632 178.376 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 88.9 p -80.69 174.17 11.88 Favored 'General case' 0 CA--C 1.532 0.283 0 C-N-CA 123.466 0.706 . . . . 0.0 109.734 168.3 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 7.6 mtpm? -56.92 -44.28 82.26 Favored 'General case' 0 C--O 1.226 -0.173 0 N-CA-C 109.721 -0.474 . . . . 0.0 109.721 171.352 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 1.8 mp0 -63.09 -51.95 64.61 Favored 'General case' 0 N--CA 1.451 -0.424 0 C-N-CA 123.285 0.634 . . . . 0.0 110.259 -176.861 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -57.67 -41.77 82.23 Favored 'General case' 0 N--CA 1.451 -0.401 0 CA-C-O 118.564 -0.731 . . . . 0.0 110.422 176.687 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 14.3 mt -57.79 -43.66 85.74 Favored 'General case' 0 CA--C 1.513 -0.446 0 CA-C-N 119.614 1.097 . . . . 0.0 113.126 169.744 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 21.0 ttmm -61.11 -49.36 77.61 Favored 'General case' 0 N--CA 1.449 -0.497 0 CA-C-N 118.773 0.715 . . . . 0.0 109.857 -178.163 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 95.9 mt -62.02 -45.49 93.35 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.39 -0.368 . . . . 0.0 111.169 179.156 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 7.6 tt -50.84 -57.85 7.42 Favored 'General case' 0 C--O 1.232 0.132 0 C-N-CA 124.098 0.959 . . . . 0.0 109.405 173.668 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 40.7 mt -55.56 -58.01 9.53 Favored 'General case' 0 N--CA 1.455 -0.179 0 N-CA-C 109.637 -0.505 . . . . 0.0 109.637 -178.794 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 22.8 tt0 -53.07 -50.45 64.35 Favored 'General case' 0 N--CA 1.452 -0.349 0 C-N-CA 124.202 1.001 . . . . 0.0 111.674 -176.012 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 15.0 m -74.48 -49.97 20.11 Favored 'General case' 0 N--CA 1.453 -0.303 0 CA-C-N 116.34 -0.391 . . . . 0.0 110.898 -173.017 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 73.2 mm-40 -94.58 -32.5 13.41 Favored 'General case' 0 N--CA 1.448 -0.554 0 N-CA-C 112.685 0.624 . . . . 0.0 112.685 -167.06 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 81.6 m-85 . . . . . 0 CA--C 1.538 0.494 0 C-N-CA 123.49 0.716 . . . . 0.0 112.443 -173.919 . . . . . . . . 0 0 . 1 . 002 nuclear nobuild core ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 57.3 tp . . . . . 0 C--O 1.223 -0.305 0 N-CA-C 109.936 -0.394 . . . . 0.0 109.936 . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild core ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 5.6 m-20 -58.96 -52.62 64.98 Favored 'General case' 0 N--CA 1.449 -0.524 0 C-N-CA 123.734 0.814 . . . . 0.0 111.027 179.781 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 33.8 mt-10 -59.37 -45.59 91.0 Favored 'General case' 0 N--CA 1.455 -0.18 0 CA-C-N 116.618 -0.265 . . . . 0.0 111.125 177.88 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 59.7 mt -54.9 -54.72 38.98 Favored 'General case' 0 C--O 1.224 -0.238 0 N-CA-C 109.636 -0.505 . . . . 0.0 109.636 174.802 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 50' ' ' PHE . . . . . . . . . . . . . 80.4 t80 -52.43 -49.92 63.6 Favored 'General case' 0 N--CA 1.449 -0.475 0 C-N-CA 123.965 0.906 . . . . 0.0 110.36 -177.527 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 27.7 tp10 -58.72 -48.34 81.5 Favored 'General case' 0 N--CA 1.454 -0.268 0 CA-C-O 120.755 0.312 . . . . 0.0 110.83 177.143 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 42.8 tt0 -56.68 -39.71 74.28 Favored 'General case' 0 CA--C 1.53 0.174 0 C-N-CA 123.631 0.772 . . . . 0.0 111.156 179.598 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 38.1 mt -78.71 -43.99 24.56 Favored 'General case' 0 N--CA 1.448 -0.56 0 C-N-CA 122.952 0.501 . . . . 0.0 112.114 -178.636 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 53.1 t0 . . . . . 0 CA--C 1.538 0.493 0 C-N-CA 125.101 1.361 . . . . 0.0 111.361 -177.356 . . . . . . . . 0 0 . 1 . 002 nuclear nobuild core ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 31.5 mt-10 . . . . . 0 N--CA 1.452 -0.331 0 N-CA-C 104.944 -2.243 . . . . 0.0 104.944 . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild core ' A' A ' 61' ' ' VAL . . . . . . . . . . . . . 5.1 t -117.02 115.2 48.14 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.193 0 N-CA-C 109.685 -0.487 . . . . 0.0 109.685 -178.599 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 12.6 t -84.89 164.31 18.46 Favored 'General case' 0 CA--C 1.537 0.465 0 C-N-CA 122.65 0.38 . . . . 0.0 111.572 173.537 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 63' ' ' PHE . . . . . . . . . . . . . 64.4 t80 -62.01 -39.63 92.89 Favored 'General case' 0 N--CA 1.464 0.238 0 N-CA-C 112.65 0.611 . . . . 0.0 112.65 -170.044 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 50.9 mt-10 -62.33 -57.09 12.61 Favored 'General case' 0 N--CA 1.453 -0.292 0 N-CA-C 109.639 -0.504 . . . . 0.0 109.639 -178.471 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 20.3 pt-20 -64.28 -34.33 77.88 Favored 'General case' 0 CA--C 1.539 0.547 0 O-C-N 121.639 -0.663 . . . . 0.0 111.425 -179.692 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 17.8 t80 -52.03 -25.4 8.43 Favored 'General case' 0 CA--C 1.538 0.493 0 C-N-CA 123.828 0.851 . . . . 0.0 112.237 169.357 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 67' ' ' GLN . . . . . . . . . . . . . 45.6 mm-40 -54.64 -23.78 18.7 Favored 'General case' 0 CA--C 1.537 0.459 0 CA-C-N 119.745 1.157 . . . . 0.0 113.197 172.473 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 83.0 t -53.96 -33.16 23.55 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.485 0 CA-C-N 119.162 0.892 . . . . 0.0 110.817 170.469 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 19.3 tp -75.47 -53.11 9.2 Favored 'General case' 0 N--CA 1.452 -0.345 0 N-CA-C 108.134 -1.061 . . . . 0.0 108.134 173.163 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 70' ' ' VAL . . . . . . . . . . . . . 58.1 t . . . . . 0 CA--C 1.534 0.352 0 CA-C-N 118.324 0.511 . . . . 0.0 111.74 -175.295 . . . . . . . . 0 0 . 1 . 003 nuclear nobuild core ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 85.8 Cg_exo . . . . . 0 N--CA 1.455 -0.78 0 CA-C-O 120.347 0.061 . . . . 0.0 112.015 . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild core ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 2.8 mp0 -61.3 -47.07 87.64 Favored 'General case' 0 N--CA 1.455 -0.175 0 C-N-CA 123.841 0.857 . . . . 0.0 111.942 176.607 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -62.88 -44.23 96.67 Favored 'General case' 0 C--N 1.331 -0.215 0 N-CA-C 108.974 -0.75 . . . . 0.0 108.974 178.108 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 6' ' ' LEU . . . . . 0.475 HD13 HG22 ' A' ' 70' ' ' VAL . 12.8 mt -59.43 -40.58 87.2 Favored 'General case' 0 N--CA 1.449 -0.501 0 C-N-CA 122.646 0.379 . . . . 0.0 111.844 177.047 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 51.7 tptt -58.62 -47.11 85.46 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 118.414 0.552 . . . . 0.0 110.307 170.167 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . -52.89 -54.65 27.47 Favored Glycine 0 CA--C 1.53 0.989 0 N-CA-C 110.744 -0.943 . . . . 0.0 110.744 179.648 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 9' ' ' ILE . . . . . . . . . . . . . 65.9 mt -51.12 -58.14 2.25 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.13 0 C-N-CA 125.407 1.483 . . . . 0.0 109.523 171.639 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 10' ' ' PHE . . . . . . . . . . . . . 23.7 t80 -49.91 -48.11 51.84 Favored 'General case' 0 N--CA 1.442 -0.826 0 O-C-N 122.006 -0.434 . . . . 0.0 110.07 -175.883 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 55.3 mt-10 -64.88 -50.24 67.34 Favored 'General case' 0 N--CA 1.452 -0.33 0 C-N-CA 123.483 0.713 . . . . 0.0 110.636 179.118 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 21.8 ttpt -43.55 -50.37 7.22 Favored 'General case' 0 N--CA 1.461 0.114 0 C-N-CA 124.161 0.984 . . . . 0.0 110.384 175.422 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 59.6 m-85 -78.73 -44.97 22.24 Favored 'General case' 0 N--CA 1.449 -0.475 0 CA-C-N 116.47 -0.332 . . . . 0.0 111.862 -175.137 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -67.52 -35.04 78.34 Favored 'General case' 0 N--CA 1.466 0.342 0 C-N-CA 125.139 1.376 . . . . 0.0 113.24 -176.545 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.452 -0.373 0 C-N-CA 123.039 0.536 . . . . 0.0 111.455 -178.956 . . . . . . . . 0 0 . 1 . 003 nuclear nobuild core ' A' A ' 20' ' ' PRO . . . . . . . . . . . . . 26.4 Cg_endo . . . . . 0 N--CA 1.456 -0.723 0 N-CA-C 112.66 0.215 . . . . 0.0 112.66 . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild core ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 38.8 m-80 -87.56 -7.18 57.87 Favored 'General case' 0 N--CA 1.453 -0.316 0 C-N-CA 124.831 1.253 . . . . 0.0 112.962 -175.521 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 9.9 tt0 -144.89 125.1 13.71 Favored 'General case' 0 CA--C 1.539 0.523 0 CA-C-N 119.294 0.952 . . . . 0.0 113.256 -171.942 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 52.1 mt -96.07 142.98 27.62 Favored 'General case' 0 C--N 1.343 0.284 0 C-N-CA 124.8 1.24 . . . . 0.0 111.423 179.349 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 93.2 p -92.35 174.61 7.2 Favored 'General case' 0 CA--C 1.538 0.512 0 C-N-CA 124.091 0.956 . . . . 0.0 108.974 167.029 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 97.6 mttt -54.6 -49.4 70.51 Favored 'General case' 0 C--N 1.339 0.135 0 O-C-N 121.895 -0.503 . . . . 0.0 111.49 -179.173 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 24.2 mt-10 -63.73 -43.51 96.31 Favored 'General case' 0 CA--C 1.519 -0.215 0 CA-C-O 121.234 0.54 . . . . 0.0 110.414 -175.105 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 57.6 mt-10 -58.22 -47.55 83.14 Favored 'General case' 0 N--CA 1.45 -0.426 0 CA-C-N 115.929 -0.578 . . . . 0.0 109.709 176.149 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 11.4 mt -56.8 -41.3 77.51 Favored 'General case' 0 CA--C 1.511 -0.545 0 N-CA-C 112.932 0.716 . . . . 0.0 112.932 171.683 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 84.8 tttt -61.5 -49.74 75.53 Favored 'General case' 0 C--N 1.324 -0.515 0 CA-C-N 118.747 0.703 . . . . 0.0 109.604 -178.37 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 10.4 mp -60.15 -46.89 88.13 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.394 -0.366 . . . . 0.0 111.101 177.847 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 7.5 tt -51.9 -57.27 9.89 Favored 'General case' 0 C--N 1.333 -0.12 0 C-N-CA 123.652 0.781 . . . . 0.0 109.682 175.366 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 43.2 mt -55.44 -53.61 54.15 Favored 'General case' 0 N--CA 1.454 -0.252 0 C-N-CA 123.994 0.918 . . . . 0.0 109.246 -178.522 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 22.7 tt0 -55.21 -46.48 75.91 Favored 'General case' 0 N--CA 1.451 -0.386 0 C-N-CA 123.665 0.786 . . . . 0.0 111.629 -177.508 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 5.3 m -73.96 -53.11 10.8 Favored 'General case' 0 CA--C 1.532 0.258 0 C-N-CA 120.916 -0.314 . . . . 0.0 111.03 -176.307 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 79.4 mm-40 -91.82 -39.05 11.98 Favored 'General case' 0 N--CA 1.45 -0.442 0 C-N-CA 123.762 0.825 . . . . 0.0 112.751 -166.953 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 17.7 m-85 . . . . . 0 CA--C 1.539 0.541 0 N-CA-C 113.22 0.822 . . . . 0.0 113.22 -169.132 . . . . . . . . 0 0 . 1 . 003 nuclear nobuild core ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 52.6 tp . . . . . 0 N--CA 1.457 -0.115 0 N-CA-C 109.375 -0.602 . . . . 0.0 109.375 . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild core ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 5.0 m-20 -55.78 -52.56 63.54 Favored 'General case' 0 N--CA 1.449 -0.495 0 C-N-CA 124.575 1.15 . . . . 0.0 110.602 177.805 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 4.0 tm-20 -53.49 -52.27 60.1 Favored 'General case' 0 C--N 1.331 -0.218 0 C-N-CA 122.512 0.325 . . . . 0.0 110.784 176.22 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 95.6 mt -55.18 -49.53 71.63 Favored 'General case' 0 CA--C 1.529 0.169 0 CA-C-O 121.282 0.563 . . . . 0.0 110.305 178.671 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 50' ' ' PHE . . . . . . . . . . . . . 62.4 t80 -55.49 -50.67 69.3 Favored 'General case' 0 N--CA 1.45 -0.426 0 C-N-CA 123.827 0.851 . . . . 0.0 110.828 -179.115 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 36.0 mt-10 -59.3 -45.93 89.94 Favored 'General case' 0 N--CA 1.454 -0.234 0 C-N-CA 123.289 0.636 . . . . 0.0 110.547 177.994 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 12.5 tm-20 -56.25 -46.16 79.73 Favored 'General case' 0 N--CA 1.456 -0.172 0 C-N-CA 123.358 0.663 . . . . 0.0 110.072 178.708 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 91.6 mt -72.6 -43.34 63.44 Favored 'General case' 0 N--CA 1.45 -0.435 0 C-N-CA 123.021 0.528 . . . . 0.0 112.04 -176.58 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 47.4 t0 . . . . . 0 CA--C 1.537 0.459 0 C-N-CA 124.206 1.002 . . . . 0.0 112.206 -172.616 . . . . . . . . 0 0 . 1 . 003 nuclear nobuild core ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 30.3 mt-10 . . . . . 0 CA--C 1.528 0.129 0 N-CA-C 105.924 -1.88 . . . . 0.0 105.924 . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild core ' A' A ' 61' ' ' VAL . . . . . . . . . . . . . 3.5 t -123.57 115.36 45.07 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.183 0 N-CA-C 109.373 -0.603 . . . . 0.0 109.373 179.582 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 62.4 p -77.95 156.96 29.92 Favored 'General case' 0 CA--C 1.532 0.267 0 C-N-CA 123.515 0.726 . . . . 0.0 110.395 177.794 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 63' ' ' PHE . . . . . . . . . . . . . 71.4 t80 -55.11 -34.97 64.15 Favored 'General case' 0 N--CA 1.463 0.207 0 N-CA-C 112.318 0.488 . . . . 0.0 112.318 178.042 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 45.8 mt-10 -58.1 -67.56 0.33 Allowed 'General case' 0 N--CA 1.452 -0.339 0 N-CA-C 109.903 -0.406 . . . . 0.0 109.903 176.78 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 9.8 pt-20 -65.24 -28.55 69.44 Favored 'General case' 0 CA--C 1.534 0.348 0 O-C-N 121.842 -0.536 . . . . 0.0 111.669 -175.015 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 8.2 t80 -49.15 -29.88 5.98 Favored 'General case' 0 CA--C 1.532 0.276 0 C-N-CA 123.391 0.677 . . . . 0.0 112.283 169.102 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 67' ' ' GLN . . . . . . . . . . . . . 97.8 mm-40 -56.86 -19.93 20.25 Favored 'General case' 0 CA--C 1.54 0.571 0 CA-C-N 119.661 1.119 . . . . 0.0 112.933 175.993 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 69.8 t -56.97 -34.29 44.23 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.552 0 CA-C-N 119.61 1.095 . . . . 0.0 110.878 169.472 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 9.4 tt -70.9 -44.36 66.42 Favored 'General case' 0 N--CA 1.456 -0.147 0 N-CA-C 107.179 -1.415 . . . . 0.0 107.179 -179.675 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 70' ' ' VAL . . . . . 0.475 HG22 HD13 ' A' ' 6' ' ' LEU . 22.2 t . . . . . 0 N--CA 1.452 -0.371 0 N-CA-C 109.913 -0.403 . . . . 0.0 109.913 176.879 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 99.2 Cg_exo . . . . . 0 N--CA 1.458 -0.58 0 CA-C-O 120.602 0.167 . . . . 0.0 112.463 . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild core ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 2.9 mp0 -58.59 -50.33 74.2 Favored 'General case' 0 N--CA 1.454 -0.246 0 C-N-CA 123.762 0.825 . . . . 0.0 111.971 176.473 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 31.9 mt-10 -60.35 -45.57 93.02 Favored 'General case' 0 C--N 1.332 -0.183 0 N-CA-C 109.101 -0.703 . . . . 0.0 109.101 178.254 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 20.2 mt -59.45 -38.03 79.67 Favored 'General case' 0 N--CA 1.446 -0.651 0 C-N-CA 122.841 0.457 . . . . 0.0 111.998 178.116 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 78.3 tttt -64.55 -44.48 90.62 Favored 'General case' 0 N--CA 1.449 -0.504 0 CA-C-N 118.292 0.496 . . . . 0.0 110.664 172.769 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . -54.55 -51.71 50.18 Favored Glycine 0 CA--C 1.529 0.966 0 N-CA-C 109.893 -1.283 . . . . 0.0 109.893 177.709 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 9' ' ' ILE . . . . . . . . . . . . . 63.1 mt -53.84 -56.79 7.46 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.23 0 C-N-CA 125.935 1.694 . . . . 0.0 110.055 173.245 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 10' ' ' PHE . . . . . . . . . . . . . 51.9 t80 -45.97 -53.43 10.01 Favored 'General case' 0 N--CA 1.451 -0.414 0 C-N-CA 123.169 0.588 . . . . 0.0 109.843 179.019 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 44.3 mt-10 -62.8 -51.92 65.21 Favored 'General case' 0 CA--C 1.532 0.265 0 C-N-CA 122.756 0.423 . . . . 0.0 110.731 -178.591 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 26.4 ttpt -45.8 -53.72 9.16 Favored 'General case' 0 C--N 1.338 0.102 0 C-N-CA 125.15 1.38 . . . . 0.0 111.077 178.186 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 57.0 m-85 -77.28 -44.36 30.03 Favored 'General case' 0 N--CA 1.45 -0.44 0 N-CA-C 110.107 -0.331 . . . . 0.0 110.107 -175.456 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -52.99 -45.92 68.07 Favored 'General case' 0 C--O 1.225 -0.204 0 C-N-CA 123.652 0.781 . . . . 0.0 111.897 178.956 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.331 -0.21 0 N-CA-C 113.007 0.743 . . . . 0.0 113.007 178.075 . . . . . . . . 0 0 . 1 . 004 nuclear nobuild core ' A' A ' 20' ' ' PRO . . . . . . . . . . . . . 19.2 Cg_endo . . . . . 0 CA--C 1.535 0.567 0 N-CA-C 113.988 0.726 . . . . 0.0 113.988 . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild core ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 44.8 m-80 -85.0 -7.59 59.08 Favored 'General case' 0 N--CA 1.453 -0.289 0 C-N-CA 123.779 0.832 . . . . 0.0 112.877 -178.523 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 11.4 tt0 -156.87 117.63 3.64 Favored 'General case' 0 CA--C 1.538 0.482 0 CA-C-N 119.648 1.113 . . . . 0.0 112.903 -169.017 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 19.2 mt -79.66 136.31 36.77 Favored 'General case' 0 C--O 1.234 0.278 0 C-N-CA 124.566 1.146 . . . . 0.0 110.918 179.43 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 12.4 p -97.42 -179.62 4.55 Favored 'General case' 0 CA--C 1.54 0.583 0 N-CA-C 107.322 -1.362 . . . . 0.0 107.322 164.796 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 62.4 mttp -55.14 -47.11 75.55 Favored 'General case' 0 C--O 1.226 -0.135 0 O-C-N 121.941 -0.475 . . . . 0.0 112.157 -173.097 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 34.4 tt0 -64.09 -46.3 84.88 Favored 'General case' 0 N--CA 1.456 -0.173 0 CA-C-N 118.16 0.436 . . . . 0.0 110.62 -174.54 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 2.6 mp0 -54.7 -49.93 69.52 Favored 'General case' 0 N--CA 1.451 -0.414 0 N-CA-C 109.578 -0.527 . . . . 0.0 109.578 175.214 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 9.6 mt -55.88 -43.74 77.48 Favored 'General case' 0 CA--C 1.51 -0.573 0 N-CA-C 113.266 0.839 . . . . 0.0 113.266 173.473 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 84.8 tttt -62.45 -48.54 79.21 Favored 'General case' 0 C--N 1.323 -0.567 0 CA-C-N 118.512 0.596 . . . . 0.0 109.769 -175.858 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 81.5 mt -62.44 -47.51 83.75 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.875 178.905 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 6.7 tt -49.5 -58.22 5.59 Favored 'General case' 0 CA--C 1.522 -0.12 0 C-N-CA 123.979 0.912 . . . . 0.0 109.264 174.023 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 39.9 mt -56.68 -57.99 10.01 Favored 'General case' 0 N--CA 1.451 -0.4 0 C-N-CA 123.533 0.733 . . . . 0.0 109.281 -177.404 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 7.0 tp-100 -52.2 -49.7 63.38 Favored 'General case' 0 N--CA 1.455 -0.206 0 C-N-CA 123.04 0.536 . . . . 0.0 111.161 -176.343 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 11.4 m -75.74 -49.38 18.37 Favored 'General case' 0 N--CA 1.454 -0.258 0 CA-C-N 116.223 -0.444 . . . . 0.0 111.069 -171.574 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 70.4 mm-40 -89.67 -29.25 18.92 Favored 'General case' 0 N--CA 1.45 -0.458 0 C-N-CA 123.362 0.665 . . . . 0.0 111.771 -169.465 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 94.1 m-85 . . . . . 0 CA--C 1.537 0.443 0 C-N-CA 124.425 1.09 . . . . 0.0 111.63 -174.66 . . . . . . . . 0 0 . 1 . 004 nuclear nobuild core ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 66.6 tp . . . . . 0 C--O 1.224 -0.246 0 N-CA-C 111.714 0.265 . . . . 0.0 111.714 . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild core ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 5.3 m-20 -60.6 -46.11 91.46 Favored 'General case' 0 N--CA 1.451 -0.4 0 C-N-CA 123.339 0.656 . . . . 0.0 111.542 179.803 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 93.0 mt-10 -59.64 -52.12 66.91 Favored 'General case' 0 N--CA 1.455 -0.181 0 N-CA-C 109.557 -0.535 . . . . 0.0 109.557 177.383 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 46.9 tp -58.47 -46.39 86.71 Favored 'General case' 0 N--CA 1.452 -0.364 0 N-CA-C 109.416 -0.587 . . . . 0.0 109.416 -178.147 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 50' ' ' PHE . . . . . . . . . . . . . 71.2 t80 -54.6 -50.11 68.83 Favored 'General case' 0 N--CA 1.449 -0.497 0 C-N-CA 123.934 0.894 . . . . 0.0 110.249 177.281 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 41.2 tt0 -57.35 -49.84 74.88 Favored 'General case' 0 N--CA 1.453 -0.279 0 C-N-CA 122.275 0.23 . . . . 0.0 110.761 177.411 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 39.9 mt-10 -55.18 -44.57 75.36 Favored 'General case' 0 CA--C 1.53 0.196 0 C-N-CA 123.141 0.576 . . . . 0.0 111.458 178.931 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 84.7 mt -71.3 -42.66 68.38 Favored 'General case' 0 N--CA 1.451 -0.388 0 C-N-CA 122.955 0.502 . . . . 0.0 111.582 -178.879 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 21.4 t0 . . . . . 0 CA--C 1.534 0.331 0 C-N-CA 124.289 1.036 . . . . 0.0 110.363 177.553 . . . . . . . . 0 0 . 1 . 004 nuclear nobuild core ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 46.9 mt-10 . . . . . 0 CA--C 1.532 0.254 0 N-CA-C 107.466 -1.309 . . . . 0.0 107.466 . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild core ' A' A ' 61' ' ' VAL . . . . . . . . . . . . . 4.4 t -127.78 111.75 25.6 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.408 0 C-N-CA 123.006 0.522 . . . . 0.0 111.213 -169.679 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 8.6 t -83.3 177.4 8.53 Favored 'General case' 0 CA--C 1.537 0.467 0 CA-C-O 121.249 0.547 . . . . 0.0 111.991 172.572 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 63' ' ' PHE . . . . . . . . . . . . . 40.2 t80 -64.97 -47.59 77.06 Favored 'General case' 0 N--CA 1.461 0.086 0 C-N-CA 123.615 0.766 . . . . 0.0 112.723 -168.693 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 23.1 mp0 -59.87 -56.24 24.19 Favored 'General case' 0 N--CA 1.452 -0.342 0 N-CA-C 108.862 -0.792 . . . . 0.0 108.862 -175.984 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 18.0 pt-20 -62.84 -35.1 78.85 Favored 'General case' 0 CA--C 1.537 0.45 0 N-CA-C 112.102 0.408 . . . . 0.0 112.102 179.429 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 7.4 t80 -50.06 -31.73 13.81 Favored 'General case' 0 CA--C 1.535 0.397 0 O-C-N 121.172 -0.955 . . . . 0.0 112.403 169.542 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 67' ' ' GLN . . . . . . . . . . . . . 14.7 mm-40 -55.66 -20.43 14.07 Favored 'General case' 0 CA--C 1.54 0.593 0 CA-C-N 119.388 0.995 . . . . 0.0 113.372 174.265 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 76.8 t -53.63 -28.8 16.58 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.56 0 CA-C-N 119.654 1.116 . . . . 0.0 110.929 169.942 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 31.1 tp -70.69 -39.13 73.66 Favored 'General case' 0 CA--C 1.532 0.27 0 O-C-N 121.094 -1.004 . . . . 0.0 108.293 176.706 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 70' ' ' VAL . . . . . . . . . . . . . 11.5 t . . . . . 0 N--CA 1.454 -0.256 0 O-C-N 121.786 -0.571 . . . . 0.0 109.699 176.911 . . . . . . . . 0 0 . 1 . 005 nuclear nobuild core ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 98.0 Cg_exo . . . . . 0 N--CA 1.459 -0.501 0 CA-C-O 120.821 0.259 . . . . 0.0 112.619 . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild core ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 45.0 mt-10 -61.79 -45.51 93.58 Favored 'General case' 0 N--CA 1.454 -0.256 0 C-N-CA 123.046 0.539 . . . . 0.0 111.249 178.152 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 31.7 mt-10 -65.28 -44.3 88.43 Favored 'General case' 0 N--CA 1.45 -0.436 0 N-CA-C 109.108 -0.701 . . . . 0.0 109.108 178.378 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 14.6 mt -55.02 -42.87 73.12 Favored 'General case' 0 N--CA 1.453 -0.323 0 C-N-CA 123.684 0.794 . . . . 0.0 111.075 175.843 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 23.3 tptm -61.53 -52.14 65.7 Favored 'General case' 0 C--O 1.226 -0.136 0 CA-C-N 118.483 0.583 . . . . 0.0 111.113 172.954 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . -51.06 -49.3 43.49 Favored Glycine 0 CA--C 1.533 1.18 0 N-CA-C 111.081 -0.808 . . . . 0.0 111.081 179.297 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 9' ' ' ILE . . . . . . . . . . . . . 3.0 mm -58.81 -55.48 22.9 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.257 0 C-N-CA 126.885 2.074 . . . . 0.0 109.037 176.46 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 10' ' ' PHE . . . . . . . . . . . . . 58.7 t80 -46.15 -52.24 12.61 Favored 'General case' 0 N--CA 1.451 -0.398 0 C-N-CA 123.242 0.617 . . . . 0.0 109.938 177.785 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 52.6 mt-10 -62.06 -51.56 67.49 Favored 'General case' 0 CA--C 1.532 0.287 0 C-N-CA 123.213 0.605 . . . . 0.0 110.738 -179.986 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 67.2 tttt -44.65 -51.91 8.7 Favored 'General case' 0 N--CA 1.462 0.15 0 C-N-CA 124.877 1.271 . . . . 0.0 111.128 177.7 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 58.1 m-85 -77.75 -46.24 22.3 Favored 'General case' 0 N--CA 1.454 -0.259 0 O-C-N 122.304 -0.248 . . . . 0.0 110.645 -175.532 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -56.34 -41.48 76.13 Favored 'General case' 0 C--N 1.332 -0.17 0 C-N-CA 123.491 0.716 . . . . 0.0 111.793 -179.655 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.53 0.181 0 C-N-CA 124.518 1.127 . . . . 0.0 112.232 177.8 . . . . . . . . 0 0 . 1 . 005 nuclear nobuild core ' A' A ' 20' ' ' PRO . . . . . . . . . . . . . 41.4 Cg_endo . . . . . 0 N--CA 1.458 -0.598 0 N-CA-C 113.201 0.424 . . . . 0.0 113.201 . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild core ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 51.0 m-80 -81.51 -4.12 55.04 Favored 'General case' 0 C--O 1.234 0.272 0 N-CA-C 113.58 0.955 . . . . 0.0 113.58 -169.21 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 43.5 tt0 -155.52 130.87 9.59 Favored 'General case' 0 CA--C 1.533 0.322 0 CA-C-N 119.333 0.969 . . . . 0.0 112.428 -168.311 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 40.2 mt -102.66 123.58 46.63 Favored 'General case' 0 N--CA 1.453 -0.283 0 C-N-CA 124.651 1.18 . . . . 0.0 111.85 179.13 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -84.21 170.84 13.33 Favored 'General case' 0 CA--C 1.537 0.471 0 C-N-CA 123.625 0.77 . . . . 0.0 109.591 165.202 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 98.4 mttt -51.14 -49.94 59.85 Favored 'General case' 0 C--N 1.339 0.123 0 N-CA-C 113.333 0.864 . . . . 0.0 113.333 -168.949 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 38.6 tp10 -63.2 -45.12 93.21 Favored 'General case' 0 N--CA 1.456 -0.152 0 O-C-N 121.983 -0.448 . . . . 0.0 111.045 -173.249 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 1.9 mp0 -53.66 -51.19 63.94 Favored 'General case' 0 N--CA 1.452 -0.358 0 N-CA-C 109.598 -0.519 . . . . 0.0 109.598 173.319 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 9.2 mt -55.73 -41.72 74.29 Favored 'General case' 0 CA--C 1.513 -0.472 0 N-CA-C 113.173 0.805 . . . . 0.0 113.173 173.748 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 60.0 tttm -61.82 -51.96 66.13 Favored 'General case' 0 C--N 1.325 -0.494 0 CA-C-N 118.67 0.668 . . . . 0.0 109.82 -177.249 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 10.5 mp -63.2 -44.09 96.32 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.146 -0.479 . . . . 0.0 110.606 -179.936 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 7.4 tt -50.32 -58.25 6.07 Favored 'General case' 0 C--N 1.332 -0.167 0 C-N-CA 123.789 0.835 . . . . 0.0 109.543 173.074 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 29.4 mt -54.19 -62.13 1.85 Allowed 'General case' 0 N--CA 1.455 -0.193 0 C-N-CA 123.561 0.744 . . . . 0.0 109.605 -179.103 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 25.5 tt0 -55.73 -45.08 78.05 Favored 'General case' 0 N--CA 1.452 -0.331 0 C-N-CA 123.575 0.75 . . . . 0.0 111.534 -173.096 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 19.8 m -78.44 -48.0 16.33 Favored 'General case' 0 C--N 1.33 -0.28 0 C-N-CA 122.367 0.267 . . . . 0.0 111.313 -173.376 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 66.7 mm-40 -96.42 -31.02 13.05 Favored 'General case' 0 N--CA 1.45 -0.463 0 N-CA-C 112.766 0.654 . . . . 0.0 112.766 -167.748 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 69.7 m-85 . . . . . 0 CA--C 1.53 0.197 0 C-N-CA 123.522 0.729 . . . . 0.0 110.462 -176.205 . . . . . . . . 0 0 . 1 . 005 nuclear nobuild core ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 58.8 tp . . . . . 0 C--O 1.226 -0.153 0 CA-C-O 120.787 0.327 . . . . 0.0 110.775 . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild core ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 5.7 m-20 -61.03 -54.5 44.06 Favored 'General case' 0 N--CA 1.45 -0.431 0 C-N-CA 123.395 0.678 . . . . 0.0 110.788 -179.215 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 59.1 mm-40 -58.29 -43.67 88.17 Favored 'General case' 0 N--CA 1.455 -0.217 0 C-N-CA 120.681 -0.407 . . . . 0.0 110.535 178.676 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 46.5 tp -61.17 -47.47 86.02 Favored 'General case' 0 N--CA 1.452 -0.335 0 N-CA-C 109.746 -0.465 . . . . 0.0 109.746 179.816 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 50' ' ' PHE . . . . . . . . . . . . . 70.4 t80 -51.96 -49.61 62.87 Favored 'General case' 0 C--N 1.331 -0.209 0 C-N-CA 124.022 0.929 . . . . 0.0 110.367 176.595 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 36.0 mt-10 -62.46 -44.11 97.2 Favored 'General case' 0 CA--C 1.532 0.266 0 C-N-CA 122.45 0.3 . . . . 0.0 111.687 177.464 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 34.4 mt-10 -57.36 -40.75 78.75 Favored 'General case' 0 C--N 1.332 -0.183 0 C-N-CA 122.921 0.488 . . . . 0.0 110.962 176.097 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 94.6 mt -66.33 -67.32 0.46 Allowed 'General case' 0 N--CA 1.449 -0.499 0 C-N-CA 123.054 0.542 . . . . 0.0 109.971 176.732 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 39.8 t0 . . . . . 0 N--CA 1.454 -0.267 0 N-CA-C 108.192 -1.04 . . . . 0.0 108.192 177.368 . . . . . . . . 0 0 . 1 . 005 nuclear nobuild core ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 11.3 mp0 . . . . . 0 N--CA 1.454 -0.266 0 N-CA-C 108.375 -0.972 . . . . 0.0 108.375 . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild core ' A' A ' 61' ' ' VAL . . . . . . . . . . . . . 15.2 t -79.18 110.54 15.01 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.375 0 C-N-CA 123.399 0.68 . . . . 0.0 111.397 -166.42 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 8.7 t -79.36 172.91 13.14 Favored 'General case' 0 CA--C 1.537 0.465 0 CA-C-O 120.815 0.34 . . . . 0.0 111.316 169.668 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 63' ' ' PHE . . . . . . . . . . . . . 55.1 t80 -63.45 -36.83 85.04 Favored 'General case' 0 N--CA 1.464 0.265 0 N-CA-C 113.3 0.852 . . . . 0.0 113.3 -168.679 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 21.1 mp0 -67.55 -58.4 4.77 Favored 'General case' 0 N--CA 1.453 -0.321 0 N-CA-C 108.864 -0.791 . . . . 0.0 108.864 -177.857 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 17.8 pt-20 -59.58 -35.04 73.49 Favored 'General case' 0 CA--C 1.539 0.549 0 O-C-N 121.775 -0.578 . . . . 0.0 111.796 177.351 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 19.2 t80 -51.39 -28.6 13.13 Favored 'General case' 0 CA--C 1.534 0.344 0 O-C-N 121.288 -0.882 . . . . 0.0 112.489 169.89 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 67' ' ' GLN . . . . . . . . . . . . . 74.8 mm-40 -54.38 -23.73 16.85 Favored 'General case' 0 CA--C 1.538 0.497 0 CA-C-N 120.119 1.327 . . . . 0.0 113.063 174.04 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 86.5 t -55.64 -27.93 22.4 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.704 0 CA-C-N 119.44 1.018 . . . . 0.0 111.042 172.079 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 8.4 tt -71.44 -41.03 69.96 Favored 'General case' 0 CA--C 1.529 0.164 0 O-C-N 120.892 -1.13 . . . . 0.0 108.256 176.597 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 70' ' ' VAL . . . . . . . . . . . . . 15.7 t . . . . . 0 CA--C 1.538 0.498 0 O-C-N 121.705 -0.622 . . . . 0.0 109.812 176.642 . . . . . . . . 0 0 . 1 . 006 nuclear nobuild core ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 88.8 Cg_exo . . . . . 0 N--CA 1.458 -0.592 0 CA-C-O 120.647 0.186 . . . . 0.0 112.465 . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild core ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 45.7 mt-10 -59.25 -48.14 82.72 Favored 'General case' 0 C--O 1.232 0.159 0 C-N-CA 123.504 0.722 . . . . 0.0 111.083 177.687 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 31.6 mt-10 -61.42 -46.22 91.04 Favored 'General case' 0 C--O 1.221 -0.41 0 N-CA-C 108.957 -0.757 . . . . 0.0 108.957 177.263 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 14.8 mt -59.25 -40.38 85.8 Favored 'General case' 0 N--CA 1.451 -0.417 0 C-N-CA 123.596 0.759 . . . . 0.0 111.477 -178.334 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -60.18 -53.93 51.89 Favored 'General case' 0 CA--C 1.53 0.206 0 C-N-CA 123.332 0.653 . . . . 0.0 110.73 170.987 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . -51.84 -49.03 49.57 Favored Glycine 0 CA--C 1.533 1.192 0 N-CA-C 111.295 -0.722 . . . . 0.0 111.295 179.205 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 9' ' ' ILE . . . . . . . . . . . . . 3.4 mm -59.41 -52.07 65.21 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.265 0 C-N-CA 127.416 2.286 . . . . 0.0 109.254 177.339 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 10' ' ' PHE . . . . . . . . . . . . . 51.9 t80 -48.13 -53.21 17.42 Favored 'General case' 0 N--CA 1.45 -0.463 0 N-CA-C 109.306 -0.627 . . . . 0.0 109.306 177.234 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 44.5 mt-10 -60.48 -52.97 62.94 Favored 'General case' 0 CA--C 1.53 0.173 0 C-N-CA 122.438 0.295 . . . . 0.0 110.682 179.411 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 39.4 tttm -43.06 -54.82 4.13 Favored 'General case' 0 N--CA 1.455 -0.177 0 C-N-CA 125.025 1.33 . . . . 0.0 110.668 179.832 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 70.0 m-85 -78.47 -44.1 25.43 Favored 'General case' 0 N--CA 1.454 -0.238 0 CA-C-O 119.533 -0.27 . . . . 0.0 111.386 -176.254 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -52.19 -37.96 56.41 Favored 'General case' 0 N--CA 1.463 0.208 0 C-N-CA 123.351 0.66 . . . . 0.0 112.086 179.118 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.402 0 N-CA-C 113.597 0.962 . . . . 0.0 113.597 179.589 . . . . . . . . 0 0 . 1 . 006 nuclear nobuild core ' A' A ' 20' ' ' PRO . . . . . . . . . . . . . 17.8 Cg_endo . . . . . 0 CA--C 1.54 0.804 0 CA-C-O 120.451 0.104 . . . . 0.0 112.351 . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild core ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 31.9 m-80 -86.22 -7.62 58.4 Favored 'General case' 0 CA--C 1.533 0.314 0 C-N-CA 124.615 1.166 . . . . 0.0 112.97 -179.1 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 25.3 tt0 -155.57 115.53 3.71 Favored 'General case' 0 CA--C 1.538 0.506 0 CA-C-N 119.443 1.02 . . . . 0.0 111.81 -168.907 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 32.3 mt -80.49 128.32 33.45 Favored 'General case' 0 C--O 1.234 0.283 0 C-N-CA 123.513 0.725 . . . . 0.0 112.015 -171.421 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -86.12 175.25 8.63 Favored 'General case' 0 CA--C 1.541 0.629 0 N-CA-C 108.108 -1.071 . . . . 0.0 108.108 166.13 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 98.6 mttt -56.15 -44.83 79.63 Favored 'General case' 0 N--CA 1.456 -0.165 0 C-N-CA 123.394 0.678 . . . . 0.0 112.187 -172.209 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 24.8 mt-10 -65.46 -46.84 78.23 Favored 'General case' 0 CA--C 1.521 -0.136 0 CA-C-O 121.116 0.484 . . . . 0.0 110.551 -173.56 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 2.0 mp0 -53.36 -51.32 62.85 Favored 'General case' 0 N--CA 1.451 -0.424 0 CA-C-N 115.734 -0.666 . . . . 0.0 109.257 174.089 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 8.6 mt -55.42 -42.17 73.77 Favored 'General case' 0 CA--C 1.511 -0.551 0 N-CA-C 113.646 0.98 . . . . 0.0 113.646 173.486 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 84.1 tttt -60.63 -56.67 18.54 Favored 'General case' 0 C--N 1.324 -0.533 0 N-CA-C 108.835 -0.802 . . . . 0.0 108.835 -178.291 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 4.2 mm? -58.37 -43.65 88.54 Favored 'General case' 0 C--N 1.328 -0.341 0 C-N-CA 120.887 -0.325 . . . . 0.0 110.92 -178.348 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 9.3 tt -51.99 -57.85 8.25 Favored 'General case' 0 CA--C 1.53 0.179 0 C-N-CA 123.533 0.733 . . . . 0.0 109.906 173.769 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 38.9 mt -54.46 -58.41 7.58 Favored 'General case' 0 C--N 1.332 -0.159 0 C-N-CA 123.739 0.816 . . . . 0.0 110.309 -178.596 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 23.8 mm100 -52.32 -55.01 24.32 Favored 'General case' 0 N--CA 1.453 -0.277 0 C-N-CA 124.603 1.161 . . . . 0.0 110.846 -176.96 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 11.9 m -74.42 -43.43 56.31 Favored 'General case' 0 N--CA 1.449 -0.479 0 CA-C-N 115.602 -0.727 . . . . 0.0 111.202 -169.558 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 71.8 mm-40 -100.1 -29.36 12.55 Favored 'General case' 0 N--CA 1.448 -0.572 0 N-CA-C 113.583 0.956 . . . . 0.0 113.583 -167.734 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 50.9 m-85 . . . . . 0 C--O 1.234 0.276 0 N-CA-C 113.157 0.799 . . . . 0.0 113.157 -171.23 . . . . . . . . 0 0 . 1 . 006 nuclear nobuild core ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 22.7 mt . . . . . 0 C--O 1.221 -0.438 0 N-CA-C 107.913 -1.143 . . . . 0.0 107.913 . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild core ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 5.4 m-20 -53.28 -53.64 47.92 Favored 'General case' 0 N--CA 1.449 -0.521 0 C-N-CA 124.633 1.173 . . . . 0.0 111.66 176.901 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 19.9 tp10 -56.89 -52.06 66.65 Favored 'General case' 0 N--CA 1.456 -0.146 0 N-CA-C 110.403 -0.221 . . . . 0.0 110.403 177.513 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 3.9 mm? -56.08 -45.43 79.35 Favored 'General case' 0 C--O 1.225 -0.213 0 CA-C-O 120.969 0.414 . . . . 0.0 110.264 179.781 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 50' ' ' PHE . . . . . . . . . . . . . 64.9 t80 -58.86 -50.89 72.3 Favored 'General case' 0 N--CA 1.448 -0.533 0 C-N-CA 124.117 0.967 . . . . 0.0 110.084 -178.287 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 24.9 tp10 -59.46 -46.42 88.83 Favored 'General case' 0 N--CA 1.453 -0.306 0 N-CA-C 109.996 -0.372 . . . . 0.0 109.996 178.555 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 13.6 tm-20 -57.44 -44.24 84.54 Favored 'General case' 0 CA--C 1.531 0.231 0 C-N-CA 123.609 0.764 . . . . 0.0 110.493 -179.824 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 84.6 mt -72.09 -45.23 61.47 Favored 'General case' 0 N--CA 1.45 -0.429 0 C-N-CA 123.5 0.72 . . . . 0.0 111.568 -178.363 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 47.1 t0 . . . . . 0 CA--C 1.533 0.319 0 C-N-CA 123.699 0.8 . . . . 0.0 110.697 -177.786 . . . . . . . . 0 0 . 1 . 006 nuclear nobuild core ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 59.5 mt-10 . . . . . 0 CA--C 1.532 0.272 0 N-CA-C 106.431 -1.692 . . . . 0.0 106.431 . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild core ' A' A ' 61' ' ' VAL . . . . . . . . . . . . . 8.9 t -108.93 109.54 28.71 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.446 0 CA-C-N 118.554 0.616 . . . . 0.0 110.78 -175.911 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 3.8 m -78.76 154.03 30.31 Favored 'General case' 0 CA--C 1.537 0.45 0 C-N-CA 123.296 0.638 . . . . 0.0 111.107 173.418 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 63' ' ' PHE . . . . . . . . . . . . . 69.7 t80 -51.13 -42.37 60.7 Favored 'General case' 0 CA--C 1.534 0.358 0 C-N-CA 123.524 0.73 . . . . 0.0 112.711 -173.334 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 12.6 pt-20 -59.18 -37.09 76.52 Favored 'General case' 0 CA--C 1.534 0.349 0 N-CA-C 112.746 0.647 . . . . 0.0 112.746 -178.565 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 18.7 pt-20 -91.23 -30.52 16.59 Favored 'General case' 0 CA--C 1.531 0.239 0 C-N-CA 123.091 0.557 . . . . 0.0 110.062 -179.087 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 7.9 t80 -49.97 -27.28 5.17 Favored 'General case' 0 CA--C 1.536 0.421 0 C-N-CA 123.86 0.864 . . . . 0.0 111.071 167.815 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 67' ' ' GLN . . . . . . . . . . . . . 68.9 mm-40 -49.55 -27.61 4.63 Favored 'General case' 0 CA--C 1.537 0.47 0 CA-C-N 119.259 0.936 . . . . 0.0 113.448 171.586 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 69.2 t -53.17 -32.25 18.81 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.58 0 O-C-N 121.368 -0.833 . . . . 0.0 111.368 172.613 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 8.5 tt -71.54 -42.69 67.59 Favored 'General case' 0 N--CA 1.455 -0.192 0 N-CA-C 107.946 -1.131 . . . . 0.0 107.946 178.806 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 70' ' ' VAL . . . . . . . . . . . . . 19.0 t . . . . . 0 N--CA 1.453 -0.286 0 N-CA-C 109.721 -0.474 . . . . 0.0 109.721 177.272 . . . . . . . . 0 0 . 1 . 007 nuclear nobuild core ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 97.1 Cg_exo . . . . . 0 N--CA 1.458 -0.598 0 N-CA-C 112.821 0.277 . . . . 0.0 112.821 . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild core ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 3.0 mp0 -59.06 -49.84 76.34 Favored 'General case' 0 N--CA 1.456 -0.125 0 C-N-CA 123.54 0.736 . . . . 0.0 111.757 176.751 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 46.6 mm-40 -62.63 -43.15 99.53 Favored 'General case' 0 C--N 1.331 -0.204 0 N-CA-C 109.201 -0.666 . . . . 0.0 109.201 179.165 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 12.8 mt -60.34 -36.66 78.49 Favored 'General case' 0 N--CA 1.446 -0.664 0 CA-C-O 119.266 -0.397 . . . . 0.0 111.916 175.67 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 79.3 tttt -64.64 -45.07 88.38 Favored 'General case' 0 N--CA 1.448 -0.55 0 CA-C-N 118.813 0.733 . . . . 0.0 110.526 172.294 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . -52.8 -52.36 39.26 Favored Glycine 0 CA--C 1.53 1.028 0 N-CA-C 110.169 -1.172 . . . . 0.0 110.169 177.253 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 9' ' ' ILE . . . . . . . . . . . . . 15.1 mm -54.19 -58.25 4.12 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.198 0 C-N-CA 125.631 1.572 . . . . 0.0 109.391 173.848 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 10' ' ' PHE . . . . . . . . . . . . . 28.5 t80 -46.05 -51.11 14.3 Favored 'General case' 0 N--CA 1.448 -0.566 0 C-N-CA 123.173 0.589 . . . . 0.0 109.995 179.854 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 48.0 mt-10 -63.4 -49.94 71.81 Favored 'General case' 0 CA--C 1.53 0.195 0 C-N-CA 123.657 0.783 . . . . 0.0 111.037 -179.385 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 41.1 tttp -42.57 -51.16 5.24 Favored 'General case' 0 C--N 1.341 0.212 0 C-N-CA 124.635 1.174 . . . . 0.0 110.649 176.693 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 81.2 m-85 -78.79 -51.27 9.99 Favored 'General case' 0 N--CA 1.452 -0.348 0 CA-C-N 116.521 -0.309 . . . . 0.0 110.504 -178.78 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -56.93 -25.56 57.76 Favored 'General case' 0 N--CA 1.465 0.287 0 C-N-CA 126.347 1.859 . . . . 0.0 114.436 -174.46 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.453 -0.318 0 CA-C-O 118.276 -0.868 . . . . 0.0 113.278 177.3 . . . . . . . . 0 0 . 1 . 007 nuclear nobuild core ' A' A ' 20' ' ' PRO . . . . . . . . . . . . . 10.4 Cg_endo . . . . . 0 CA--C 1.542 0.902 0 N-CA-C 114.546 0.941 . . . . 0.0 114.546 . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild core ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 38.9 m-80 -98.88 -1.96 38.85 Favored 'General case' 0 CA--C 1.538 0.486 0 C-N-CA 125.395 1.478 . . . . 0.0 112.827 -178.955 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 4.4 tp60 -145.22 116.84 8.1 Favored 'General case' 0 CA--C 1.55 0.964 0 C-N-CA 124.684 1.194 . . . . 0.0 112.42 -168.152 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 44.3 mt -91.71 128.83 37.7 Favored 'General case' 0 C--N 1.344 0.331 0 C-N-CA 124.592 1.157 . . . . 0.0 112.578 -175.354 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 98.3 p -79.4 167.71 20.48 Favored 'General case' 0 CA--C 1.537 0.462 0 C-N-CA 123.779 0.832 . . . . 0.0 109.316 167.665 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 97.4 mttt -54.79 -47.7 73.66 Favored 'General case' 0 C--N 1.339 0.141 0 O-C-N 121.866 -0.521 . . . . 0.0 111.342 -179.421 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 42.2 tt0 -61.41 -44.06 97.79 Favored 'General case' 0 N--CA 1.454 -0.234 0 CA-C-O 120.695 0.283 . . . . 0.0 110.729 -178.138 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 69.5 mt-10 -59.58 -48.8 80.25 Favored 'General case' 0 N--CA 1.448 -0.525 0 N-CA-C 109.717 -0.475 . . . . 0.0 109.717 177.329 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 7.5 mt -54.16 -42.53 69.71 Favored 'General case' 0 CA--C 1.511 -0.549 0 N-CA-C 113.084 0.772 . . . . 0.0 113.084 170.868 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 82.5 tttt -62.46 -50.1 72.81 Favored 'General case' 0 N--CA 1.448 -0.565 0 CA-C-N 118.68 0.673 . . . . 0.0 109.593 -177.304 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 79.1 mt -59.95 -45.43 92.66 Favored 'General case' 0 C--O 1.235 0.341 0 C-N-CA 122.725 0.41 . . . . 0.0 111.506 178.272 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 7.9 tt -53.63 -56.74 14.57 Favored 'General case' 0 N--CA 1.455 -0.188 0 C-N-CA 123.77 0.828 . . . . 0.0 109.169 174.851 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 50.2 mt -55.72 -51.08 68.56 Favored 'General case' 0 N--CA 1.454 -0.267 0 C-N-CA 123.813 0.845 . . . . 0.0 109.751 -178.569 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 35.5 mt-30 -49.51 -54.6 17.01 Favored 'General case' 0 N--CA 1.458 -0.032 0 C-N-CA 123.165 0.586 . . . . 0.0 111.236 176.982 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 6.0 m -70.71 -48.66 53.47 Favored 'General case' 0 N--CA 1.454 -0.267 0 CA-C-N 116.059 -0.519 . . . . 0.0 111.095 -170.93 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 19.6 mm-40 -97.57 -37.34 9.98 Favored 'General case' 0 N--CA 1.45 -0.445 0 C-N-CA 123.759 0.824 . . . . 0.0 113.131 -167.339 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 27.0 m-85 . . . . . 0 CA--C 1.536 0.411 0 C-N-CA 122.93 0.492 . . . . 0.0 112.155 -168.744 . . . . . . . . 0 0 . 1 . 007 nuclear nobuild core ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 65.1 tp . . . . . 0 C--O 1.223 -0.297 0 N-CA-C 111.982 0.364 . . . . 0.0 111.982 . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild core ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 6.7 m-20 -58.09 -51.2 70.69 Favored 'General case' 0 N--CA 1.452 -0.369 0 C-N-CA 123.306 0.643 . . . . 0.0 111.392 179.276 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 3.2 mp0 -60.44 -46.93 88.28 Favored 'General case' 0 N--CA 1.457 -0.116 0 N-CA-C 109.983 -0.377 . . . . 0.0 109.983 177.955 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 94.5 mt -56.73 -46.19 81.49 Favored 'General case' 0 C--O 1.225 -0.236 0 N-CA-C 109.946 -0.39 . . . . 0.0 109.946 178.66 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 50' ' ' PHE . . . . . . . . . . . . . 68.7 t80 -57.23 -51.88 67.58 Favored 'General case' 0 N--CA 1.45 -0.446 0 C-N-CA 124.034 0.934 . . . . 0.0 110.457 179.561 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 53.5 mm-40 -57.39 -48.2 79.7 Favored 'General case' 0 CA--C 1.532 0.275 0 CA-C-O 120.594 0.235 . . . . 0.0 110.98 176.559 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 47.5 tp10 -55.3 -44.4 75.7 Favored 'General case' 0 CA--C 1.53 0.204 0 C-N-CA 123.759 0.824 . . . . 0.0 110.865 179.43 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 85.2 mt -69.32 -46.64 66.59 Favored 'General case' 0 N--CA 1.449 -0.5 0 C-N-CA 123.213 0.605 . . . . 0.0 110.923 179.902 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 55.2 t0 . . . . . 0 CA--C 1.535 0.402 0 C-N-CA 123.548 0.739 . . . . 0.0 110.57 179.309 . . . . . . . . 0 0 . 1 . 007 nuclear nobuild core ' A' A ' 60' ' ' GLU . . . . . . . . . . . . 0.343 0.2 OUTLIER . . . . . 0 CA--C 1.537 0.469 0 N-CA-C 110.735 -0.098 . . . . 0.0 110.735 . . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 61' ' ' VAL . . . . . . . . . . . . . 13.6 t -77.23 122.53 32.02 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.42 0 N-CA-C 113.921 1.082 . . . . 0.0 113.921 -164.096 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -77.96 152.09 33.34 Favored 'General case' 0 CA--C 1.536 0.406 0 C-N-CA 123.838 0.855 . . . . 0.0 110.942 174.053 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 63' ' ' PHE . . . . . . . . . . . . . 59.7 t80 -53.81 -31.24 48.38 Favored 'General case' 0 N--CA 1.47 0.566 0 N-CA-C 113.862 1.06 . . . . 0.0 113.862 176.771 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 28.8 mp0 -68.65 -63.52 1.04 Allowed 'General case' 0 N--CA 1.453 -0.318 0 O-C-N 121.581 -0.7 . . . . 0.0 109.112 -179.977 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 18.5 pt-20 -62.27 -28.37 69.67 Favored 'General case' 0 CA--C 1.539 0.522 0 O-C-N 121.274 -0.891 . . . . 0.0 111.828 -179.631 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 12.7 t80 -50.01 -27.54 5.64 Favored 'General case' 0 CA--C 1.534 0.342 0 C-N-CA 123.662 0.785 . . . . 0.0 112.622 169.304 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 67' ' ' GLN . . . . . . . . . . . . . 71.6 mm-40 -55.4 -22.09 18.43 Favored 'General case' 0 CA--C 1.543 0.706 0 CA-C-N 119.812 1.187 . . . . 0.0 112.901 173.925 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 72.5 t -53.23 -29.15 15.65 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.589 0 O-C-N 120.98 -1.075 . . . . 0.0 111.175 169.889 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 18.7 tp -70.91 -42.06 70.42 Favored 'General case' 0 N--CA 1.452 -0.331 0 N-CA-C 107.872 -1.158 . . . . 0.0 107.872 177.438 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 70' ' ' VAL . . . . . . . . . . . . . 24.2 t . . . . . 0 N--CA 1.456 -0.169 0 N-CA-C 109.863 -0.421 . . . . 0.0 109.863 177.077 . . . . . . . . 0 0 . 1 . 008 nuclear nobuild core ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 88.1 Cg_exo . . . . . 0 N--CA 1.456 -0.685 0 CA-C-O 120.24 0.017 . . . . 0.0 112.107 . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild core ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 40.0 tt0 -63.62 -47.03 83.02 Favored 'General case' 0 N--CA 1.456 -0.164 0 C-N-CA 123.327 0.651 . . . . 0.0 111.293 177.129 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 25.9 mt-10 -60.46 -47.53 85.74 Favored 'General case' 0 N--CA 1.454 -0.241 0 N-CA-C 108.48 -0.933 . . . . 0.0 108.48 176.997 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 17.9 mt -57.75 -37.7 74.08 Favored 'General case' 0 N--CA 1.45 -0.462 0 C-N-CA 123.639 0.776 . . . . 0.0 111.947 178.127 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 21.1 tptm -62.4 -51.84 65.96 Favored 'General case' 0 C--N 1.332 -0.188 0 CA-C-N 118.728 0.695 . . . . 0.0 111.089 171.986 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . -53.95 -50.61 54.16 Favored Glycine 0 CA--C 1.531 1.035 0 N-CA-C 110.136 -1.186 . . . . 0.0 110.136 -179.811 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 9' ' ' ILE . . . . . . . . . . . . . 69.3 mt -55.01 -53.63 32.1 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.385 0 C-N-CA 125.772 1.629 . . . . 0.0 110.27 174.053 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 10' ' ' PHE . . . . . . . . . . . . . 41.0 t80 -49.17 -52.76 24.55 Favored 'General case' 0 N--CA 1.45 -0.457 0 N-CA-C 109.208 -0.664 . . . . 0.0 109.208 179.153 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 50.0 mt-10 -58.91 -50.9 72.3 Favored 'General case' 0 N--CA 1.453 -0.292 0 C-N-CA 122.898 0.479 . . . . 0.0 110.289 -179.468 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 41.0 tttm -48.63 -59.76 3.26 Favored 'General case' 0 CA--C 1.532 0.268 0 C-N-CA 123.462 0.705 . . . . 0.0 111.243 176.879 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 57.8 m-85 -76.57 -30.01 56.87 Favored 'General case' 0 C--O 1.224 -0.26 0 O-C-N 121.913 -0.492 . . . . 0.0 110.946 -169.955 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -66.2 -46.52 77.01 Favored 'General case' 0 N--CA 1.453 -0.275 0 O-C-N 121.932 -0.48 . . . . 0.0 110.259 173.878 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.333 -0.128 0 C-N-CA 123.545 0.738 . . . . 0.0 111.572 176.987 . . . . . . . . 0 0 . 1 . 008 nuclear nobuild core ' A' A ' 20' ' ' PRO . . . . . . . . . . . . . 13.3 Cg_endo . . . . . 0 CA--C 1.535 0.525 0 N-CA-C 114.893 1.074 . . . . 0.0 114.893 . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild core ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 46.4 m-80 -90.39 -2.29 57.96 Favored 'General case' 0 N--CA 1.452 -0.358 0 C-N-CA 123.9 0.88 . . . . 0.0 112.583 -177.257 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 43.6 tt0 -155.79 122.67 5.32 Favored 'General case' 0 CA--C 1.539 0.553 0 CA-C-N 119.799 1.181 . . . . 0.0 113.432 -167.677 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 56.8 mt -89.05 133.16 34.46 Favored 'General case' 0 CA--C 1.532 0.281 0 C-N-CA 124.252 1.021 . . . . 0.0 112.055 -178.682 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 45.1 p -78.27 172.46 13.55 Favored 'General case' 0 CA--C 1.535 0.377 0 C-N-CA 123.534 0.734 . . . . 0.0 109.413 167.676 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 98.0 mttt -57.97 -45.91 85.99 Favored 'General case' 0 C--O 1.226 -0.177 0 O-C-N 121.746 -0.596 . . . . 0.0 109.752 174.34 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 26' ' ' GLU . . . . . 0.421 ' H ' ' CD ' ' A' ' 26' ' ' GLU . 2.0 mp0 -62.57 -48.29 80.12 Favored 'General case' 0 CA--C 1.516 -0.345 0 CA-C-O 121.194 0.521 . . . . 0.0 109.948 -177.311 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 34.2 mt-10 -56.29 -47.37 78.79 Favored 'General case' 0 N--CA 1.449 -0.487 0 CA-C-N 115.467 -0.788 . . . . 0.0 109.661 177.104 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 11.0 mt -55.16 -44.83 75.55 Favored 'General case' 0 CA--C 1.512 -0.496 0 N-CA-C 113.051 0.76 . . . . 0.0 113.051 170.003 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 62.5 tttm -61.73 -48.9 78.64 Favored 'General case' 0 C--N 1.324 -0.533 0 CA-C-N 118.732 0.697 . . . . 0.0 110.019 -176.093 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 4.2 mm? -61.53 -46.07 91.52 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.375 -0.375 . . . . 0.0 111.056 178.142 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 6.0 tt -49.87 -59.17 4.1 Favored 'General case' 0 C--N 1.333 -0.127 0 C-N-CA 123.648 0.779 . . . . 0.0 109.332 173.859 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 49.4 mt -55.78 -58.26 8.58 Favored 'General case' 0 N--CA 1.454 -0.265 0 C-N-CA 123.563 0.745 . . . . 0.0 109.817 -177.738 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 30.0 tt0 -50.97 -52.2 45.03 Favored 'General case' 0 N--CA 1.452 -0.349 0 C-N-CA 124.361 1.064 . . . . 0.0 111.438 -177.807 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 16.3 m -74.54 -49.31 22.4 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.235 -0.439 . . . . 0.0 110.861 -171.26 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 70.8 mm-40 -89.5 -31.99 17.4 Favored 'General case' 0 N--CA 1.449 -0.483 0 C-N-CA 122.7 0.4 . . . . 0.0 111.77 -169.4 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 76.4 m-85 . . . . . 0 CA--C 1.535 0.366 0 C-N-CA 124.268 1.027 . . . . 0.0 110.235 -175.541 . . . . . . . . 0 0 . 1 . 008 nuclear nobuild core ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 62.6 tp . . . . . 0 C--O 1.227 -0.084 0 N-CA-C 112.606 0.595 . . . . 0.0 112.606 . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild core ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 5.9 m-20 -57.87 -56.62 19.66 Favored 'General case' 0 N--CA 1.451 -0.415 0 CA-C-O 121.408 0.623 . . . . 0.0 110.129 178.899 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 70.0 mm-40 -54.23 -47.35 72.28 Favored 'General case' 0 N--CA 1.453 -0.323 0 CA-C-N 115.911 -0.586 . . . . 0.0 110.222 178.555 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 6.2 tp -52.8 -53.5 47.55 Favored 'General case' 0 C--O 1.224 -0.283 0 C-N-CA 123.096 0.558 . . . . 0.0 109.921 176.172 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 50' ' ' PHE . . . . . . . . . . . . . 63.1 t80 -52.6 -51.35 60.34 Favored 'General case' 0 N--CA 1.453 -0.299 0 C-N-CA 124.232 1.013 . . . . 0.0 110.486 -179.194 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 2.2 mp0 -56.18 -50.03 72.35 Favored 'General case' 0 CA--C 1.533 0.31 0 CA-C-O 120.529 0.204 . . . . 0.0 111.18 174.89 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 34.6 mt-10 -55.62 -41.75 73.95 Favored 'General case' 0 CA--C 1.531 0.217 0 C-N-CA 123.024 0.53 . . . . 0.0 111.673 179.983 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 76.4 mt -67.04 -54.9 17.16 Favored 'General case' 0 N--CA 1.449 -0.523 0 C-N-CA 122.921 0.488 . . . . 0.0 110.339 177.689 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 11.4 t70 . . . . . 0 N--CA 1.453 -0.296 0 CA-C-O 121.627 0.727 . . . . 0.0 109.332 -179.136 . . . . . . . . 0 0 . 1 . 008 nuclear nobuild core ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 39.7 mt-10 . . . . . 0 N--CA 1.455 -0.204 0 N-CA-C 107.615 -1.254 . . . . 0.0 107.615 . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild core ' A' A ' 61' ' ' VAL . . . . . . . . . . . . . 3.8 t -88.77 111.24 22.35 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.308 0 N-CA-C 112.754 0.65 . . . . 0.0 112.754 -163.913 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 34.3 m -79.45 162.36 25.51 Favored 'General case' 0 CA--C 1.533 0.326 0 C-N-CA 123.094 0.558 . . . . 0.0 111.989 169.876 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 63' ' ' PHE . . . . . . . . . . . . . 57.7 t80 -54.2 -37.89 65.05 Favored 'General case' 0 N--CA 1.464 0.257 0 N-CA-C 113.388 0.885 . . . . 0.0 113.388 -169.568 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 25.3 mp0 -65.39 -57.69 7.72 Favored 'General case' 0 N--CA 1.451 -0.404 0 N-CA-C 109.081 -0.711 . . . . 0.0 109.081 -176.565 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 17.1 pt-20 -61.43 -36.49 80.5 Favored 'General case' 0 CA--C 1.541 0.623 0 O-C-N 121.823 -0.548 . . . . 0.0 111.347 177.478 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 14.6 t80 -52.76 -26.12 13.29 Favored 'General case' 0 CA--C 1.537 0.474 0 C-N-CA 123.943 0.897 . . . . 0.0 112.335 169.922 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 67' ' ' GLN . . . . . . . . . . . . . 60.3 mm-40 -54.82 -23.17 17.06 Favored 'General case' 0 CA--C 1.534 0.337 0 CA-C-N 119.83 1.195 . . . . 0.0 113.077 173.356 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 98.6 t -55.89 -33.76 35.77 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.516 0 CA-C-N 119.341 0.973 . . . . 0.0 110.528 171.526 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 22.5 tp -74.12 -49.92 21.77 Favored 'General case' 0 N--CA 1.455 -0.203 0 N-CA-C 107.754 -1.202 . . . . 0.0 107.754 177.264 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 70' ' ' VAL . . . . . . . . . . . . . 58.9 t . . . . . 0 CA--C 1.536 0.408 0 C-N-CA 123.642 0.777 . . . . 0.0 110.472 179.63 . . . . . . . . 0 0 . 1 . 009 nuclear nobuild core ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 76.3 Cg_exo . . . . . 0 N--CA 1.453 -0.856 0 N-CA-C 111.821 -0.107 . . . . 0.0 111.821 . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild core ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 44.9 mt-10 -62.46 -53.07 60.31 Favored 'General case' 0 CA--C 1.531 0.234 0 C-N-CA 123.807 0.843 . . . . 0.0 111.327 176.77 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 28.7 mt-10 -55.28 -46.85 76.18 Favored 'General case' 0 C--N 1.335 -0.057 0 CA-C-O 121.599 0.714 . . . . 0.0 109.19 176.37 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 58.9 mt -60.65 -35.75 76.98 Favored 'General case' 0 N--CA 1.446 -0.626 0 C-N-CA 124.118 0.967 . . . . 0.0 112.757 178.344 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER -62.24 -47.95 82.11 Favored 'General case' 0 N--CA 1.454 -0.254 0 CA-C-N 119.031 0.832 . . . . 0.0 109.633 170.629 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . -53.75 -52.02 45.07 Favored Glycine 0 CA--C 1.532 1.106 0 N-CA-C 110.698 -0.961 . . . . 0.0 110.698 177.316 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 9' ' ' ILE . . . . . . . . . . . . . 24.0 mm -55.45 -54.45 25.18 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.235 0 C-N-CA 125.341 1.457 . . . . 0.0 109.775 175.152 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 10' ' ' PHE . . . . . . . . . . . . . 34.4 t80 -47.56 -50.75 23.08 Favored 'General case' 0 N--CA 1.45 -0.45 0 C-N-CA 123.445 0.698 . . . . 0.0 109.878 178.872 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 57.7 mt-10 -61.97 -53.14 59.73 Favored 'General case' 0 CA--C 1.53 0.173 0 C-N-CA 122.59 0.356 . . . . 0.0 110.781 178.385 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 39.4 tttm -44.0 -49.64 8.56 Favored 'General case' 0 CA--C 1.527 0.092 0 C-N-CA 124.986 1.314 . . . . 0.0 111.022 178.624 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 57.6 m-85 -78.38 -52.41 8.62 Favored 'General case' 0 N--CA 1.45 -0.437 0 CA-C-O 119.409 -0.329 . . . . 0.0 110.613 -177.64 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -48.01 -60.65 2.45 Favored 'General case' 0 C--N 1.331 -0.199 0 C-N-CA 124.083 0.953 . . . . 0.0 111.043 -179.444 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.529 0.167 0 C-N-CA 125.148 1.379 . . . . 0.0 113.051 -177.411 . . . . . . . . 0 0 . 1 . 009 nuclear nobuild core ' A' A ' 20' ' ' PRO . . . . . . . . . . . . . 12.0 Cg_endo . . . . . 0 CA--C 1.536 0.583 0 N-CA-C 114.533 0.936 . . . . 0.0 114.533 . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild core ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 51.8 m-80 -88.58 2.9 52.17 Favored 'General case' 0 CA--C 1.536 0.429 0 C-N-CA 124.77 1.228 . . . . 0.0 113.105 -179.611 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -149.38 116.43 6.01 Favored 'General case' 0 CA--C 1.541 0.619 0 CA-C-N 119.187 0.903 . . . . 0.0 112.683 -169.039 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 77.9 mt -88.2 134.3 33.82 Favored 'General case' 0 CA--C 1.532 0.288 0 C-N-CA 124.563 1.145 . . . . 0.0 111.095 173.654 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 27.5 p -80.38 178.73 8.1 Favored 'General case' 0 CA--C 1.534 0.341 0 N-CA-C 108.543 -0.91 . . . . 0.0 108.543 166.389 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 64.4 mttp -57.98 -38.95 77.01 Favored 'General case' 0 N--CA 1.455 -0.218 0 N-CA-C 109.806 -0.442 . . . . 0.0 109.806 170.127 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 1.8 mp0 -67.95 -50.74 54.13 Favored 'General case' 0 N--CA 1.45 -0.433 0 C-N-CA 122.883 0.473 . . . . 0.0 110.035 -175.755 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 3.0 mp0 -55.79 -44.77 78.1 Favored 'General case' 0 N--CA 1.452 -0.361 0 C-N-CA 119.826 -0.75 . . . . 0.0 110.236 174.87 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 12.7 mt -56.85 -43.43 81.13 Favored 'General case' 0 CA--C 1.513 -0.454 0 CA-C-N 119.067 0.849 . . . . 0.0 113.153 171.798 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 64.5 tttm -60.31 -48.76 80.38 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-N 118.505 0.593 . . . . 0.0 109.679 -178.444 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 87.2 mt -60.16 -47.47 85.8 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.179 -0.464 . . . . 0.0 111.375 178.166 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 7.6 tt -51.99 -57.64 8.87 Favored 'General case' 0 N--CA 1.456 -0.143 0 C-N-CA 124.175 0.99 . . . . 0.0 109.497 175.721 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 47.6 mt -56.0 -54.24 47.21 Favored 'General case' 0 C--O 1.223 -0.298 0 N-CA-C 108.717 -0.845 . . . . 0.0 108.717 -178.54 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 28.3 tt0 -53.65 -49.77 67.21 Favored 'General case' 0 N--CA 1.451 -0.387 0 C-N-CA 123.777 0.831 . . . . 0.0 111.652 -176.296 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 2.1 m -73.75 -52.76 12.1 Favored 'General case' 0 CA--C 1.531 0.223 0 C-N-CA 120.684 -0.407 . . . . 0.0 110.984 -175.546 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 57.3 mm-40 -87.22 -31.91 20.06 Favored 'General case' 0 N--CA 1.448 -0.555 0 C-N-CA 123.183 0.593 . . . . 0.0 112.426 -166.595 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 74.5 m-85 . . . . . 0 CA--C 1.534 0.335 0 C-N-CA 123.425 0.69 . . . . 0.0 111.604 -172.341 . . . . . . . . 0 0 . 1 . 009 nuclear nobuild core ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 19.5 mt . . . . . 0 CA--C 1.517 -0.316 0 N-CA-C 108.658 -0.867 . . . . 0.0 108.658 . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild core ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 3.4 m-20 -50.3 -44.89 54.23 Favored 'General case' 0 N--CA 1.453 -0.29 0 C-N-CA 125.261 1.425 . . . . 0.0 111.528 -176.219 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 5.9 mp0 -59.57 -48.21 82.53 Favored 'General case' 0 C--N 1.328 -0.327 0 C-N-CA 123.702 0.801 . . . . 0.0 110.468 176.907 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 1.3 tt -58.64 -50.96 71.94 Favored 'General case' 0 CA--C 1.534 0.335 0 CA-C-O 121.824 0.821 . . . . 0.0 109.264 177.573 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 50' ' ' PHE . . . . . . . . . . . . . 52.4 t80 -51.55 -50.55 59.83 Favored 'General case' 0 N--CA 1.452 -0.336 0 C-N-CA 124.778 1.231 . . . . 0.0 110.537 178.246 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 27.0 tp10 -60.81 -43.54 98.06 Favored 'General case' 0 N--CA 1.454 -0.253 0 C-N-CA 122.879 0.472 . . . . 0.0 110.587 177.528 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 12.8 tm-20 -54.61 -43.27 72.05 Favored 'General case' 0 CA--C 1.533 0.316 0 C-N-CA 122.763 0.425 . . . . 0.0 110.756 177.079 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 92.1 mt -68.28 -64.42 0.87 Allowed 'General case' 0 N--CA 1.452 -0.341 0 C-N-CA 122.698 0.399 . . . . 0.0 110.918 175.486 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 18.2 t0 . . . . . 0 N--CA 1.455 -0.202 0 C-N-CA 124.466 1.106 . . . . 0.0 109.438 178.935 . . . . . . . . 0 0 . 1 . 009 nuclear nobuild core ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 31.7 mt-10 . . . . . 0 N--CA 1.456 -0.14 0 N-CA-C 106.722 -1.584 . . . . 0.0 106.722 . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild core ' A' A ' 61' ' ' VAL . . . . . . . . . . . . . 65.5 t -109.92 103.05 14.87 Favored 'Isoleucine or valine' 0 CA--C 1.529 0.137 0 CA-C-N 118.184 0.447 . . . . 0.0 110.231 -169.164 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 11.9 t -78.81 170.96 15.86 Favored 'General case' 0 CA--C 1.535 0.374 0 CA-C-O 121.16 0.505 . . . . 0.0 111.383 172.52 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 63' ' ' PHE . . . . . . . . . . . . . 57.3 t80 -63.85 -39.58 94.54 Favored 'General case' 0 C--O 1.232 0.137 0 C-N-CA 122.713 0.405 . . . . 0.0 111.332 -173.062 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 50.2 mt-10 -61.4 -58.39 8.41 Favored 'General case' 0 N--CA 1.452 -0.359 0 O-C-N 122.088 -0.383 . . . . 0.0 110.025 -178.745 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 10.8 pt-20 -61.27 -36.4 79.94 Favored 'General case' 0 CA--C 1.537 0.458 0 O-C-N 121.707 -0.621 . . . . 0.0 111.547 178.574 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 24.7 t80 -52.97 -26.68 15.98 Favored 'General case' 0 CA--C 1.54 0.562 0 O-C-N 121.313 -0.867 . . . . 0.0 112.585 169.777 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 67' ' ' GLN . . . . . . . . . . . . . 40.2 mm-40 -54.81 -25.64 29.67 Favored 'General case' 0 CA--C 1.537 0.463 0 CA-C-N 119.819 1.191 . . . . 0.0 112.926 173.051 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 96.5 t -54.58 -32.69 25.53 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.605 0 CA-C-N 118.685 0.675 . . . . 0.0 110.458 172.238 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -77.16 -50.28 13.34 Favored 'General case' 0 N--CA 1.455 -0.211 0 C-N-CA 124.684 1.193 . . . . 0.0 108.696 172.931 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 70' ' ' VAL . . . . . . . . . . . . . 98.0 t . . . . . 0 N--CA 1.465 0.314 0 O-C-N 121.861 -0.525 . . . . 0.0 111.702 -177.674 . . . . . . . . 0 0 . 1 . 010 nuclear nobuild core ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 88.6 Cg_exo . . . . . 0 N--CA 1.458 -0.587 0 N-CA-C 112.58 0.185 . . . . 0.0 112.58 . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild core ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 48.4 mt-10 -60.93 -50.23 74.24 Favored 'General case' 0 C--O 1.232 0.177 0 C-N-CA 123.335 0.654 . . . . 0.0 110.841 177.357 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 45.1 mm-40 -59.58 -46.01 90.18 Favored 'General case' 0 N--CA 1.453 -0.281 0 N-CA-C 108.794 -0.817 . . . . 0.0 108.794 178.008 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 6' ' ' LEU . . . . . 0.422 HD13 HG22 ' A' ' 70' ' ' VAL . 25.6 mt -57.9 -40.1 79.5 Favored 'General case' 0 N--CA 1.445 -0.703 0 CA-C-O 118.653 -0.689 . . . . 0.0 112.333 178.235 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 20.6 tptm -59.5 -52.33 66.02 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 119.506 1.048 . . . . 0.0 110.168 171.94 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . -49.89 -53.84 20.63 Favored Glycine 0 CA--C 1.536 1.372 0 N-CA-C 111.699 -0.561 . . . . 0.0 111.699 177.927 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 9' ' ' ILE . . . . . . . . . . . . . 1.6 mm -53.7 -56.4 9.08 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.163 0 C-N-CA 127.007 2.123 . . . . 0.0 108.825 175.826 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 10' ' ' PHE . . . . . . . . . . . . . 24.0 t80 -49.36 -50.53 39.56 Favored 'General case' 0 N--CA 1.444 -0.732 0 C-N-CA 123.406 0.683 . . . . 0.0 109.374 -179.27 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 53.1 mt-10 -62.41 -48.07 81.31 Favored 'General case' 0 N--CA 1.453 -0.29 0 C-N-CA 123.196 0.598 . . . . 0.0 110.833 -179.147 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 37.1 tttm -44.2 -51.45 8.18 Favored 'General case' 0 CA--C 1.529 0.163 0 C-N-CA 124.006 0.923 . . . . 0.0 111.002 177.207 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 85.1 m-85 -79.38 -49.28 12.61 Favored 'General case' 0 CA--C 1.535 0.376 0 CA-C-O 120.546 0.212 . . . . 0.0 111.12 -177.245 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -55.67 -39.02 70.39 Favored 'General case' 0 N--CA 1.464 0.243 0 C-N-CA 124.532 1.133 . . . . 0.0 112.558 -177.428 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.532 0.279 0 C-N-CA 123.411 0.684 . . . . 0.0 111.807 175.794 . . . . . . . . 0 0 . 1 . 010 nuclear nobuild core ' A' A ' 20' ' ' PRO . . . . . . . . . . . . . 32.8 Cg_endo . . . . . 0 N--CA 1.456 -0.725 0 N-CA-C 112.414 0.121 . . . . 0.0 112.414 . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild core ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 41.9 m-80 -85.42 -5.02 59.33 Favored 'General case' 0 N--CA 1.452 -0.331 0 C-N-CA 124.526 1.13 . . . . 0.0 113.205 -174.167 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 27.8 tt0 -142.91 126.34 16.72 Favored 'General case' 0 CA--C 1.543 0.679 0 CA-C-N 119.513 1.051 . . . . 0.0 113.823 -169.553 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 70.4 mt -103.94 138.27 40.75 Favored 'General case' 0 C--N 1.345 0.393 0 C-N-CA 125.451 1.5 . . . . 0.0 112.15 -179.413 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 77.9 p -80.56 172.76 13.34 Favored 'General case' 0 C--O 1.234 0.259 0 C-N-CA 123.966 0.906 . . . . 0.0 109.722 168.021 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 98.3 mttt -55.41 -45.07 76.71 Favored 'General case' 0 C--O 1.226 -0.172 0 N-CA-C 110.169 -0.308 . . . . 0.0 110.169 172.045 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 22.9 mt-10 -65.85 -46.99 76.45 Favored 'General case' 0 CA--C 1.516 -0.336 0 CA-C-O 120.785 0.326 . . . . 0.0 110.559 -175.96 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -61.67 -39.92 93.12 Favored 'General case' 0 C--N 1.327 -0.374 0 C-N-CA 120.062 -0.655 . . . . 0.0 110.056 177.844 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 13.5 mt -57.47 -47.59 81.45 Favored 'General case' 0 C--O 1.218 -0.593 0 CA-C-N 119.346 0.975 . . . . 0.0 111.897 168.554 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 38.4 ttpt -58.08 -47.26 83.75 Favored 'General case' 0 C--N 1.323 -0.582 0 CA-C-N 119.002 0.819 . . . . 0.0 110.077 -175.95 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 3.7 mm? -59.59 -48.04 83.2 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.351 -0.386 . . . . 0.0 111.475 175.498 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 7.9 tt -51.23 -57.49 8.67 Favored 'General case' 0 N--CA 1.456 -0.136 0 C-N-CA 123.563 0.745 . . . . 0.0 109.896 176.061 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 48.0 mt -57.93 -51.2 70.62 Favored 'General case' 0 C--O 1.223 -0.292 0 N-CA-C 109.546 -0.539 . . . . 0.0 109.546 -179.247 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 17.5 tt0 -54.67 -44.15 73.05 Favored 'General case' 0 N--CA 1.452 -0.344 0 O-C-N 121.744 -0.597 . . . . 0.0 111.755 -176.598 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 2.1 m -77.85 -49.03 15.07 Favored 'General case' 0 CA--C 1.534 0.36 0 C-N-CA 120.92 -0.312 . . . . 0.0 111.316 -177.611 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 67.1 mm-40 -96.79 -27.9 14.52 Favored 'General case' 0 N--CA 1.451 -0.383 0 N-CA-C 114.015 1.117 . . . . 0.0 114.015 -165.716 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 97.9 m-85 . . . . . 0 CA--C 1.538 0.513 0 C-N-CA 124.559 1.144 . . . . 0.0 112.2 -176.592 . . . . . . . . 0 0 . 1 . 010 nuclear nobuild core ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 66.9 tp . . . . . 0 C--O 1.225 -0.192 0 N-CA-C 112.274 0.472 . . . . 0.0 112.274 . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild core ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 6.2 m-20 -59.21 -51.51 69.66 Favored 'General case' 0 N--CA 1.45 -0.431 0 C-N-CA 123.017 0.527 . . . . 0.0 110.829 -179.54 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 38.1 mm-40 -61.41 -43.96 97.96 Favored 'General case' 0 N--CA 1.453 -0.317 0 CA-C-N 116.291 -0.413 . . . . 0.0 110.394 -179.905 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 67.0 tp -56.99 -50.65 72.05 Favored 'General case' 0 N--CA 1.451 -0.38 0 N-CA-C 109.431 -0.581 . . . . 0.0 109.431 175.724 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 50' ' ' PHE . . . . . . . . . . . . . 65.4 t80 -54.06 -50.85 65.82 Favored 'General case' 0 N--CA 1.45 -0.439 0 C-N-CA 123.806 0.842 . . . . 0.0 110.508 -178.982 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 59.0 mm-40 -58.22 -47.51 83.27 Favored 'General case' 0 CA--C 1.532 0.267 0 CA-C-O 120.629 0.252 . . . . 0.0 111.151 175.683 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 40.7 tt0 -55.28 -40.3 70.87 Favored 'General case' 0 CA--C 1.531 0.238 0 C-N-CA 123.526 0.73 . . . . 0.0 111.338 179.279 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 84.3 mt -77.18 -49.28 15.52 Favored 'General case' 0 N--CA 1.448 -0.567 0 C-N-CA 122.99 0.516 . . . . 0.0 111.492 -179.341 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 43.8 t0 . . . . . 0 CA--C 1.536 0.409 0 C-N-CA 123.828 0.851 . . . . 0.0 111.586 -175.799 . . . . . . . . 0 0 . 1 . 010 nuclear nobuild core ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 42.0 mt-10 . . . . . 0 N--CA 1.452 -0.338 0 N-CA-C 106.137 -1.801 . . . . 0.0 106.137 . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild core ' A' A ' 61' ' ' VAL . . . . . . . . . . . . . 16.1 t -102.32 116.22 45.61 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.149 0 N-CA-C 108.807 -0.812 . . . . 0.0 108.807 -179.028 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 78.3 p -79.99 156.67 27.08 Favored 'General case' 0 CA--C 1.537 0.458 0 C-N-CA 122.934 0.493 . . . . 0.0 111.248 174.966 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 63' ' ' PHE . . . . . . . . . . . . . 77.2 t80 -56.11 -32.88 64.59 Favored 'General case' 0 N--CA 1.467 0.383 0 N-CA-C 113.31 0.856 . . . . 0.0 113.31 -178.361 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 13.0 tp10 -65.42 -62.45 1.52 Allowed 'General case' 0 N--CA 1.453 -0.288 0 O-C-N 121.882 -0.511 . . . . 0.0 109.624 178.495 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 12.0 pt-20 -64.97 -27.15 68.64 Favored 'General case' 0 CA--C 1.54 0.578 0 O-C-N 121.182 -0.948 . . . . 0.0 111.553 -177.023 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 15.5 t80 -50.97 -27.53 7.86 Favored 'General case' 0 CA--C 1.534 0.33 0 C-N-CA 123.499 0.72 . . . . 0.0 112.176 168.828 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 67' ' ' GLN . . . . . . . . . . . . . 66.8 mm-40 -53.88 -24.29 15.45 Favored 'General case' 0 CA--C 1.54 0.559 0 CA-C-N 119.814 1.188 . . . . 0.0 113.058 173.314 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 97.2 t -57.06 -31.26 36.46 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.631 0 O-C-N 121.043 -1.036 . . . . 0.0 111.24 171.796 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 7.5 tt -71.93 -44.22 63.99 Favored 'General case' 0 N--CA 1.457 -0.094 0 N-CA-C 107.721 -1.214 . . . . 0.0 107.721 177.959 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 70' ' ' VAL . . . . . 0.422 HG22 HD13 ' A' ' 6' ' ' LEU . 18.2 t . . . . . 0 CA--C 1.532 0.286 0 N-CA-C 109.804 -0.443 . . . . 0.0 109.804 178.07 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 84.8 Cg_exo . . . . . 0 N--CA 1.456 -0.71 0 N-CA-C 112.364 0.102 . . . . 0.0 112.364 . . . . . . . . . 0 0 . 1 . 011 nuclear nobuild core ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 44.7 mt-10 -62.71 -48.94 77.06 Favored 'General case' 0 CA--C 1.529 0.162 0 C-N-CA 123.657 0.783 . . . . 0.0 111.395 176.652 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 29.0 mt-10 -60.11 -46.46 89.55 Favored 'General case' 0 C--N 1.332 -0.164 0 N-CA-C 109.148 -0.686 . . . . 0.0 109.148 177.18 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 27.4 mt -60.29 -39.34 86.55 Favored 'General case' 0 N--CA 1.447 -0.585 0 C-N-CA 123.031 0.532 . . . . 0.0 111.953 179.087 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 19.7 tptm -58.86 -49.12 78.92 Favored 'General case' 0 C--N 1.332 -0.175 0 O-C-N 121.678 -0.639 . . . . 0.0 110.046 170.029 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . -51.66 -50.68 41.87 Favored Glycine 0 CA--C 1.529 0.941 0 N-CA-C 110.401 -1.08 . . . . 0.0 110.401 178.686 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 9' ' ' ILE . . . . . . . . . . . . . 24.4 mm -57.6 -54.95 24.52 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.252 0 C-N-CA 125.324 1.45 . . . . 0.0 109.894 175.795 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 10' ' ' PHE . . . . . . . . . . . . . 25.6 t80 -48.36 -50.84 28.97 Favored 'General case' 0 N--CA 1.446 -0.673 0 O-C-N 121.747 -0.596 . . . . 0.0 109.673 179.815 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 43.6 mt-10 -64.4 -46.69 82.21 Favored 'General case' 0 N--CA 1.453 -0.298 0 CA-C-O 118.687 -0.673 . . . . 0.0 111.429 179.596 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 29.2 ttmt -43.37 -53.3 5.41 Favored 'General case' 0 N--CA 1.464 0.24 0 C-N-CA 124.072 0.949 . . . . 0.0 110.469 175.947 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 80.3 m-85 -78.86 -47.84 15.82 Favored 'General case' 0 N--CA 1.451 -0.392 0 CA-C-N 116.544 -0.298 . . . . 0.0 110.829 -175.346 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -56.75 -45.48 81.99 Favored 'General case' 0 CA--C 1.533 0.32 0 CA-C-O 121.654 0.74 . . . . 0.0 112.1 -177.919 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.53 0.193 0 C-N-CA 123.96 0.904 . . . . 0.0 111.777 175.967 . . . . . . . . 0 0 . 1 . 011 nuclear nobuild core ' A' A ' 20' ' ' PRO . . . . . . . . . . . . . 29.3 Cg_endo . . . . . 0 N--CA 1.456 -0.702 0 N-CA-C 113.124 0.394 . . . . 0.0 113.124 . . . . . . . . . 0 0 . 1 . 011 nuclear nobuild core ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 43.1 m-80 -89.81 -6.14 56.22 Favored 'General case' 0 CA--C 1.531 0.228 0 C-N-CA 124.539 1.136 . . . . 0.0 113.601 -170.571 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 30.0 tt0 -148.09 126.35 12.24 Favored 'General case' 0 CA--C 1.541 0.606 0 CA-C-N 119.39 0.995 . . . . 0.0 112.492 -168.138 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 51.2 mt -103.31 135.88 44.13 Favored 'General case' 0 C--N 1.344 0.361 0 C-N-CA 125.295 1.438 . . . . 0.0 111.117 -178.649 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 7.0 p -88.6 178.06 6.61 Favored 'General case' 0 C--O 1.236 0.376 0 N-CA-C 108.475 -0.935 . . . . 0.0 108.475 167.162 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 99.1 mttt -54.16 -43.65 70.77 Favored 'General case' 0 N--CA 1.454 -0.231 0 C-N-CA 122.991 0.516 . . . . 0.0 111.299 -179.754 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 34.3 tt0 -65.84 -46.38 78.73 Favored 'General case' 0 N--CA 1.456 -0.14 0 O-C-N 121.995 -0.441 . . . . 0.0 110.602 -175.636 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 4.1 mp0 -58.39 -45.31 88.57 Favored 'General case' 0 N--CA 1.453 -0.322 0 N-CA-C 109.474 -0.565 . . . . 0.0 109.474 176.609 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 18.9 mt -57.39 -42.02 81.37 Favored 'General case' 0 CA--C 1.512 -0.489 0 C-N-CA 120.288 -0.565 . . . . 0.0 112.262 173.279 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 25.3 ttpp -61.71 -50.96 70.34 Favored 'General case' 0 N--CA 1.447 -0.582 0 CA-C-N 118.725 0.693 . . . . 0.0 109.479 -178.113 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 83.3 mt -59.83 -46.02 90.56 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-O 120.847 0.356 . . . . 0.0 111.398 178.972 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 8.0 tt -53.31 -55.92 20.78 Favored 'General case' 0 C--N 1.332 -0.168 0 C-N-CA 124.002 0.921 . . . . 0.0 109.518 174.695 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 38.4 mt -54.14 -54.39 40.24 Favored 'General case' 0 C--O 1.226 -0.178 0 C-N-CA 123.517 0.727 . . . . 0.0 109.689 -179.412 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 41.2 mt-30 -51.32 -51.84 50.68 Favored 'General case' 0 N--CA 1.457 -0.087 0 C-N-CA 122.954 0.502 . . . . 0.0 111.432 179.249 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 7.0 m -70.19 -53.95 14.93 Favored 'General case' 0 N--CA 1.455 -0.205 0 CA-C-N 116.485 -0.325 . . . . 0.0 111.149 -172.483 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 42.5 mm-40 -94.05 -34.84 12.85 Favored 'General case' 0 N--CA 1.45 -0.438 0 N-CA-C 113.134 0.79 . . . . 0.0 113.134 -167.671 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 17.3 m-85 . . . . . 0 CA--C 1.53 0.209 0 C-N-CA 122.626 0.37 . . . . 0.0 111.82 -170.571 . . . . . . . . 0 0 . 1 . 011 nuclear nobuild core ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 56.8 tp . . . . . 0 C--O 1.224 -0.265 0 CA-C-O 120.781 0.324 . . . . 0.0 110.254 . . . . . . . . . 0 0 . 1 . 011 nuclear nobuild core ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 5.5 m-20 -56.88 -55.48 33.92 Favored 'General case' 0 N--CA 1.452 -0.325 0 C-N-CA 124.271 1.028 . . . . 0.0 111.313 177.571 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 31.1 mm-40 -59.08 -42.83 91.38 Favored 'General case' 0 C--N 1.331 -0.213 0 O-C-N 122.222 -0.299 . . . . 0.0 111.119 178.692 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 59.1 tp -59.19 -47.42 85.37 Favored 'General case' 0 CA--C 1.531 0.233 0 CA-C-O 121.207 0.527 . . . . 0.0 110.055 176.485 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 50' ' ' PHE . . . . . . . . . . . . . 59.7 t80 -55.03 -49.35 71.78 Favored 'General case' 0 N--CA 1.452 -0.371 0 C-N-CA 123.914 0.885 . . . . 0.0 109.888 178.989 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 78.3 mm-40 -59.2 -46.07 89.4 Favored 'General case' 0 N--CA 1.455 -0.209 0 CA-C-O 120.443 0.163 . . . . 0.0 111.42 175.11 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 36.8 tt0 -52.14 -45.08 64.87 Favored 'General case' 0 CA--C 1.531 0.224 0 C-N-CA 122.735 0.414 . . . . 0.0 111.016 177.651 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 96.4 mt -68.68 -59.58 3.01 Favored 'General case' 0 N--CA 1.451 -0.393 0 C-N-CA 122.982 0.513 . . . . 0.0 110.846 177.655 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 12.0 t0 . . . . . 0 N--CA 1.455 -0.202 0 C-N-CA 125.648 1.579 . . . . 0.0 110.136 178.209 . . . . . . . . 0 0 . 1 . 011 nuclear nobuild core ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 25.6 mt-10 . . . . . 0 N--CA 1.453 -0.299 0 N-CA-C 105.829 -1.915 . . . . 0.0 105.829 . . . . . . . . . 0 0 . 1 . 011 nuclear nobuild core ' A' A ' 61' ' ' VAL . . . . . . . . . . . . . 98.7 t -113.68 110.2 31.27 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.248 0 N-CA-C 108.924 -0.769 . . . . 0.0 108.924 -179.248 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 4.6 m -79.23 163.21 25.16 Favored 'General case' 0 CA--C 1.535 0.39 0 C-N-CA 124.699 1.2 . . . . 0.0 110.648 174.126 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 63' ' ' PHE . . . . . . . . . . . . . 64.9 t80 -58.48 -34.63 71.1 Favored 'General case' 0 N--CA 1.466 0.33 0 N-CA-C 113.084 0.772 . . . . 0.0 113.084 -177.563 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 12.7 tp10 -65.17 -60.63 2.79 Favored 'General case' 0 CA--C 1.533 0.32 0 O-C-N 121.931 -0.481 . . . . 0.0 109.896 178.255 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 9.9 pt-20 -61.83 -30.9 71.14 Favored 'General case' 0 CA--C 1.539 0.52 0 O-C-N 121.376 -0.827 . . . . 0.0 111.679 -178.506 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 20.6 t80 -51.35 -30.53 18.97 Favored 'General case' 0 CA--C 1.535 0.396 0 O-C-N 121.462 -0.774 . . . . 0.0 112.476 169.019 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 67' ' ' GLN . . . . . . . . . . . . . 77.9 mm-40 -55.52 -23.52 26.77 Favored 'General case' 0 CA--C 1.537 0.461 0 CA-C-N 119.723 1.147 . . . . 0.0 112.769 174.224 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 90.7 t -60.35 -33.09 52.67 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.563 0 CA-C-N 119.512 1.051 . . . . 0.0 110.789 172.068 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 3.2 tm? -72.71 -49.69 29.57 Favored 'General case' 0 N--CA 1.457 -0.085 0 N-CA-C 106.997 -1.483 . . . . 0.0 106.997 -179.35 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 70' ' ' VAL . . . . . . . . . . . . . 22.0 t . . . . . 0 CA--C 1.536 0.406 0 C-N-CA 122.845 0.458 . . . . 0.0 109.982 176.705 . . . . . . . . 0 0 . 1 . 012 nuclear nobuild core ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 86.2 Cg_exo . . . . . 0 N--CA 1.458 -0.616 0 CA-C-O 120.571 0.155 . . . . 0.0 112.015 . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild core ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 48.9 mt-10 -62.2 -49.43 75.81 Favored 'General case' 0 N--CA 1.455 -0.191 0 C-N-CA 123.534 0.734 . . . . 0.0 111.105 177.578 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 2.4 tm-20 -62.4 -43.33 99.08 Favored 'General case' 0 CA--C 1.531 0.215 0 N-CA-C 108.414 -0.958 . . . . 0.0 108.414 -179.483 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 31.7 mt -59.99 -39.85 87.15 Favored 'General case' 0 N--CA 1.45 -0.475 0 C-N-CA 124.245 1.018 . . . . 0.0 111.732 176.827 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 54.8 tptt -59.35 -50.46 73.87 Favored 'General case' 0 C--N 1.333 -0.14 0 CA-C-N 118.986 0.812 . . . . 0.0 110.157 170.575 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . -49.22 -53.65 18.57 Favored Glycine 0 CA--C 1.532 1.127 0 N-CA-C 111.246 -0.742 . . . . 0.0 111.246 177.346 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 9' ' ' ILE . . . . . . . . . . . . . 1.6 mm -56.52 -54.49 27.93 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.226 0 C-N-CA 125.81 1.644 . . . . 0.0 109.209 176.565 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 10' ' ' PHE . . . . . . . . . . . . . 19.6 t80 -48.03 -51.35 24.47 Favored 'General case' 0 N--CA 1.447 -0.607 0 C-N-CA 123.304 0.642 . . . . 0.0 109.562 179.574 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 52.8 mt-10 -62.41 -49.89 73.67 Favored 'General case' 0 N--CA 1.455 -0.196 0 C-N-CA 123.374 0.67 . . . . 0.0 110.727 -179.749 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 45.4 tttp -43.78 -50.9 7.63 Favored 'General case' 0 CA--C 1.528 0.098 0 C-N-CA 124.094 0.958 . . . . 0.0 110.87 177.606 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 75.4 m-85 -79.56 -47.92 14.7 Favored 'General case' 0 CA--C 1.528 0.13 0 N-CA-C 111.836 0.31 . . . . 0.0 111.836 -177.937 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -57.07 -31.21 64.98 Favored 'General case' 0 N--CA 1.466 0.354 0 C-N-CA 124.902 1.281 . . . . 0.0 112.859 -178.628 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.421 0 O-C-N 121.872 -0.517 . . . . 0.0 111.472 174.767 . . . . . . . . 0 0 . 1 . 012 nuclear nobuild core ' A' A ' 20' ' ' PRO . . . . . . . . . . . . . 22.9 Cg_endo . . . . . 0 CA--C 1.536 0.593 0 N-CA-C 113.35 0.481 . . . . 0.0 113.35 . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild core ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 41.9 m-80 -94.05 3.28 55.55 Favored 'General case' 0 CA--C 1.533 0.315 0 C-N-CA 125.303 1.441 . . . . 0.0 113.205 -178.487 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 51.0 tt0 -139.59 124.12 18.25 Favored 'General case' 0 CA--C 1.539 0.555 0 CA-C-N 119.109 0.868 . . . . 0.0 112.134 -176.891 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 60.4 mt -100.16 136.55 39.89 Favored 'General case' 0 C--N 1.343 0.311 0 C-N-CA 123.908 0.883 . . . . 0.0 110.667 175.768 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 99.0 p -88.07 175.44 7.74 Favored 'General case' 0 CA--C 1.535 0.371 0 C-N-CA 123.75 0.82 . . . . 0.0 108.956 167.107 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 98.7 mttt -56.28 -46.17 79.85 Favored 'General case' 0 C--O 1.226 -0.148 0 O-C-N 121.968 -0.457 . . . . 0.0 111.288 179.556 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 29.0 tp10 -64.74 -45.14 87.76 Favored 'General case' 0 N--CA 1.455 -0.177 0 CA-C-O 121.034 0.445 . . . . 0.0 110.719 -177.312 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 58.8 mt-10 -56.88 -47.59 80.12 Favored 'General case' 0 N--CA 1.451 -0.42 0 N-CA-C 109.725 -0.472 . . . . 0.0 109.725 176.069 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 16.1 mt -55.86 -43.85 77.51 Favored 'General case' 0 CA--C 1.513 -0.474 0 N-CA-C 112.783 0.66 . . . . 0.0 112.783 170.994 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 63.3 tttp -59.09 -52.27 66.45 Favored 'General case' 0 C--N 1.323 -0.563 0 CA-C-N 118.839 0.745 . . . . 0.0 109.624 -177.145 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 81.2 mt -58.72 -48.97 79.32 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 115.816 -0.629 . . . . 0.0 110.748 178.866 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 9.6 tt -50.64 -55.12 17.86 Favored 'General case' 0 C--O 1.233 0.216 0 C-N-CA 124.007 0.923 . . . . 0.0 110.17 175.914 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 38.3 mt -56.81 -56.85 16.3 Favored 'General case' 0 N--CA 1.456 -0.174 0 C-N-CA 124.061 0.944 . . . . 0.0 110.086 -178.601 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -57.93 -50.37 73.59 Favored 'General case' 0 N--CA 1.455 -0.217 0 C-N-CA 122.552 0.341 . . . . 0.0 110.635 -175.568 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 9.1 m -65.11 -52.49 55.09 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.477 -0.329 . . . . 0.0 111.232 -175.036 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 76.1 mm-40 -103.58 -24.44 13.4 Favored 'General case' 0 N--CA 1.452 -0.348 0 N-CA-C 114.906 1.447 . . . . 0.0 114.906 -165.361 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 46.5 m-85 . . . . . 0 C--O 1.235 0.332 0 CA-C-N 119.263 0.938 . . . . 0.0 112.624 -171.795 . . . . . . . . 0 0 . 1 . 012 nuclear nobuild core ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 18.5 mt . . . . . 0 N--CA 1.451 -0.394 0 N-CA-C 108.152 -1.055 . . . . 0.0 108.152 . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild core ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 5.5 m-20 -54.99 -56.38 20.4 Favored 'General case' 0 N--CA 1.451 -0.424 0 C-N-CA 124.527 1.131 . . . . 0.0 111.633 177.425 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 32.5 mt-10 -55.15 -48.1 74.2 Favored 'General case' 0 C--N 1.334 -0.089 0 C-N-CA 122.097 0.159 . . . . 0.0 110.706 176.377 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 55.9 tp -57.66 -47.6 81.83 Favored 'General case' 0 CA--C 1.532 0.263 0 CA-C-O 121.385 0.612 . . . . 0.0 110.47 179.649 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 50' ' ' PHE . . . . . . . . . . . . . 50.0 t80 -57.04 -48.93 77.34 Favored 'General case' 0 N--CA 1.452 -0.368 0 C-N-CA 124.467 1.107 . . . . 0.0 109.864 -179.874 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 33.9 tt0 -61.76 -40.44 95.17 Favored 'General case' 0 N--CA 1.453 -0.284 0 C-N-CA 122.788 0.435 . . . . 0.0 111.16 177.93 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 70.2 tt0 -59.0 -46.51 87.98 Favored 'General case' 0 C--N 1.331 -0.203 0 C-N-CA 123.092 0.557 . . . . 0.0 110.422 176.384 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 84.4 mt -66.38 -56.29 11.77 Favored 'General case' 0 N--CA 1.452 -0.345 0 C-N-CA 123.465 0.706 . . . . 0.0 111.133 -179.52 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 14.2 t0 . . . . . 0 N--CA 1.453 -0.307 0 C-N-CA 124.376 1.07 . . . . 0.0 108.985 -176.367 . . . . . . . . 0 0 . 1 . 012 nuclear nobuild core ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 42.6 mp0 . . . . . 0 N--CA 1.457 -0.098 0 N-CA-C 105.94 -1.874 . . . . 0.0 105.94 . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild core ' A' A ' 61' ' ' VAL . . . . . . . . . . . . . 39.9 t -118.28 103.79 15.19 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.241 0 N-CA-C 109.136 -0.69 . . . . 0.0 109.136 176.678 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 18.6 t -79.2 167.37 21.07 Favored 'General case' 0 CA--C 1.532 0.282 0 C-N-CA 123.01 0.524 . . . . 0.0 111.345 172.335 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 63' ' ' PHE . . . . . . . . . . . . . 63.1 t80 -60.41 -34.8 74.47 Favored 'General case' 0 CA--C 1.53 0.211 0 C-N-CA 123.204 0.602 . . . . 0.0 112.518 -172.733 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 7.6 tm-20 -64.17 -61.77 2.05 Favored 'General case' 0 CA--C 1.533 0.327 0 N-CA-C 109.476 -0.565 . . . . 0.0 109.476 178.11 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 14.7 pt-20 -59.86 -33.44 71.81 Favored 'General case' 0 CA--C 1.537 0.463 0 O-C-N 121.62 -0.675 . . . . 0.0 111.741 -179.472 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 19.6 t80 -53.03 -25.76 13.48 Favored 'General case' 0 CA--C 1.536 0.415 0 C-N-CA 123.902 0.881 . . . . 0.0 112.897 169.668 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 67' ' ' GLN . . . . . . . . . . . . . 73.2 mm-40 -55.81 -24.75 37.92 Favored 'General case' 0 CA--C 1.538 0.492 0 O-C-N 120.785 -1.197 . . . . 0.0 112.435 171.795 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 74.0 t -61.01 -33.98 58.02 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.547 0 O-C-N 121.086 -1.009 . . . . 0.0 110.339 170.467 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 14.1 tp -73.07 -39.82 65.55 Favored 'General case' 0 C--O 1.225 -0.223 0 O-C-N 120.885 -1.134 . . . . 0.0 108.15 176.494 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 70' ' ' VAL . . . . . . . . . . . . . 40.9 t . . . . . 0 CA--C 1.539 0.544 0 O-C-N 121.939 -0.475 . . . . 0.0 110.54 173.159 . . . . . . . . 0 0 . 1 . 013 nuclear nobuild core ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 82.2 Cg_exo . . . . . 0 N--CA 1.456 -0.726 0 N-CA-C 111.621 -0.184 . . . . 0.0 111.621 . . . . . . . . . 0 0 . 1 . 013 nuclear nobuild core ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 3.1 mp0 -59.39 -50.83 72.43 Favored 'General case' 0 N--CA 1.454 -0.229 0 C-N-CA 123.817 0.847 . . . . 0.0 112.154 176.236 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 15.3 tp10 -57.96 -46.89 84.4 Favored 'General case' 0 N--CA 1.454 -0.239 0 N-CA-C 108.211 -1.033 . . . . 0.0 108.211 178.502 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 25.8 mt -59.59 -37.83 79.6 Favored 'General case' 0 N--CA 1.445 -0.712 0 C-N-CA 124.216 1.007 . . . . 0.0 111.831 179.266 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 1.2 tmtm? -61.86 -48.0 82.51 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 118.843 0.747 . . . . 0.0 109.949 171.94 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . -54.77 -54.67 31.76 Favored Glycine 0 CA--C 1.528 0.867 0 N-CA-C 110.49 -1.044 . . . . 0.0 110.49 178.758 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 9' ' ' ILE . . . . . . . . . . . . . 72.9 mt -50.98 -54.26 11.1 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.184 0 C-N-CA 125.278 1.431 . . . . 0.0 109.967 172.781 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 10' ' ' PHE . . . . . . . . . . . . . 29.5 t80 -51.97 -49.79 62.54 Favored 'General case' 0 N--CA 1.447 -0.609 0 O-C-N 121.715 -0.616 . . . . 0.0 109.719 -176.863 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 54.8 mt-10 -61.85 -53.05 61.18 Favored 'General case' 0 N--CA 1.457 -0.082 0 N-CA-C 110.292 -0.262 . . . . 0.0 110.292 178.847 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 48.9 tttp -44.24 -53.71 6.36 Favored 'General case' 0 C--O 1.227 -0.124 0 C-N-CA 124.52 1.128 . . . . 0.0 110.586 178.064 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 41.8 m-85 -77.4 -41.28 40.63 Favored 'General case' 0 N--CA 1.454 -0.273 0 CA-C-O 119.629 -0.224 . . . . 0.0 111.491 -173.909 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -58.7 -58.73 7.29 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-O 120.848 0.356 . . . . 0.0 110.847 179.036 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.531 0.222 0 C-N-CA 125.121 1.368 . . . . 0.0 113.111 -169.941 . . . . . . . . 0 0 . 1 . 013 nuclear nobuild core ' A' A ' 20' ' ' PRO . . . . . . . . . . . . . 12.9 Cg_endo . . . . . 0 CA--C 1.537 0.657 0 N-CA-C 114.145 0.787 . . . . 0.0 114.145 . . . . . . . . . 0 0 . 1 . 013 nuclear nobuild core ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 44.1 m-80 -88.38 -5.67 58.16 Favored 'General case' 0 CA--C 1.535 0.381 0 C-N-CA 124.912 1.285 . . . . 0.0 113.186 -177.214 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 37.4 tt0 -148.64 119.57 7.64 Favored 'General case' 0 CA--C 1.539 0.556 0 CA-C-N 118.797 0.726 . . . . 0.0 112.82 -169.446 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 69.5 mt -88.98 133.91 34.16 Favored 'General case' 0 C--N 1.343 0.312 0 C-N-CA 124.139 0.976 . . . . 0.0 112.544 -175.529 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 27.9 p -77.83 171.71 14.56 Favored 'General case' 0 C--O 1.235 0.29 0 C-N-CA 123.626 0.77 . . . . 0.0 109.457 168.268 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 97.8 mttt -57.99 -46.76 84.67 Favored 'General case' 0 N--CA 1.454 -0.237 0 N-CA-C 110.156 -0.313 . . . . 0.0 110.156 174.245 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 27.4 tp10 -65.08 -44.45 88.86 Favored 'General case' 0 N--CA 1.453 -0.283 0 CA-C-O 120.89 0.376 . . . . 0.0 110.34 -176.895 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 21.1 mt-10 -56.1 -49.51 73.64 Favored 'General case' 0 CA--C 1.536 0.433 0 N-CA-C 109.443 -0.577 . . . . 0.0 109.443 175.289 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 10.2 mt -55.75 -41.88 74.62 Favored 'General case' 0 CA--C 1.514 -0.405 0 N-CA-C 113.324 0.861 . . . . 0.0 113.324 171.661 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 89.1 tttt -59.81 -53.29 59.65 Favored 'General case' 0 C--N 1.323 -0.566 0 CA-C-N 118.737 0.699 . . . . 0.0 109.8 -178.637 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 82.9 mt -58.27 -46.78 85.39 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.968 178.875 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 6.4 tt -51.15 -57.65 8.19 Favored 'General case' 0 C--N 1.332 -0.156 0 C-N-CA 123.836 0.854 . . . . 0.0 109.9 175.415 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 40.0 mt -54.73 -55.13 33.21 Favored 'General case' 0 C--N 1.331 -0.196 0 C-N-CA 124.27 1.028 . . . . 0.0 109.724 -178.433 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 24.2 mt-30 -53.13 -50.95 63.46 Favored 'General case' 0 N--CA 1.454 -0.245 0 C-N-CA 123.484 0.714 . . . . 0.0 111.343 -177.556 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 1.6 m -73.54 -51.15 17.99 Favored 'General case' 0 CA--C 1.532 0.264 0 C-N-CA 120.174 -0.61 . . . . 0.0 111.322 -173.898 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 45.0 mm-40 -94.4 -29.62 14.89 Favored 'General case' 0 N--CA 1.449 -0.5 0 N-CA-C 113.622 0.971 . . . . 0.0 113.622 -166.123 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 75.4 m-85 . . . . . 0 CA--C 1.534 0.365 0 N-CA-C 113.053 0.76 . . . . 0.0 113.053 -173.249 . . . . . . . . 0 0 . 1 . 013 nuclear nobuild core ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 18.8 mt . . . . . 0 N--CA 1.451 -0.375 0 N-CA-C 108.275 -1.009 . . . . 0.0 108.275 . . . . . . . . . 0 0 . 1 . 013 nuclear nobuild core ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 5.7 m-20 -58.38 -49.07 78.57 Favored 'General case' 0 N--CA 1.447 -0.595 0 CA-C-N 115.006 -0.997 . . . . 0.0 111.39 178.503 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 51.0 mt-10 -57.9 -50.64 72.65 Favored 'General case' 0 C--N 1.333 -0.125 0 CA-C-N 117.379 0.081 . . . . 0.0 110.931 175.962 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 81.6 mt -57.64 -48.34 79.73 Favored 'General case' 0 CA--C 1.531 0.22 0 CA-C-O 121.376 0.608 . . . . 0.0 109.926 -179.936 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 50' ' ' PHE . . . . . . . . . . . . . 54.6 t80 -55.03 -53.29 57.75 Favored 'General case' 0 N--CA 1.45 -0.466 0 C-N-CA 123.882 0.873 . . . . 0.0 109.879 178.965 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 42.8 tt0 -57.51 -45.74 84.62 Favored 'General case' 0 N--CA 1.454 -0.264 0 C-N-CA 122.895 0.478 . . . . 0.0 110.771 179.503 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 8.5 tm-20 -55.99 -45.97 78.83 Favored 'General case' 0 N--CA 1.454 -0.264 0 C-N-CA 122.998 0.519 . . . . 0.0 110.308 179.433 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 95.8 mt -78.25 -38.21 43.38 Favored 'General case' 0 CA--C 1.533 0.299 0 N-CA-C 112.592 0.59 . . . . 0.0 112.592 -175.364 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 27.5 t0 . . . . . 0 C--N 1.33 -0.274 0 C-N-CA 126.876 2.07 . . . . 0.0 109.674 177.607 . . . . . . . . 0 0 . 1 . 013 nuclear nobuild core ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 62.4 mt-10 . . . . . 0 N--CA 1.456 -0.157 0 N-CA-C 108.906 -0.775 . . . . 0.0 108.906 . . . . . . . . . 0 0 . 1 . 013 nuclear nobuild core ' A' A ' 61' ' ' VAL . . . . . . . . . . . . . 2.8 t -83.87 109.77 17.76 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.203 0 O-C-N 122.221 -0.3 . . . . 0.0 111.585 -165.814 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 1.7 m -77.78 153.47 32.82 Favored 'General case' 0 CA--C 1.534 0.352 0 C-N-CA 124.123 0.969 . . . . 0.0 110.741 -177.586 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 63' ' ' PHE . . . . . . . . . . . . . 69.1 t80 -55.31 -38.69 69.0 Favored 'General case' 0 N--CA 1.468 0.472 0 N-CA-C 113.072 0.767 . . . . 0.0 113.072 -174.336 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 12.5 tp10 -61.92 -59.92 4.4 Favored 'General case' 0 CA--C 1.534 0.33 0 O-C-N 121.994 -0.441 . . . . 0.0 110.012 179.865 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 16.6 pt-20 -59.35 -36.19 75.25 Favored 'General case' 0 CA--C 1.535 0.388 0 O-C-N 121.394 -0.816 . . . . 0.0 111.798 179.739 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 23.7 t80 -51.94 -26.24 9.97 Favored 'General case' 0 CA--C 1.54 0.578 0 C-N-CA 123.788 0.835 . . . . 0.0 112.408 171.682 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 67' ' ' GLN . . . . . . . . . . . . . 36.2 mm-40 -53.23 -27.84 24.12 Favored 'General case' 0 CA--C 1.54 0.567 0 O-C-N 120.985 -1.072 . . . . 0.0 113.117 172.625 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 85.8 t -56.22 -30.58 30.21 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.436 0 C-N-CA 122.966 0.506 . . . . 0.0 110.967 173.206 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 16.8 tp -78.17 -51.32 10.4 Favored 'General case' 0 N--CA 1.455 -0.178 0 N-CA-C 109.221 -0.659 . . . . 0.0 109.221 170.664 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 70' ' ' VAL . . . . . . . . . . . . . 84.4 t . . . . . 0 N--CA 1.463 0.22 0 C-N-CA 122.88 0.472 . . . . 0.0 111.591 -175.695 . . . . . . . . 0 0 . 1 . 014 nuclear nobuild core ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 83.9 Cg_exo . . . . . 0 N--CA 1.456 -0.692 0 N-CA-C 112.322 0.085 . . . . 0.0 112.322 . . . . . . . . . 0 0 . 1 . 014 nuclear nobuild core ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 3.1 mp0 -62.54 -48.66 78.52 Favored 'General case' 0 CA--C 1.53 0.202 0 C-N-CA 123.793 0.837 . . . . 0.0 111.917 175.966 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 9.6 tm-20 -60.33 -44.47 95.46 Favored 'General case' 0 CA--C 1.53 0.206 0 N-CA-C 108.739 -0.837 . . . . 0.0 108.739 178.074 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 6' ' ' LEU . . . . . 0.421 HD13 HG22 ' A' ' 70' ' ' VAL . 14.5 mt -60.98 -37.18 81.56 Favored 'General case' 0 N--CA 1.447 -0.6 0 C-N-CA 123.614 0.766 . . . . 0.0 112.568 175.803 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 54.5 tptt -59.24 -47.45 85.29 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 119.232 0.924 . . . . 0.0 109.724 169.752 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . -51.18 -54.21 24.27 Favored Glycine 0 CA--C 1.531 1.072 0 N-CA-C 110.696 -0.962 . . . . 0.0 110.696 176.793 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 9' ' ' ILE . . . . . . . . . . . . . 4.2 mm -54.56 -56.12 11.85 Favored 'Isoleucine or valine' 0 CA--C 1.529 0.166 0 C-N-CA 125.063 1.345 . . . . 0.0 109.321 175.99 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 10' ' ' PHE . . . . . . . . . . . . . 23.2 t80 -49.56 -49.33 46.75 Favored 'General case' 0 N--CA 1.444 -0.753 0 C-N-CA 123.612 0.765 . . . . 0.0 109.772 -178.65 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 52.1 mt-10 -63.35 -48.77 76.55 Favored 'General case' 0 N--CA 1.453 -0.288 0 C-N-CA 123.504 0.722 . . . . 0.0 110.613 179.638 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 64.6 tttt -44.39 -51.84 8.25 Favored 'General case' 0 CA--C 1.53 0.21 0 C-N-CA 123.893 0.877 . . . . 0.0 110.756 176.592 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 83.0 m-85 -80.68 -38.54 28.81 Favored 'General case' 0 CA--C 1.533 0.295 0 N-CA-C 112.379 0.511 . . . . 0.0 112.379 -176.723 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -69.05 -52.63 26.52 Favored 'General case' 0 C--N 1.333 -0.147 0 C-N-CA 123.552 0.741 . . . . 0.0 111.757 -176.908 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.332 -0.188 0 C-N-CA 124.124 0.97 . . . . 0.0 112.255 -178.57 . . . . . . . . 0 0 . 1 . 014 nuclear nobuild core ' A' A ' 20' ' ' PRO . . . . . . . . . . . . . 11.1 Cg_endo . . . . . 0 CA--C 1.537 0.649 0 N-CA-C 114.538 0.938 . . . . 0.0 114.538 . . . . . . . . . 0 0 . 1 . 014 nuclear nobuild core ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 49.2 m-80 -96.56 -1.17 47.6 Favored 'General case' 0 CA--C 1.533 0.3 0 C-N-CA 124.956 1.302 . . . . 0.0 113.314 -177.743 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 30.7 tt0 -141.51 116.98 10.21 Favored 'General case' 0 CA--C 1.538 0.514 0 C-N-CA 123.869 0.868 . . . . 0.0 112.579 -176.712 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 46.9 mt -90.56 136.74 32.87 Favored 'General case' 0 C--N 1.342 0.26 0 C-N-CA 124.564 1.145 . . . . 0.0 110.857 179.875 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 98.0 p -78.5 168.05 20.37 Favored 'General case' 0 CA--C 1.532 0.273 0 N-CA-C 108.572 -0.899 . . . . 0.0 108.572 167.133 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 1.1 ttmp? -59.11 -38.12 78.8 Favored 'General case' 0 CA--C 1.535 0.395 0 O-C-N 122.017 -0.427 . . . . 0.0 110.739 177.985 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 26.9 mt-10 -68.24 -47.49 67.64 Favored 'General case' 0 N--CA 1.454 -0.23 0 CA-C-O 121.162 0.506 . . . . 0.0 110.516 -179.576 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 60.2 mt-10 -58.06 -43.94 87.22 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.027 -0.533 . . . . 0.0 109.814 176.183 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 12.3 mt -54.59 -47.37 73.42 Favored 'General case' 0 CA--C 1.507 -0.676 0 CA-C-N 118.387 0.54 . . . . 0.0 112.233 169.608 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 61.9 tttp -58.83 -47.59 84.31 Favored 'General case' 0 C--N 1.324 -0.531 0 CA-C-N 118.706 0.684 . . . . 0.0 109.876 -177.353 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 90.5 mt -59.75 -49.06 79.21 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.532 -0.304 . . . . 0.0 111.686 177.286 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 6.9 tt -50.62 -58.28 6.21 Favored 'General case' 0 N--CA 1.456 -0.148 0 C-N-CA 124.204 1.002 . . . . 0.0 109.327 175.545 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 42.8 mt -57.98 -52.35 65.87 Favored 'General case' 0 N--CA 1.451 -0.39 0 C-N-CA 123.86 0.864 . . . . 0.0 109.079 -176.291 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 23.6 tt0 -53.85 -51.03 64.92 Favored 'General case' 0 N--CA 1.453 -0.287 0 C-N-CA 123.639 0.776 . . . . 0.0 111.075 -178.204 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 11.4 m -75.65 -45.36 37.6 Favored 'General case' 0 N--CA 1.451 -0.381 0 CA-C-N 115.992 -0.549 . . . . 0.0 110.958 -171.583 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 74.0 mm-40 -94.57 -34.97 12.44 Favored 'General case' 0 N--CA 1.452 -0.357 0 C-N-CA 123.797 0.839 . . . . 0.0 112.406 -169.355 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 73.9 m-85 . . . . . 0 CA--C 1.541 0.606 0 C-N-CA 123.832 0.853 . . . . 0.0 113.108 -169.875 . . . . . . . . 0 0 . 1 . 014 nuclear nobuild core ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 57.4 tp . . . . . 0 CA--C 1.528 0.118 0 CA-C-O 120.984 0.421 . . . . 0.0 110.709 . . . . . . . . . 0 0 . 1 . 014 nuclear nobuild core ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 4.8 m-20 -59.59 -54.04 51.15 Favored 'General case' 0 N--CA 1.45 -0.459 0 C-N-CA 123.905 0.882 . . . . 0.0 110.932 179.252 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 37.0 mt-10 -55.13 -48.52 73.55 Favored 'General case' 0 C--N 1.332 -0.191 0 CA-C-N 116.492 -0.322 . . . . 0.0 110.547 176.262 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 54.9 tp -56.39 -49.79 73.47 Favored 'General case' 0 C--N 1.331 -0.206 0 C-N-CA 123.035 0.534 . . . . 0.0 109.863 -179.904 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 50' ' ' PHE . . . . . . . . . . . . . 59.9 t80 -51.8 -50.42 60.82 Favored 'General case' 0 N--CA 1.453 -0.305 0 C-N-CA 124.041 0.936 . . . . 0.0 110.3 177.69 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 56.9 mm-40 -59.3 -47.5 85.14 Favored 'General case' 0 CA--C 1.534 0.364 0 CA-C-N 117.923 0.329 . . . . 0.0 111.627 175.373 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 39.8 mt-10 -54.81 -36.92 65.47 Favored 'General case' 0 CA--C 1.529 0.137 0 C-N-CA 123.375 0.67 . . . . 0.0 111.688 178.689 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 53.2 mt -75.21 -57.37 3.94 Favored 'General case' 0 N--CA 1.447 -0.611 0 CA-C-N 117.905 0.32 . . . . 0.0 110.626 174.808 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 33.2 t0 . . . . . 0 CA--C 1.536 0.436 0 C-N-CA 124.612 1.165 . . . . 0.0 110.89 -178.947 . . . . . . . . 0 0 . 1 . 014 nuclear nobuild core ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 33.4 mt-10 . . . . . 0 N--CA 1.454 -0.231 0 N-CA-C 105.731 -1.952 . . . . 0.0 105.731 . . . . . . . . . 0 0 . 1 . 014 nuclear nobuild core ' A' A ' 61' ' ' VAL . . . . . . . . . . . . . 25.4 t -109.94 114.63 47.53 Favored 'Isoleucine or valine' 0 N--CA 1.461 0.092 0 N-CA-C 109.419 -0.585 . . . . 0.0 109.419 -179.91 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 2.8 m -78.83 159.21 27.94 Favored 'General case' 0 CA--C 1.535 0.387 0 C-N-CA 123.519 0.728 . . . . 0.0 110.85 176.548 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 63' ' ' PHE . . . . . . . . . . . . . 73.8 t80 -59.17 -31.39 68.95 Favored 'General case' 0 CA--C 1.534 0.329 0 O-C-N 121.036 -1.04 . . . . 0.0 113.341 -176.996 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 29.3 mp0 -68.86 -62.95 1.16 Allowed 'General case' 0 N--CA 1.451 -0.403 0 N-CA-C 108.958 -0.756 . . . . 0.0 108.958 -177.595 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 1.5 pt-20 -59.68 -32.86 70.89 Favored 'General case' 0 CA--C 1.538 0.512 0 O-C-N 121.623 -0.673 . . . . 0.0 112.037 178.0 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 18.5 t80 -48.69 -29.84 4.86 Favored 'General case' 0 CA--C 1.537 0.467 0 O-C-N 121.429 -0.795 . . . . 0.0 112.741 169.194 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 67' ' ' GLN . . . . . . . . . . . . . 69.5 mm-40 -54.63 -22.29 13.09 Favored 'General case' 0 CA--C 1.539 0.543 0 CA-C-N 119.557 1.071 . . . . 0.0 112.872 174.685 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 76.2 t -55.49 -35.54 38.22 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.516 0 CA-C-N 119.751 1.159 . . . . 0.0 110.655 171.166 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 24.6 tp -71.95 -45.47 60.97 Favored 'General case' 0 N--CA 1.454 -0.26 0 N-CA-C 107.286 -1.376 . . . . 0.0 107.286 179.129 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 70' ' ' VAL . . . . . 0.421 HG22 HD13 ' A' ' 6' ' ' LEU . 23.4 t . . . . . 0 CA--C 1.534 0.341 0 C-N-CA 123.036 0.535 . . . . 0.0 110.37 178.708 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 86.7 Cg_exo . . . . . 0 N--CA 1.456 -0.68 0 CA-C-O 120.402 0.084 . . . . 0.0 111.982 . . . . . . . . . 0 0 . 1 . 015 nuclear nobuild core ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 48.0 mt-10 -61.5 -49.54 76.34 Favored 'General case' 0 N--CA 1.456 -0.149 0 C-N-CA 123.587 0.755 . . . . 0.0 111.114 176.501 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 37.8 mm-40 -59.59 -47.18 86.59 Favored 'General case' 0 C--O 1.225 -0.204 0 N-CA-C 109.044 -0.724 . . . . 0.0 109.044 177.638 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 47.5 mt -58.29 -39.66 79.88 Favored 'General case' 0 N--CA 1.447 -0.589 0 C-N-CA 123.462 0.705 . . . . 0.0 111.802 178.857 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 21.8 tptm -61.62 -49.26 77.3 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 118.626 0.648 . . . . 0.0 110.744 171.673 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . -53.61 -52.17 43.57 Favored Glycine 0 CA--C 1.529 0.932 0 N-CA-C 110.272 -1.131 . . . . 0.0 110.272 -179.666 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 9' ' ' ILE . . . . . . . . . . . . . 80.3 mt -53.37 -56.41 8.49 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.245 0 C-N-CA 126.464 1.906 . . . . 0.0 109.704 172.442 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 10' ' ' PHE . . . . . . . . . . . . . 42.1 t80 -49.34 -49.66 43.24 Favored 'General case' 0 N--CA 1.447 -0.586 0 O-C-N 121.82 -0.55 . . . . 0.0 109.618 -178.144 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 52.4 mt-10 -63.65 -51.45 65.12 Favored 'General case' 0 CA--C 1.532 0.25 0 C-N-CA 123.165 0.586 . . . . 0.0 110.801 179.3 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 43.9 tttp -44.79 -51.23 9.64 Favored 'General case' 0 N--CA 1.461 0.113 0 C-N-CA 125.026 1.33 . . . . 0.0 110.909 177.163 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 57.2 m-85 -78.39 -47.37 17.74 Favored 'General case' 0 N--CA 1.448 -0.525 0 CA-C-N 116.362 -0.381 . . . . 0.0 110.355 -175.664 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -54.89 -38.14 67.19 Favored 'General case' 0 C--N 1.331 -0.204 0 C-N-CA 124.21 1.004 . . . . 0.0 112.418 179.218 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.533 0.289 0 O-C-N 121.737 -0.602 . . . . 0.0 111.835 174.157 . . . . . . . . 0 0 . 1 . 015 nuclear nobuild core ' A' A ' 20' ' ' PRO . . . . . . . . . . . . . 32.5 Cg_endo . . . . . 0 N--CA 1.458 -0.578 0 N-CA-C 112.735 0.244 . . . . 0.0 112.735 . . . . . . . . . 0 0 . 1 . 015 nuclear nobuild core ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 43.2 m-80 -83.13 -4.51 58.45 Favored 'General case' 0 N--CA 1.451 -0.39 0 C-N-CA 124.35 1.06 . . . . 0.0 112.884 -177.268 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 26.3 tt0 -145.58 132.4 20.09 Favored 'General case' 0 CA--C 1.54 0.561 0 CA-C-N 119.699 1.136 . . . . 0.0 113.182 -168.771 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 84.7 mt -104.06 133.86 48.29 Favored 'General case' 0 C--N 1.342 0.257 0 C-N-CA 125.591 1.557 . . . . 0.0 110.804 176.941 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 82.4 p -79.77 175.63 10.45 Favored 'General case' 0 N--CA 1.452 -0.356 0 C-N-CA 123.76 0.824 . . . . 0.0 109.017 168.481 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 97.8 mttt -55.46 -46.3 76.82 Favored 'General case' 0 N--CA 1.455 -0.189 0 O-C-N 122.059 -0.401 . . . . 0.0 110.023 170.168 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 19.3 tp10 -64.96 -46.79 80.09 Favored 'General case' 0 N--CA 1.451 -0.422 0 CA-C-O 120.7 0.286 . . . . 0.0 110.353 -175.961 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -58.6 -44.08 89.78 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-O 118.806 -0.616 . . . . 0.0 110.45 175.822 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 14.2 mt -56.27 -44.58 79.88 Favored 'General case' 0 CA--C 1.509 -0.6 0 CA-C-N 119.273 0.942 . . . . 0.0 112.539 170.484 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 61.7 tttm -59.96 -49.66 76.81 Favored 'General case' 0 N--CA 1.449 -0.525 0 CA-C-N 118.572 0.624 . . . . 0.0 109.555 -177.849 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 9.2 mp -57.83 -49.64 75.98 Favored 'General case' 0 C--N 1.329 -0.292 0 C-N-CA 122.312 0.245 . . . . 0.0 111.376 177.591 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 7.3 tt -50.23 -57.79 7.04 Favored 'General case' 0 C--N 1.332 -0.166 0 C-N-CA 123.957 0.903 . . . . 0.0 109.552 176.051 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 38.0 mt -59.35 -49.15 78.92 Favored 'General case' 0 C--O 1.222 -0.376 0 C-N-CA 123.513 0.725 . . . . 0.0 109.622 -176.747 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 24.6 tt0 -56.96 -45.84 82.57 Favored 'General case' 0 N--CA 1.452 -0.349 0 C-N-CA 124.222 1.009 . . . . 0.0 110.885 -176.911 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 2.6 m -75.77 -52.34 10.65 Favored 'General case' 0 CA--C 1.533 0.318 0 C-N-CA 120.961 -0.296 . . . . 0.0 110.879 -177.107 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 58.4 mm-40 -90.15 -28.18 19.1 Favored 'General case' 0 N--CA 1.449 -0.483 0 N-CA-C 113.093 0.775 . . . . 0.0 113.093 -166.687 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 76.9 m-85 . . . . . 0 CA--C 1.538 0.518 0 C-N-CA 123.965 0.906 . . . . 0.0 112.949 -173.252 . . . . . . . . 0 0 . 1 . 015 nuclear nobuild core ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 62.9 tp . . . . . 0 N--CA 1.454 -0.247 0 CA-C-O 120.697 0.284 . . . . 0.0 111.078 . . . . . . . . . 0 0 . 1 . 015 nuclear nobuild core ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 6.0 m-20 -57.81 -54.75 43.41 Favored 'General case' 0 N--CA 1.451 -0.416 0 C-N-CA 123.792 0.837 . . . . 0.0 111.008 178.279 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 46.0 mt-10 -54.31 -47.77 72.07 Favored 'General case' 0 C--N 1.332 -0.158 0 CA-C-N 116.802 -0.181 . . . . 0.0 110.868 177.739 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 48.7 tp -60.4 -48.26 82.51 Favored 'General case' 0 N--CA 1.453 -0.315 0 CA-C-O 121.348 0.594 . . . . 0.0 109.632 -179.411 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 50' ' ' PHE . . . . . . . . . . . . . 59.2 t80 -53.98 -49.31 69.1 Favored 'General case' 0 N--CA 1.449 -0.483 0 C-N-CA 123.331 0.653 . . . . 0.0 110.266 178.848 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 34.7 mt-10 -60.9 -43.34 98.67 Favored 'General case' 0 N--CA 1.455 -0.209 0 C-N-CA 122.719 0.408 . . . . 0.0 110.996 177.648 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 32.7 tt0 -52.74 -42.31 64.79 Favored 'General case' 0 CA--C 1.529 0.172 0 C-N-CA 122.933 0.493 . . . . 0.0 110.708 176.456 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 82.1 mt -75.36 -63.12 1.35 Allowed 'General case' 0 N--CA 1.45 -0.471 0 C-N-CA 123.062 0.545 . . . . 0.0 111.229 179.046 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 29.4 t70 . . . . . 0 C--N 1.332 -0.181 0 C-N-CA 125.406 1.482 . . . . 0.0 108.711 -179.207 . . . . . . . . 0 0 . 1 . 015 nuclear nobuild core ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 45.7 mt-10 . . . . . 0 N--CA 1.454 -0.24 0 N-CA-C 106.637 -1.616 . . . . 0.0 106.637 . . . . . . . . . 0 0 . 1 . 015 nuclear nobuild core ' A' A ' 61' ' ' VAL . . . . . . . . . . . . . 73.0 t -111.59 106.56 21.0 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.236 0 C-N-CA 122.742 0.417 . . . . 0.0 110.161 -169.541 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 53.8 p -82.56 160.73 22.49 Favored 'General case' 0 CA--C 1.539 0.544 0 C-N-CA 123.875 0.87 . . . . 0.0 111.343 173.557 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 63' ' ' PHE . . . . . . . . . . . . . 49.7 t80 -51.16 -49.93 59.93 Favored 'General case' 0 N--CA 1.468 0.426 0 O-C-N 121.422 -0.799 . . . . 0.0 111.417 -173.921 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 12.5 pt-20 -53.26 -28.57 28.28 Favored 'General case' 0 CA--C 1.534 0.342 0 C-N-CA 124.654 1.181 . . . . 0.0 114.145 -178.373 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 14.3 pt-20 -100.15 -30.25 12.04 Favored 'General case' 0 CA--C 1.529 0.167 0 C-N-CA 123.593 0.757 . . . . 0.0 110.432 177.88 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 5.3 t80 -52.62 -32.42 41.6 Favored 'General case' 0 CA--C 1.535 0.372 0 O-C-N 121.412 -0.805 . . . . 0.0 110.121 167.687 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 67' ' ' GLN . . . . . . . . . . . . . 0.8 OUTLIER -46.44 -34.66 4.9 Favored 'General case' 0 CA--C 1.538 0.507 0 N-CA-C 113.747 1.018 . . . . 0.0 113.747 169.15 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 77.1 t -61.23 -29.54 46.04 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.541 0 CA-C-N 119.104 0.865 . . . . 0.0 110.667 175.945 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 1.4 tt -71.98 -50.69 26.65 Favored 'General case' 0 N--CA 1.455 -0.188 0 N-CA-C 106.447 -1.686 . . . . 0.0 106.447 178.14 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 70' ' ' VAL . . . . . . . . . . . . . 18.3 t . . . . . 0 CA--C 1.535 0.389 0 C-N-CA 122.819 0.448 . . . . 0.0 110.175 177.701 . . . . . . . . 0 0 . 1 . 016 nuclear nobuild core ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 80.0 Cg_exo . . . . . 0 N--CA 1.456 -0.702 0 N-CA-C 112.378 0.107 . . . . 0.0 112.378 . . . . . . . . . 0 0 . 1 . 016 nuclear nobuild core ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 2.8 mp0 -59.82 -49.35 78.07 Favored 'General case' 0 N--CA 1.456 -0.136 0 C-N-CA 123.956 0.902 . . . . 0.0 111.981 176.055 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 30.1 mt-10 -60.16 -45.44 93.06 Favored 'General case' 0 C--N 1.332 -0.188 0 N-CA-C 109.109 -0.7 . . . . 0.0 109.109 176.886 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 16.1 mt -61.52 -36.19 79.85 Favored 'General case' 0 N--CA 1.447 -0.579 0 C-N-CA 123.014 0.526 . . . . 0.0 112.28 179.17 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 55.8 tptt -61.31 -49.47 76.89 Favored 'General case' 0 C--N 1.329 -0.286 0 O-C-N 121.737 -0.602 . . . . 0.0 110.074 169.942 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . -50.65 -51.43 33.14 Favored Glycine 0 CA--C 1.531 1.067 0 N-CA-C 110.724 -0.95 . . . . 0.0 110.724 176.639 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 9' ' ' ILE . . . . . . . . . . . . . 3.4 mm -57.11 -55.53 20.0 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.197 0 C-N-CA 125.859 1.663 . . . . 0.0 109.417 176.628 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 10' ' ' PHE . . . . . . . . . . . . . 56.1 t80 -46.48 -52.22 13.66 Favored 'General case' 0 N--CA 1.45 -0.45 0 C-N-CA 123.49 0.716 . . . . 0.0 109.763 178.436 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 51.9 mt-10 -62.43 -50.87 69.78 Favored 'General case' 0 N--CA 1.454 -0.256 0 C-N-CA 123.214 0.606 . . . . 0.0 110.772 -179.614 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 18.1 ttmm -43.81 -53.76 5.73 Favored 'General case' 0 C--N 1.339 0.146 0 C-N-CA 124.657 1.183 . . . . 0.0 110.686 177.446 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 66.0 m-85 -78.24 -47.55 17.69 Favored 'General case' 0 N--CA 1.453 -0.32 0 C-N-CA 120.814 -0.355 . . . . 0.0 110.753 -175.922 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -52.84 -42.55 65.28 Favored 'General case' 0 C--N 1.329 -0.309 0 C-N-CA 123.493 0.717 . . . . 0.0 111.976 -179.116 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.332 -0.169 0 N-CA-C 113.367 0.877 . . . . 0.0 113.367 178.616 . . . . . . . . 0 0 . 1 . 016 nuclear nobuild core ' A' A ' 20' ' ' PRO . . . . . . . . . . . . . 19.5 Cg_endo . . . . . 0 CA--C 1.535 0.555 0 N-CA-C 114.315 0.852 . . . . 0.0 114.315 . . . . . . . . . 0 0 . 1 . 016 nuclear nobuild core ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 50.7 m-80 -84.9 -6.35 59.34 Favored 'General case' 0 CA--C 1.533 0.321 0 CA-C-O 118.321 -0.847 . . . . 0.0 112.833 -178.654 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 17.6 tt0 -152.11 118.69 5.68 Favored 'General case' 0 CA--C 1.537 0.444 0 CA-C-N 119.66 1.118 . . . . 0.0 113.664 -167.929 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 52.0 mt -83.72 131.34 34.93 Favored 'General case' 0 N--CA 1.453 -0.292 0 C-N-CA 123.935 0.894 . . . . 0.0 111.186 177.764 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 92.2 p -79.71 175.63 10.45 Favored 'General case' 0 CA--C 1.536 0.431 0 N-CA-C 108.339 -0.986 . . . . 0.0 108.339 167.06 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 63.4 mttp -57.14 -41.92 79.98 Favored 'General case' 0 C--N 1.34 0.161 0 O-C-N 121.772 -0.58 . . . . 0.0 110.017 170.932 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 1.7 mp0 -63.67 -52.19 61.8 Favored 'General case' 0 N--CA 1.452 -0.366 0 C-N-CA 123.142 0.577 . . . . 0.0 110.214 -177.317 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -58.44 -41.59 85.44 Favored 'General case' 0 CA--C 1.536 0.406 0 CA-C-N 115.8 -0.636 . . . . 0.0 109.642 177.881 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 12.1 mt -56.2 -43.7 78.75 Favored 'General case' 0 C--O 1.219 -0.515 0 CA-C-N 119.174 0.897 . . . . 0.0 112.859 169.286 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 59.2 tttp -61.99 -45.93 91.47 Favored 'General case' 0 C--N 1.322 -0.593 0 CA-C-N 119.075 0.852 . . . . 0.0 110.19 -177.192 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 4.4 mm? -60.17 -50.92 71.79 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.148 -0.478 . . . . 0.0 111.159 175.556 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 7.7 tt -51.17 -55.21 19.08 Favored 'General case' 0 C--N 1.333 -0.111 0 C-N-CA 123.575 0.75 . . . . 0.0 109.711 176.876 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 47.2 mt -55.7 -56.29 22.15 Favored 'General case' 0 N--CA 1.451 -0.385 0 C-N-CA 124.346 1.058 . . . . 0.0 109.67 -177.647 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 27.5 mt-30 -55.28 -51.54 66.34 Favored 'General case' 0 N--CA 1.457 -0.086 0 CA-C-N 117.943 0.338 . . . . 0.0 111.232 -177.868 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 5.7 m -72.81 -45.8 56.52 Favored 'General case' 0 N--CA 1.451 -0.402 0 CA-C-N 116.15 -0.477 . . . . 0.0 111.077 -170.016 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 69.6 mm-40 -98.99 -39.05 8.74 Favored 'General case' 0 N--CA 1.451 -0.423 0 C-N-CA 123.757 0.823 . . . . 0.0 112.886 -169.365 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 16.8 m-85 . . . . . 0 CA--C 1.531 0.235 0 C-N-CA 123.167 0.587 . . . . 0.0 111.505 -170.867 . . . . . . . . 0 0 . 1 . 016 nuclear nobuild core ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 19.8 mt . . . . . 0 N--CA 1.453 -0.307 0 N-CA-C 108.773 -0.825 . . . . 0.0 108.773 . . . . . . . . . 0 0 . 1 . 016 nuclear nobuild core ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 5.9 m-20 -60.25 -48.88 79.87 Favored 'General case' 0 N--CA 1.449 -0.523 0 CA-C-N 115.081 -0.963 . . . . 0.0 111.014 -179.448 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 7.9 tm-20 -64.79 -43.26 93.77 Favored 'General case' 0 N--CA 1.453 -0.317 0 N-CA-C 109.839 -0.43 . . . . 0.0 109.839 179.328 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 59.8 tp -57.34 -49.73 75.19 Favored 'General case' 0 C--N 1.333 -0.141 0 N-CA-C 109.657 -0.497 . . . . 0.0 109.657 176.829 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 50' ' ' PHE . . . . . . . . . . . . . 57.3 t80 -52.2 -46.24 65.54 Favored 'General case' 0 N--CA 1.452 -0.367 0 C-N-CA 124.043 0.937 . . . . 0.0 109.595 176.223 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 26.6 tt0 -56.66 -49.34 75.35 Favored 'General case' 0 N--CA 1.453 -0.299 0 CA-C-O 119.735 -0.174 . . . . 0.0 111.383 174.739 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 50.4 mt-10 -51.99 -47.92 64.65 Favored 'General case' 0 N--CA 1.465 0.3 0 CA-C-N 118.159 0.436 . . . . 0.0 111.353 177.582 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 80.8 mt -64.6 -55.51 19.86 Favored 'General case' 0 N--CA 1.452 -0.365 0 CA-C-O 121.269 0.557 . . . . 0.0 110.631 179.777 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 13.0 t70 . . . . . 0 N--CA 1.452 -0.333 0 C-N-CA 126.954 2.102 . . . . 0.0 108.992 -171.093 . . . . . . . . 0 0 . 1 . 016 nuclear nobuild core ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 53.6 mt-10 . . . . . 0 N--CA 1.453 -0.325 0 N-CA-C 106.764 -1.569 . . . . 0.0 106.764 . . . . . . . . . 0 0 . 1 . 016 nuclear nobuild core ' A' A ' 61' ' ' VAL . . . . . . . . . . . . . 90.1 t -109.54 102.12 13.55 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.273 0 N-CA-C 109.794 -0.447 . . . . 0.0 109.794 -170.634 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 98.7 p -77.99 170.73 16.11 Favored 'General case' 0 CA--C 1.539 0.556 0 C-N-CA 123.196 0.598 . . . . 0.0 110.609 173.193 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 63' ' ' PHE . . . . . . . . . . . . . 54.9 t80 -59.61 -41.56 90.64 Favored 'General case' 0 CA--C 1.531 0.227 0 O-C-N 121.661 -0.65 . . . . 0.0 112.572 -172.313 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 1.9 pp20? -59.08 -57.65 12.13 Favored 'General case' 0 CA--C 1.534 0.362 0 O-C-N 121.942 -0.474 . . . . 0.0 110.918 179.782 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 10.8 pt-20 -62.42 -35.13 78.26 Favored 'General case' 0 CA--C 1.535 0.372 0 O-C-N 121.694 -0.629 . . . . 0.0 111.599 179.296 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 14.2 t80 -49.81 -34.02 18.34 Favored 'General case' 0 CA--C 1.536 0.442 0 O-C-N 121.343 -0.848 . . . . 0.0 112.47 169.53 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 67' ' ' GLN . . . . . . . . . . . . . 98.9 mm-40 -60.39 -23.26 64.19 Favored 'General case' 0 CA--C 1.537 0.459 0 O-C-N 120.697 -1.252 . . . . 0.0 112.68 176.311 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 58.5 t -62.77 -29.43 47.03 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.502 0 O-C-N 120.918 -1.114 . . . . 0.0 110.215 170.69 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 1.8 tt -72.38 -46.3 55.92 Favored 'General case' 0 N--CA 1.457 -0.095 0 N-CA-C 106.769 -1.567 . . . . 0.0 106.769 177.571 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 70' ' ' VAL . . . . . . . . . . . . . 36.3 t . . . . . 0 CA--C 1.538 0.502 0 O-C-N 121.952 -0.468 . . . . 0.0 110.525 175.499 . . . . . . . . 0 0 . 1 . 017 nuclear nobuild core ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 83.4 Cg_exo . . . . . 0 N--CA 1.458 -0.572 0 N-CA-C 113.001 0.346 . . . . 0.0 113.001 . . . . . . . . . 0 0 . 1 . 017 nuclear nobuild core ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 3.0 mp0 -59.35 -47.87 83.78 Favored 'General case' 0 N--CA 1.455 -0.216 0 C-N-CA 123.934 0.894 . . . . 0.0 111.93 176.164 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 36.9 mt-10 -62.95 -43.97 97.35 Favored 'General case' 0 N--CA 1.453 -0.304 0 N-CA-C 109.349 -0.611 . . . . 0.0 109.349 178.41 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 47.7 mt -60.88 -39.7 90.22 Favored 'General case' 0 N--CA 1.45 -0.466 0 C-N-CA 123.386 0.674 . . . . 0.0 111.528 177.921 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 27.5 tptp -59.38 -46.17 89.43 Favored 'General case' 0 C--N 1.331 -0.215 0 O-C-N 121.806 -0.559 . . . . 0.0 110.348 170.05 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . -54.66 -53.51 38.61 Favored Glycine 0 CA--C 1.529 0.933 0 N-CA-C 110.338 -1.105 . . . . 0.0 110.338 179.129 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 9' ' ' ILE . . . . . . . . . . . . . 46.5 mt -51.33 -56.51 4.99 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.145 0 C-N-CA 125.641 1.576 . . . . 0.0 109.88 172.206 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 10' ' ' PHE . . . . . . . . . . . . . 49.1 t80 -49.24 -50.71 37.38 Favored 'General case' 0 N--CA 1.446 -0.673 0 N-CA-C 109.925 -0.398 . . . . 0.0 109.925 -178.438 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 57.3 mt-10 -61.99 -52.94 61.98 Favored 'General case' 0 CA--C 1.531 0.219 0 C-N-CA 122.444 0.298 . . . . 0.0 110.712 179.249 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 24.7 ttpt -43.32 -53.82 5.02 Favored 'General case' 0 C--N 1.339 0.126 0 C-N-CA 124.92 1.288 . . . . 0.0 110.736 178.645 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 66.6 m-85 -77.78 -47.63 18.5 Favored 'General case' 0 N--CA 1.45 -0.443 0 CA-C-N 116.578 -0.283 . . . . 0.0 110.408 -175.839 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -58.87 -37.18 75.95 Favored 'General case' 0 C--N 1.33 -0.275 0 O-C-N 121.417 -0.802 . . . . 0.0 112.743 -175.857 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.454 -0.269 0 N-CA-C 112.211 0.448 . . . . 0.0 112.211 176.464 . . . . . . . . 0 0 . 1 . 017 nuclear nobuild core ' A' A ' 20' ' ' PRO . . . . . . . . . . . . . 16.5 Cg_endo . . . . . 0 CA--C 1.539 0.726 0 N-CA-C 113.519 0.546 . . . . 0.0 113.519 . . . . . . . . . 0 0 . 1 . 017 nuclear nobuild core ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 37.0 m-80 -92.01 -4.1 54.95 Favored 'General case' 0 N--CA 1.454 -0.275 0 C-N-CA 124.694 1.197 . . . . 0.0 111.937 -178.025 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 7.4 tt0 -155.13 116.66 4.05 Favored 'General case' 0 CA--C 1.539 0.533 0 CA-C-N 118.838 0.744 . . . . 0.0 112.485 -168.392 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 26.0 mt -78.29 131.49 37.09 Favored 'General case' 0 N--CA 1.455 -0.191 0 C-N-CA 123.127 0.571 . . . . 0.0 111.352 -172.642 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -77.77 158.86 29.39 Favored 'General case' 0 CA--C 1.54 0.56 0 C-N-CA 126.377 1.871 . . . . 0.0 108.867 168.766 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 31.7 ttmt -60.28 -46.02 91.29 Favored 'General case' 0 CA--C 1.534 0.342 0 O-C-N 121.546 -0.721 . . . . 0.0 112.098 -170.471 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 57.6 mm-40 -65.61 -41.35 92.85 Favored 'General case' 0 N--CA 1.454 -0.241 0 CA-C-O 121.729 0.776 . . . . 0.0 110.199 -179.216 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 4.6 mp0 -57.79 -48.08 80.73 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-N 115.527 -0.76 . . . . 0.0 109.219 175.756 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 5.0 mt -52.91 -45.33 67.55 Favored 'General case' 0 C--O 1.219 -0.546 0 N-CA-C 113.097 0.777 . . . . 0.0 113.097 168.24 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 5.7 ttpm? -58.51 -50.96 71.85 Favored 'General case' 0 C--N 1.324 -0.505 0 CA-C-N 118.883 0.765 . . . . 0.0 110.636 -178.947 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 4.1 mm? -59.58 -46.78 87.92 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.169 -0.469 . . . . 0.0 111.212 177.766 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 6.8 tt -51.45 -58.17 6.99 Favored 'General case' 0 N--CA 1.455 -0.212 0 C-N-CA 124.031 0.933 . . . . 0.0 109.064 174.787 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 38.7 mt -54.02 -58.55 6.88 Favored 'General case' 0 C--N 1.33 -0.259 0 C-N-CA 123.708 0.803 . . . . 0.0 109.421 -178.021 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 1.1 tm0? -52.56 -53.55 44.8 Favored 'General case' 0 N--CA 1.453 -0.288 0 C-N-CA 123.514 0.726 . . . . 0.0 111.2 -177.401 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 11.1 m -73.24 -47.56 42.17 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.657 -0.247 . . . . 0.0 110.997 -171.105 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 69.3 mm-40 -90.69 -37.93 13.41 Favored 'General case' 0 N--CA 1.448 -0.548 0 C-N-CA 123.647 0.779 . . . . 0.0 112.021 -169.033 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 87.0 m-85 . . . . . 0 CA--C 1.531 0.247 0 C-N-CA 123.855 0.862 . . . . 0.0 111.784 -170.614 . . . . . . . . 0 0 . 1 . 017 nuclear nobuild core ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 50.5 tp . . . . . 0 N--CA 1.454 -0.265 0 N-CA-C 109.909 -0.404 . . . . 0.0 109.909 . . . . . . . . . 0 0 . 1 . 017 nuclear nobuild core ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 6.1 m-20 -57.28 -53.74 54.66 Favored 'General case' 0 N--CA 1.448 -0.563 0 C-N-CA 123.907 0.883 . . . . 0.0 111.08 177.28 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 14.7 tp10 -55.93 -49.17 74.24 Favored 'General case' 0 C--N 1.332 -0.193 0 N-CA-C 110.123 -0.325 . . . . 0.0 110.123 178.741 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 43.5 tp -59.41 -47.95 83.51 Favored 'General case' 0 CA--C 1.532 0.254 0 CA-C-O 121.304 0.573 . . . . 0.0 110.152 -179.882 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 50' ' ' PHE . . . . . . . . . . . . . 74.3 t80 -55.53 -49.05 73.66 Favored 'General case' 0 N--CA 1.451 -0.378 0 C-N-CA 124.165 0.986 . . . . 0.0 110.534 178.423 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 32.9 mt-10 -59.06 -49.29 78.44 Favored 'General case' 0 N--CA 1.455 -0.208 0 C-N-CA 123.217 0.607 . . . . 0.0 110.591 177.34 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 30.5 tp10 -53.92 -44.88 70.95 Favored 'General case' 0 N--CA 1.456 -0.167 0 C-N-CA 123.463 0.705 . . . . 0.0 110.977 178.544 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 95.1 mt -72.37 -47.53 48.72 Favored 'General case' 0 N--CA 1.45 -0.453 0 CA-C-O 120.802 0.334 . . . . 0.0 111.495 -179.767 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 37.7 t0 . . . . . 0 CA--C 1.533 0.303 0 C-N-CA 124.412 1.085 . . . . 0.0 110.267 -179.942 . . . . . . . . 0 0 . 1 . 017 nuclear nobuild core ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 51.2 mt-10 . . . . . 0 CA--C 1.534 0.348 0 N-CA-C 106.15 -1.796 . . . . 0.0 106.15 . . . . . . . . . 0 0 . 1 . 017 nuclear nobuild core ' A' A ' 61' ' ' VAL . . . . . . . . . . . . . 26.5 t -108.8 115.67 50.0 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.455 0 CA-C-N 118.706 0.685 . . . . 0.0 110.896 -175.833 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -78.92 150.85 32.0 Favored 'General case' 0 CA--C 1.537 0.45 0 C-N-CA 124.863 1.265 . . . . 0.0 111.362 179.411 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 63' ' ' PHE . . . . . . . . . . . . . 66.7 t80 -51.53 -44.7 62.71 Favored 'General case' 0 N--CA 1.468 0.427 0 O-C-N 121.446 -0.784 . . . . 0.0 112.586 -173.746 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 2.9 pm0 -59.77 -31.15 69.39 Favored 'General case' 0 N--CA 1.449 -0.524 0 N-CA-C 113.092 0.775 . . . . 0.0 113.092 -179.395 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 21.6 pt-20 -95.04 -27.65 15.51 Favored 'General case' 0 CA--C 1.531 0.222 0 CA-C-N 118.679 0.672 . . . . 0.0 110.797 179.001 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 9.5 t80 -53.21 -25.66 14.78 Favored 'General case' 0 CA--C 1.536 0.426 0 C-N-CA 123.6 0.76 . . . . 0.0 110.201 166.992 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 67' ' ' GLN . . . . . . . . . . . . . 66.4 mm-40 -51.58 -25.04 6.13 Favored 'General case' 0 CA--C 1.538 0.5 0 N-CA-C 113.633 0.975 . . . . 0.0 113.633 169.869 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 99.4 t -60.86 -33.06 53.9 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.556 0 CA-C-N 119.653 1.115 . . . . 0.0 110.735 172.136 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 10.5 tt -72.16 -46.16 57.53 Favored 'General case' 0 N--CA 1.457 -0.117 0 N-CA-C 107.056 -1.461 . . . . 0.0 107.056 176.694 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 70' ' ' VAL . . . . . . . . . . . . . 21.6 t . . . . . 0 CA--C 1.537 0.457 0 N-CA-C 110.272 -0.27 . . . . 0.0 110.272 176.775 . . . . . . . . 0 0 . 1 . 018 nuclear nobuild core ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 82.6 Cg_exo . . . . . 0 CA--C 1.536 0.625 0 CA-C-O 120.688 0.203 . . . . 0.0 112.14 . . . . . . . . . 0 0 . 1 . 018 nuclear nobuild core ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 42.3 tt0 -58.31 -53.84 53.74 Favored 'General case' 0 N--CA 1.455 -0.175 0 C-N-CA 123.777 0.831 . . . . 0.0 111.189 177.022 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 47.0 mm-40 -62.84 -40.95 99.01 Favored 'General case' 0 N--CA 1.452 -0.367 0 N-CA-C 109.149 -0.686 . . . . 0.0 109.149 -179.265 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 40.8 mt -59.49 -38.16 80.14 Favored 'General case' 0 N--CA 1.448 -0.558 0 C-N-CA 124.286 1.035 . . . . 0.0 111.896 176.609 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 23.2 tptm -60.66 -49.92 75.58 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-N 119.069 0.85 . . . . 0.0 110.712 169.982 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . -53.45 -52.96 37.82 Favored Glycine 0 CA--C 1.531 1.039 0 N-CA-C 110.519 -1.032 . . . . 0.0 110.519 -179.542 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 9' ' ' ILE . . . . . . . . . . . . . 78.3 mt -51.89 -57.25 3.83 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.259 0 C-N-CA 126.081 1.752 . . . . 0.0 109.935 172.044 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 10' ' ' PHE . . . . . . . . . . . . . 44.4 t80 -48.84 -50.03 36.47 Favored 'General case' 0 N--CA 1.446 -0.663 0 N-CA-C 109.239 -0.652 . . . . 0.0 109.239 -177.389 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 51.0 mt-10 -61.61 -53.25 58.67 Favored 'General case' 0 CA--C 1.532 0.268 0 C-N-CA 123.047 0.539 . . . . 0.0 110.717 178.709 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 1.4 ttpm? -45.14 -50.74 11.05 Favored 'General case' 0 C--N 1.34 0.167 0 C-N-CA 124.197 0.999 . . . . 0.0 110.979 178.075 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 54.6 m-85 -77.74 -52.87 8.26 Favored 'General case' 0 N--CA 1.448 -0.561 0 N-CA-C 110.072 -0.344 . . . . 0.0 110.072 -175.397 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -50.41 -37.67 38.99 Favored 'General case' 0 C--N 1.33 -0.253 0 C-N-CA 125.278 1.431 . . . . 0.0 112.762 -179.79 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.535 0.379 0 C-N-CA 123.309 0.644 . . . . 0.0 111.874 173.832 . . . . . . . . 0 0 . 1 . 018 nuclear nobuild core ' A' A ' 20' ' ' PRO . . . . . . . . . . . . . 29.4 Cg_endo . . . . . 0 N--CA 1.461 -0.437 0 N-CA-C 113.365 0.486 . . . . 0.0 113.365 . . . . . . . . . 0 0 . 1 . 018 nuclear nobuild core ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 42.7 m-80 -79.85 -4.92 54.29 Favored 'General case' 0 N--CA 1.45 -0.435 0 CA-C-O 117.849 -1.072 . . . . 0.0 112.74 -178.194 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 28.1 tt0 -147.57 135.08 20.83 Favored 'General case' 0 CA--C 1.539 0.536 0 CA-C-N 119.758 1.163 . . . . 0.0 113.385 -168.717 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 81.9 mt -104.17 133.12 49.63 Favored 'General case' 0 C--N 1.343 0.317 0 C-N-CA 125.171 1.389 . . . . 0.0 111.154 177.524 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 78.8 p -80.4 174.78 11.27 Favored 'General case' 0 CA--C 1.533 0.304 0 C-N-CA 123.876 0.87 . . . . 0.0 108.929 168.297 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 60.1 mttp -56.43 -40.97 75.64 Favored 'General case' 0 C--N 1.34 0.16 0 O-C-N 122.043 -0.411 . . . . 0.0 110.215 169.97 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 26.4 mt-10 -68.56 -47.1 67.7 Favored 'General case' 0 CA--C 1.517 -0.299 0 CA-C-O 120.813 0.339 . . . . 0.0 110.242 -175.764 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -56.97 -46.91 81.86 Favored 'General case' 0 N--CA 1.453 -0.312 0 CA-C-N 115.986 -0.552 . . . . 0.0 109.751 174.815 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 12.1 mt -56.27 -43.77 79.08 Favored 'General case' 0 CA--C 1.512 -0.518 0 CA-C-N 119.035 0.834 . . . . 0.0 112.988 171.827 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 65.1 tttm -61.58 -48.31 81.52 Favored 'General case' 0 C--N 1.323 -0.573 0 CA-C-N 118.672 0.669 . . . . 0.0 109.697 -176.726 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 92.0 mt -61.51 -46.7 88.86 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.232 -0.44 . . . . 0.0 111.3 177.763 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 7.1 tt -50.1 -58.16 6.13 Favored 'General case' 0 CA--C 1.521 -0.147 0 C-N-CA 124.213 1.005 . . . . 0.0 109.443 174.577 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 45.1 mt -57.68 -53.09 62.07 Favored 'General case' 0 N--CA 1.45 -0.433 0 N-CA-C 109.091 -0.707 . . . . 0.0 109.091 -178.332 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 25.5 tt0 -52.74 -47.13 67.62 Favored 'General case' 0 N--CA 1.453 -0.309 0 O-C-N 121.651 -0.656 . . . . 0.0 111.879 -177.41 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 2.5 m -75.46 -51.27 13.42 Favored 'General case' 0 CA--C 1.534 0.358 0 C-N-CA 121.058 -0.257 . . . . 0.0 111.144 -176.21 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 38.8 mm-40 -90.69 -31.25 16.67 Favored 'General case' 0 N--CA 1.451 -0.425 0 C-N-CA 123.6 0.76 . . . . 0.0 112.828 -166.724 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 82.2 m-85 . . . . . 0 CA--C 1.537 0.45 0 C-N-CA 124.863 1.265 . . . . 0.0 111.581 -172.801 . . . . . . . . 0 0 . 1 . 018 nuclear nobuild core ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 20.3 mt . . . . . 0 C--O 1.223 -0.309 0 N-CA-C 108.645 -0.872 . . . . 0.0 108.645 . . . . . . . . . 0 0 . 1 . 018 nuclear nobuild core ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 5.1 m-20 -52.28 -60.59 3.03 Favored 'General case' 0 N--CA 1.449 -0.504 0 C-N-CA 124.311 1.044 . . . . 0.0 110.32 176.161 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 34.2 tt0 -53.64 -46.54 70.56 Favored 'General case' 0 N--CA 1.455 -0.205 0 O-C-N 122.425 -0.172 . . . . 0.0 110.806 179.863 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 87.9 mt -56.38 -49.68 73.76 Favored 'General case' 0 C--O 1.224 -0.277 0 C-N-CA 121.069 -0.252 . . . . 0.0 110.384 176.632 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 50' ' ' PHE . . . . . . . . . . . . . 55.0 t80 -54.67 -51.61 64.94 Favored 'General case' 0 C--N 1.329 -0.319 0 C-N-CA 124.567 1.147 . . . . 0.0 110.45 -178.927 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 1.8 mp0 -56.13 -48.25 76.58 Favored 'General case' 0 CA--C 1.531 0.245 0 CA-C-O 120.641 0.258 . . . . 0.0 110.548 174.784 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 37.0 tt0 -55.23 -43.77 74.85 Favored 'General case' 0 N--CA 1.456 -0.155 0 C-N-CA 123.047 0.539 . . . . 0.0 111.437 -179.745 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 48.3 mt -65.64 -56.59 11.36 Favored 'General case' 0 N--CA 1.448 -0.573 0 N-CA-C 109.838 -0.43 . . . . 0.0 109.838 176.028 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 47.2 t0 . . . . . 0 CA--C 1.532 0.255 0 C-N-CA 123.856 0.862 . . . . 0.0 110.909 -174.601 . . . . . . . . 0 0 . 1 . 018 nuclear nobuild core ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 50.9 mt-10 . . . . . 0 CA--C 1.529 0.149 0 N-CA-C 107.99 -1.115 . . . . 0.0 107.99 . . . . . . . . . 0 0 . 1 . 018 nuclear nobuild core ' A' A ' 61' ' ' VAL . . . . . . . . . . . . . 5.5 t -112.18 106.13 20.15 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.295 0 CA-C-N 118.129 0.422 . . . . 0.0 111.017 -169.621 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 59.9 p -78.87 167.72 20.75 Favored 'General case' 0 CA--C 1.539 0.531 0 C-N-CA 122.995 0.518 . . . . 0.0 111.322 173.578 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 63' ' ' PHE . . . . . . . . . . . . . 57.2 t80 -60.93 -38.15 84.81 Favored 'General case' 0 CA--C 1.533 0.294 0 O-C-N 121.447 -0.783 . . . . 0.0 112.754 -172.81 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 1.9 pp20? -63.95 -56.66 13.52 Favored 'General case' 0 CA--C 1.536 0.408 0 O-C-N 121.8 -0.562 . . . . 0.0 111.061 -178.926 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 9.1 pt-20 -60.55 -36.86 79.46 Favored 'General case' 0 CA--C 1.537 0.443 0 O-C-N 121.425 -0.797 . . . . 0.0 111.408 176.805 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 21.5 t80 -52.32 -26.87 13.31 Favored 'General case' 0 CA--C 1.538 0.489 0 O-C-N 121.551 -0.718 . . . . 0.0 112.209 170.938 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 67' ' ' GLN . . . . . . . . . . . . . 58.6 mm-40 -55.04 -23.21 18.83 Favored 'General case' 0 CA--C 1.535 0.37 0 CA-C-N 119.768 1.167 . . . . 0.0 113.43 172.821 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 92.7 t -58.59 -32.95 47.19 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.555 0 CA-C-N 119.861 1.21 . . . . 0.0 110.468 171.428 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 22.1 tp -73.81 -48.43 31.42 Favored 'General case' 0 N--CA 1.453 -0.304 0 N-CA-C 107.404 -1.332 . . . . 0.0 107.404 176.976 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 70' ' ' VAL . . . . . . . . . . . . . 38.4 t . . . . . 0 CA--C 1.537 0.476 0 C-N-CA 122.543 0.337 . . . . 0.0 110.67 179.501 . . . . . . . . 0 0 . 1 . 019 nuclear nobuild core ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 90.3 Cg_exo . . . . . 0 N--CA 1.455 -0.765 0 N-CA-C 112.972 0.335 . . . . 0.0 112.972 . . . . . . . . . 0 0 . 1 . 019 nuclear nobuild core ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 19.0 mt-10 -67.58 -49.0 65.23 Favored 'General case' 0 N--CA 1.455 -0.18 0 CA-C-O 121.302 0.572 . . . . 0.0 110.273 -178.145 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 5.6 mp0 -65.51 -43.18 90.9 Favored 'General case' 0 N--CA 1.452 -0.353 0 N-CA-C 107.835 -1.172 . . . . 0.0 107.835 178.821 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 14.7 mt -57.2 -37.81 72.73 Favored 'General case' 0 N--CA 1.452 -0.341 0 N-CA-C 112.321 0.489 . . . . 0.0 112.321 177.012 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 55.7 tptt -61.83 -51.15 69.44 Favored 'General case' 0 C--N 1.332 -0.152 0 CA-C-N 118.873 0.76 . . . . 0.0 110.967 170.366 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . -52.51 -50.76 46.8 Favored Glycine 0 CA--C 1.531 1.051 0 N-CA-C 110.521 -1.032 . . . . 0.0 110.521 179.869 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 9' ' ' ILE . . . . . . . . . . . . . 88.0 mt -54.79 -54.75 20.26 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.298 0 C-N-CA 126.663 1.985 . . . . 0.0 109.923 173.745 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 10' ' ' PHE . . . . . . . . . . . . . 52.0 t80 -48.63 -52.8 21.29 Favored 'General case' 0 N--CA 1.453 -0.279 0 CA-C-N 118.29 0.495 . . . . 0.0 109.807 179.081 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 52.5 mt-10 -61.26 -52.69 63.7 Favored 'General case' 0 N--CA 1.455 -0.221 0 C-N-CA 123.075 0.55 . . . . 0.0 110.271 -177.986 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 25.9 ttpt -47.79 -57.74 5.23 Favored 'General case' 0 CA--C 1.53 0.191 0 C-N-CA 124.624 1.17 . . . . 0.0 110.838 177.409 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 38.6 m-85 -75.28 -34.62 61.35 Favored 'General case' 0 N--CA 1.45 -0.474 0 CA-C-O 119.193 -0.432 . . . . 0.0 110.522 -170.105 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -57.31 -63.95 1.05 Allowed 'General case' 0 N--CA 1.453 -0.299 0 N-CA-C 109.422 -0.585 . . . . 0.0 109.422 170.87 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.529 0.143 0 C-N-CA 125.311 1.445 . . . . 0.0 112.682 -177.154 . . . . . . . . 0 0 . 1 . 019 nuclear nobuild core ' A' A ' 20' ' ' PRO . . . . . . . . . . . . . 11.9 Cg_endo . . . . . 0 CA--C 1.535 0.574 0 N-CA-C 114.824 1.048 . . . . 0.0 114.824 . . . . . . . . . 0 0 . 1 . 019 nuclear nobuild core ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 58.0 m-80 -84.2 3.76 33.73 Favored 'General case' 0 CA--C 1.531 0.222 0 C-N-CA 124.008 0.923 . . . . 0.0 112.017 -178.021 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 0.7 OUTLIER -151.02 127.51 10.73 Favored 'General case' 0 N--CA 1.452 -0.368 0 O-C-N 121.395 -0.816 . . . . 0.0 112.629 -169.223 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 80.8 mt -93.44 129.43 39.61 Favored 'General case' 0 N--CA 1.452 -0.372 0 C-N-CA 122.883 0.473 . . . . 0.0 111.11 171.222 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 41.3 p -78.92 174.12 11.85 Favored 'General case' 0 CA--C 1.534 0.343 0 C-N-CA 124.255 1.022 . . . . 0.0 108.577 166.952 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 98.4 mttt -57.9 -44.84 87.0 Favored 'General case' 0 C--O 1.226 -0.153 0 O-C-N 121.837 -0.539 . . . . 0.0 110.483 172.408 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 24.3 mt-10 -66.73 -42.66 85.94 Favored 'General case' 0 N--CA 1.454 -0.253 0 CA-C-O 121.282 0.563 . . . . 0.0 110.168 -176.713 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 26.6 mt-10 -58.39 -49.42 77.31 Favored 'General case' 0 N--CA 1.451 -0.4 0 CA-C-N 115.738 -0.664 . . . . 0.0 109.211 176.152 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 10.7 mt -54.08 -42.73 69.65 Favored 'General case' 0 CA--C 1.512 -0.483 0 N-CA-C 113.28 0.845 . . . . 0.0 113.28 169.868 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 5.9 ttpm? -60.46 -53.04 62.33 Favored 'General case' 0 C--N 1.323 -0.554 0 CA-C-N 118.637 0.653 . . . . 0.0 109.845 -177.641 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 10.5 mp -59.16 -44.85 92.14 Favored 'General case' 0 C--O 1.235 0.301 0 CA-C-O 120.647 0.261 . . . . 0.0 111.294 178.433 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 6.5 tt -51.14 -57.89 7.56 Favored 'General case' 0 N--CA 1.456 -0.125 0 C-N-CA 123.682 0.793 . . . . 0.0 109.6 174.242 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 43.3 mt -54.86 -54.05 47.45 Favored 'General case' 0 N--CA 1.455 -0.203 0 C-N-CA 124.052 0.941 . . . . 0.0 109.956 -178.887 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 42.7 mt-30 -50.25 -53.11 30.61 Favored 'General case' 0 N--CA 1.457 -0.096 0 C-N-CA 123.098 0.559 . . . . 0.0 111.363 179.732 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 2.0 m -73.22 -49.64 26.83 Favored 'General case' 0 N--CA 1.454 -0.264 0 C-N-CA 120.28 -0.568 . . . . 0.0 111.259 -172.015 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 62.0 mm-40 -95.78 -31.02 13.39 Favored 'General case' 0 N--CA 1.449 -0.509 0 N-CA-C 113.382 0.882 . . . . 0.0 113.382 -166.644 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 67.9 m-85 . . . . . 0 CA--C 1.536 0.415 0 N-CA-C 113.198 0.814 . . . . 0.0 113.198 -171.577 . . . . . . . . 0 0 . 1 . 019 nuclear nobuild core ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 20.9 mt . . . . . 0 N--CA 1.452 -0.35 0 N-CA-C 107.961 -1.126 . . . . 0.0 107.961 . . . . . . . . . 0 0 . 1 . 019 nuclear nobuild core ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 5.3 m-20 -53.26 -57.07 11.82 Favored 'General case' 0 N--CA 1.449 -0.509 0 C-N-CA 124.812 1.245 . . . . 0.0 111.345 177.294 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 29.9 mm-40 -55.48 -45.88 76.95 Favored 'General case' 0 C--N 1.333 -0.135 0 O-C-N 122.438 -0.164 . . . . 0.0 110.924 177.447 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 1.1 tt -57.02 -50.0 74.08 Favored 'General case' 0 CA--C 1.537 0.46 0 CA-C-O 121.827 0.822 . . . . 0.0 109.854 178.306 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 50' ' ' PHE . . . . . . . . . . . . . 55.6 t80 -55.5 -50.64 69.39 Favored 'General case' 0 N--CA 1.45 -0.463 0 C-N-CA 125.078 1.351 . . . . 0.0 110.222 -179.195 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 74.6 mm-40 -59.38 -43.16 92.93 Favored 'General case' 0 N--CA 1.454 -0.229 0 CA-C-O 120.6 0.238 . . . . 0.0 111.317 176.185 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 7.7 tm-20 -54.26 -44.36 71.76 Favored 'General case' 0 CA--C 1.531 0.242 0 C-N-CA 122.374 0.27 . . . . 0.0 110.614 177.255 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 85.0 mt -69.43 -62.04 1.54 Allowed 'General case' 0 N--CA 1.453 -0.32 0 C-N-CA 122.436 0.295 . . . . 0.0 111.251 176.86 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 12.6 t0 . . . . . 0 N--CA 1.455 -0.192 0 C-N-CA 124.961 1.304 . . . . 0.0 109.39 178.999 . . . . . . . . 0 0 . 1 . 019 nuclear nobuild core ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 33.2 mt-10 . . . . . 0 CA--C 1.529 0.135 0 N-CA-C 106.233 -1.766 . . . . 0.0 106.233 . . . . . . . . . 0 0 . 1 . 019 nuclear nobuild core ' A' A ' 61' ' ' VAL . . . . . . . . . . . . . 46.6 t -112.1 108.63 25.99 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.318 0 CA-C-N 118.118 0.417 . . . . 0.0 110.591 -171.905 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 1.8 m -76.27 158.85 31.15 Favored 'General case' 0 CA--C 1.536 0.429 0 C-N-CA 125.517 1.527 . . . . 0.0 110.552 170.785 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 63' ' ' PHE . . . . . . . . . . . . . 54.7 t80 -53.12 -48.14 68.1 Favored 'General case' 0 CA--C 1.533 0.29 0 O-C-N 121.665 -0.647 . . . . 0.0 111.914 -174.47 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 2.8 pm0 -61.32 -25.46 67.15 Favored 'General case' 0 CA--C 1.537 0.458 0 N-CA-C 113.871 1.063 . . . . 0.0 113.871 -177.324 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 9.0 pt-20 -90.73 -37.81 13.45 Favored 'General case' 0 CA--C 1.532 0.279 0 CA-C-N 118.81 0.732 . . . . 0.0 109.225 174.977 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 9.5 t80 -51.5 -33.31 30.95 Favored 'General case' 0 CA--C 1.538 0.481 0 O-C-N 121.609 -0.682 . . . . 0.0 110.716 167.391 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 67' ' ' GLN . . . . . . . . . . . . . 60.5 mm-40 -54.09 -23.04 12.47 Favored 'General case' 0 CA--C 1.538 0.503 0 O-C-N 120.841 -1.162 . . . . 0.0 113.495 174.145 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 92.1 t -62.72 -34.46 65.65 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.584 0 CA-C-N 120.039 1.29 . . . . 0.0 110.304 171.454 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 9.1 tt -71.96 -42.29 66.74 Favored 'General case' 0 N--CA 1.456 -0.152 0 N-CA-C 107.402 -1.333 . . . . 0.0 107.402 177.505 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 70' ' ' VAL . . . . . . . . . . . . . 64.4 t . . . . . 0 CA--C 1.532 0.271 0 O-C-N 121.908 -0.495 . . . . 0.0 111.148 173.942 . . . . . . . . 0 0 . 1 . 020 nuclear nobuild core ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 53.4 Cg_exo . . . . . 0 N--CA 1.459 -0.508 0 N-CA-C 114.989 1.111 . . . . 0.0 114.989 . . . . . . . . . 0 0 . 1 . 020 nuclear nobuild core ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 46.3 mt-10 -60.75 -41.3 95.14 Favored 'General case' 0 CA--C 1.532 0.265 0 CA-C-O 121.323 0.582 . . . . 0.0 111.293 179.989 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 10.4 mp0 -69.41 -42.24 75.32 Favored 'General case' 0 N--CA 1.451 -0.414 0 N-CA-C 107.633 -1.247 . . . . 0.0 107.633 -178.688 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 18.7 mt -58.24 -38.71 77.39 Favored 'General case' 0 N--CA 1.448 -0.539 0 CA-C-O 119.075 -0.488 . . . . 0.0 111.674 173.004 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 2.1 tmtt? -62.88 -48.67 77.99 Favored 'General case' 0 CA--C 1.533 0.297 0 CA-C-N 119.111 0.869 . . . . 0.0 109.955 173.844 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . -54.78 -51.51 52.41 Favored Glycine 0 CA--C 1.533 1.2 0 N-CA-C 111.092 -0.803 . . . . 0.0 111.092 177.946 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 9' ' ' ILE . . . . . . . . . . . . . 3.2 mm -56.27 -50.23 72.4 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.262 0 C-N-CA 125.714 1.606 . . . . 0.0 109.359 175.549 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 10' ' ' PHE . . . . . . . . . . . . . 25.6 t80 -51.66 -49.94 61.35 Favored 'General case' 0 N--CA 1.444 -0.745 0 O-C-N 121.689 -0.632 . . . . 0.0 109.3 178.126 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 68.8 mt-10 -60.6 -50.77 72.21 Favored 'General case' 0 CA--C 1.531 0.241 0 CA-C-O 119.065 -0.493 . . . . 0.0 111.36 178.836 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 20.3 tptm -39.79 -53.98 2.17 Favored 'General case' 0 N--CA 1.464 0.238 0 C-N-CA 124.568 1.147 . . . . 0.0 110.941 175.466 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 79.0 m-85 -81.9 -46.85 13.51 Favored 'General case' 0 N--CA 1.454 -0.235 0 N-CA-C 111.655 0.242 . . . . 0.0 111.655 -176.172 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -54.25 -38.19 65.5 Favored 'General case' 0 C--N 1.329 -0.311 0 C-N-CA 124.413 1.085 . . . . 0.0 112.309 -179.333 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.534 0.362 0 C-N-CA 122.961 0.504 . . . . 0.0 111.697 174.132 . . . . . . . . 0 0 . 1 . 020 nuclear nobuild core ' A' A ' 20' ' ' PRO . . . . . . . . . . . . . 30.0 Cg_endo . . . . . 0 N--CA 1.458 -0.61 0 N-CA-C 112.985 0.34 . . . . 0.0 112.985 . . . . . . . . . 0 0 . 1 . 020 nuclear nobuild core ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 40.6 m-80 -87.36 -4.93 59.05 Favored 'General case' 0 N--CA 1.453 -0.307 0 C-N-CA 125.032 1.333 . . . . 0.0 113.27 -176.778 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 29.8 tt0 -140.75 134.11 29.78 Favored 'General case' 0 CA--C 1.541 0.61 0 CA-C-N 119.109 0.868 . . . . 0.0 112.754 -170.713 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 81.8 mt -108.8 136.36 48.49 Favored 'General case' 0 C--N 1.344 0.361 0 C-N-CA 125.339 1.455 . . . . 0.0 111.426 178.09 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 73.0 p -81.09 174.81 11.22 Favored 'General case' 0 CA--C 1.532 0.263 0 C-N-CA 124.29 1.036 . . . . 0.0 109.388 168.794 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 98.3 mttt -57.13 -46.6 82.54 Favored 'General case' 0 C--O 1.226 -0.156 0 O-C-N 122.088 -0.382 . . . . 0.0 110.129 172.143 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 45.2 tt0 -64.53 -46.2 83.93 Favored 'General case' 0 N--CA 1.452 -0.348 0 N-CA-C 110.2 -0.296 . . . . 0.0 110.2 -177.037 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -59.33 -44.63 92.58 Favored 'General case' 0 N--CA 1.45 -0.433 0 C-N-CA 120.256 -0.577 . . . . 0.0 109.872 176.97 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 11.3 mt -56.77 -43.57 80.96 Favored 'General case' 0 CA--C 1.511 -0.538 0 CA-C-N 119.168 0.894 . . . . 0.0 113.014 170.865 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 63.0 tttm -59.96 -52.3 66.0 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-N 118.754 0.706 . . . . 0.0 109.483 -178.425 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 10.3 mp -58.31 -47.83 82.45 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 116.36 -0.382 . . . . 0.0 110.92 179.237 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 7.4 tt -50.64 -58.4 5.94 Favored 'General case' 0 N--CA 1.455 -0.19 0 C-N-CA 123.531 0.732 . . . . 0.0 109.83 175.331 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 47.7 mt -54.94 -57.7 10.59 Favored 'General case' 0 C--N 1.332 -0.174 0 C-N-CA 123.654 0.782 . . . . 0.0 109.448 -177.708 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 53.0 tt0 -61.55 -45.41 94.28 Favored 'General case' 0 N--CA 1.449 -0.499 0 C-N-CA 124.729 1.212 . . . . 0.0 111.169 -170.888 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 17.9 m -76.41 -48.75 18.7 Favored 'General case' 0 N--CA 1.451 -0.377 0 CA-C-N 116.341 -0.39 . . . . 0.0 110.738 -175.191 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 71.7 mm-40 -93.26 -32.5 14.31 Favored 'General case' 0 N--CA 1.449 -0.496 0 N-CA-C 112.646 0.61 . . . . 0.0 112.646 -168.108 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 85.7 m-85 . . . . . 0 CA--C 1.53 0.203 0 C-N-CA 123.761 0.825 . . . . 0.0 110.668 -176.251 . . . . . . . . 0 0 . 1 . 020 nuclear nobuild core ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 59.5 tp . . . . . 0 C--O 1.223 -0.307 0 N-CA-C 110.517 -0.179 . . . . 0.0 110.517 . . . . . . . . . 0 0 . 1 . 020 nuclear nobuild core ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 5.4 m-20 -57.84 -56.5 21.22 Favored 'General case' 0 N--CA 1.452 -0.367 0 C-N-CA 124.16 0.984 . . . . 0.0 111.132 178.182 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 33.4 mt-10 -54.63 -45.7 73.79 Favored 'General case' 0 CA--C 1.53 0.187 0 CA-C-O 120.883 0.373 . . . . 0.0 110.93 176.614 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -57.88 -51.54 69.17 Favored 'General case' 0 CA--C 1.532 0.263 0 N-CA-C 109.17 -0.678 . . . . 0.0 109.17 179.596 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 50' ' ' PHE . . . . . . . . . . . . . 68.8 t80 -53.32 -50.41 65.03 Favored 'General case' 0 N--CA 1.453 -0.307 0 C-N-CA 125.143 1.377 . . . . 0.0 110.404 178.667 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 33.1 mt-10 -55.73 -48.91 74.41 Favored 'General case' 0 CA--C 1.531 0.222 0 C-N-CA 122.974 0.51 . . . . 0.0 110.658 176.799 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 33.4 tp10 -55.99 -45.43 78.98 Favored 'General case' 0 CA--C 1.531 0.214 0 C-N-CA 123.184 0.593 . . . . 0.0 111.375 177.284 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 32.0 mt -66.32 -45.09 81.51 Favored 'General case' 0 N--CA 1.45 -0.45 0 O-C-N 122.054 -0.404 . . . . 0.0 111.778 179.138 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 51.9 t0 . . . . . 0 CA--C 1.539 0.542 0 C-N-CA 124.961 1.305 . . . . 0.0 111.315 -174.185 . . . . . . . . 0 0 . 1 . 020 nuclear nobuild core ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 50.4 mt-10 . . . . . 0 N--CA 1.453 -0.287 0 N-CA-C 106.859 -1.534 . . . . 0.0 106.859 . . . . . . . . . 0 0 . 1 . 020 nuclear nobuild core ' A' A ' 61' ' ' VAL . . . . . . . . . . . . . 3.7 t -108.77 112.3 39.83 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.174 0 N-CA-C 109.767 -0.456 . . . . 0.0 109.767 -171.186 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 78.1 p -78.62 158.21 28.5 Favored 'General case' 0 CA--C 1.536 0.438 0 C-N-CA 122.804 0.441 . . . . 0.0 110.874 176.369 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 63' ' ' PHE . . . . . . . . . . . . . 69.6 t80 -55.21 -34.09 63.62 Favored 'General case' 0 N--CA 1.468 0.458 0 N-CA-C 113.248 0.833 . . . . 0.0 113.248 -177.81 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 45.7 mm-40 -65.2 -60.37 3.08 Favored 'General case' 0 N--CA 1.451 -0.424 0 O-C-N 121.85 -0.531 . . . . 0.0 109.822 179.735 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 12.8 pt-20 -66.1 -28.45 68.83 Favored 'General case' 0 CA--C 1.537 0.462 0 O-C-N 121.14 -0.975 . . . . 0.0 111.391 -177.421 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 15.9 t80 -51.85 -25.58 8.15 Favored 'General case' 0 CA--C 1.536 0.406 0 C-N-CA 123.8 0.84 . . . . 0.0 112.345 169.016 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 67' ' ' GLN . . . . . . . . . . . . . 59.3 mm-40 -54.09 -25.62 22.82 Favored 'General case' 0 CA--C 1.541 0.607 0 CA-C-N 119.532 1.06 . . . . 0.0 112.859 172.593 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 97.0 t -56.4 -33.93 39.62 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.543 0 O-C-N 121.369 -0.832 . . . . 0.0 110.853 171.626 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 25.1 tp -75.04 -47.65 27.93 Favored 'General case' 0 N--CA 1.457 -0.108 0 N-CA-C 107.993 -1.114 . . . . 0.0 107.993 175.159 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 70' ' ' VAL . . . . . . . . . . . . . 84.5 t . . . . . 0 CA--C 1.531 0.242 0 C-N-CA 122.46 0.304 . . . . 0.0 111.112 -179.793 . . . . . . . . 0 0 . 1 . 021 nuclear nobuild core ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 96.0 Cg_exo . . . . . 0 N--CA 1.458 -0.618 0 N-CA-C 113.038 0.361 . . . . 0.0 113.038 . . . . . . . . . 0 0 . 1 . 021 nuclear nobuild core ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 35.1 tt0 -62.67 -45.14 94.17 Favored 'General case' 0 N--CA 1.454 -0.266 0 C-N-CA 122.82 0.448 . . . . 0.0 111.464 178.839 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 6.9 mp0 -70.34 -40.86 73.85 Favored 'General case' 0 N--CA 1.451 -0.405 0 N-CA-C 108.35 -0.982 . . . . 0.0 108.35 179.532 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 7.3 mt -56.3 -38.35 71.14 Favored 'General case' 0 N--CA 1.452 -0.336 0 C-N-CA 122.786 0.434 . . . . 0.0 111.751 175.03 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 22.8 tptm -61.8 -54.31 44.07 Favored 'General case' 0 C--N 1.333 -0.144 0 CA-C-N 118.961 0.801 . . . . 0.0 111.083 170.508 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . -49.87 -48.71 37.05 Favored Glycine 0 CA--C 1.534 1.254 0 N-CA-C 111.202 -0.759 . . . . 0.0 111.202 178.846 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 9' ' ' ILE . . . . . . . . . . . . . 2.8 mm -59.59 -54.44 34.46 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.315 0 C-N-CA 127.156 2.182 . . . . 0.0 109.209 176.999 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 10' ' ' PHE . . . . . . . . . . . . . 55.8 t80 -46.96 -53.07 13.15 Favored 'General case' 0 N--CA 1.45 -0.45 0 N-CA-C 109.45 -0.574 . . . . 0.0 109.45 177.744 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 50.4 mt-10 -59.72 -52.67 64.48 Favored 'General case' 0 N--CA 1.454 -0.251 0 C-N-CA 123.015 0.526 . . . . 0.0 110.55 179.666 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 44.5 tttp -44.13 -52.82 6.97 Favored 'General case' 0 CA--C 1.528 0.12 0 C-N-CA 124.567 1.147 . . . . 0.0 111.307 178.375 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 69.9 m-85 -78.39 -46.41 20.0 Favored 'General case' 0 CA--C 1.532 0.287 0 C-N-CA 121.182 -0.207 . . . . 0.0 110.877 -175.88 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -56.59 -31.94 64.74 Favored 'General case' 0 CA--C 1.535 0.382 0 C-N-CA 125.019 1.327 . . . . 0.0 112.583 -179.778 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.452 -0.373 0 O-C-N 121.68 -0.638 . . . . 0.0 112.419 176.095 . . . . . . . . 0 0 . 1 . 021 nuclear nobuild core ' A' A ' 20' ' ' PRO . . . . . . . . . . . . . 18.9 Cg_endo . . . . . 0 CA--C 1.534 0.499 0 N-CA-C 113.621 0.585 . . . . 0.0 113.621 . . . . . . . . . 0 0 . 1 . 021 nuclear nobuild core ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 69.0 m-80 -79.83 -20.18 46.67 Favored 'General case' 0 N--CA 1.452 -0.367 0 C-N-CA 124.306 1.042 . . . . 0.0 113.075 -178.541 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 12.0 tt0 -154.13 124.32 6.9 Favored 'General case' 0 CA--C 1.538 0.481 0 CA-C-N 119.147 0.885 . . . . 0.0 112.631 -168.098 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 42.6 mt -81.65 141.2 33.87 Favored 'General case' 0 C--O 1.234 0.276 0 C-N-CA 124.083 0.953 . . . . 0.0 112.101 -177.775 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 90.5 p -86.57 173.08 9.8 Favored 'General case' 0 CA--C 1.537 0.442 0 C-N-CA 124.42 1.088 . . . . 0.0 109.373 167.312 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 92.9 mttt -55.0 -44.18 74.27 Favored 'General case' 0 C--O 1.225 -0.224 0 O-C-N 121.814 -0.554 . . . . 0.0 110.731 173.685 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 46.4 mp0 -66.02 -50.27 64.82 Favored 'General case' 0 N--CA 1.45 -0.443 0 CA-C-O 121.389 0.614 . . . . 0.0 109.769 -174.136 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 65.5 mt-10 -53.13 -48.88 67.54 Favored 'General case' 0 N--CA 1.451 -0.376 0 CA-C-N 114.874 -1.057 . . . . 0.0 109.867 174.131 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 11.5 mt -57.18 -40.67 77.81 Favored 'General case' 0 CA--C 1.514 -0.418 0 N-CA-C 113.386 0.884 . . . . 0.0 113.386 172.959 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 5.1 ttpm? -63.23 -49.72 73.05 Favored 'General case' 0 C--N 1.322 -0.601 0 CA-C-N 118.817 0.735 . . . . 0.0 109.836 -177.572 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 4.1 mm? -60.01 -48.52 81.38 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.752 177.369 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 8.6 tt -50.26 -56.81 9.59 Favored 'General case' 0 N--CA 1.456 -0.143 0 C-N-CA 123.869 0.867 . . . . 0.0 109.568 175.476 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 39.1 mt -55.73 -58.63 7.02 Favored 'General case' 0 C--N 1.331 -0.22 0 C-N-CA 123.696 0.798 . . . . 0.0 109.58 -178.809 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 23.0 tt0 -55.9 -47.48 77.38 Favored 'General case' 0 N--CA 1.452 -0.328 0 C-N-CA 123.231 0.612 . . . . 0.0 111.337 -174.171 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 12.7 m -76.98 -45.82 26.12 Favored 'General case' 0 N--CA 1.451 -0.381 0 CA-C-N 116.224 -0.444 . . . . 0.0 111.229 -172.538 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 71.3 mm-40 -97.35 -33.37 11.45 Favored 'General case' 0 N--CA 1.451 -0.42 0 N-CA-C 112.685 0.624 . . . . 0.0 112.685 -168.32 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 54.2 m-85 . . . . . 0 C--O 1.236 0.343 0 C-N-CA 123.521 0.728 . . . . 0.0 111.409 -174.408 . . . . . . . . 0 0 . 1 . 021 nuclear nobuild core ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 52.0 tp . . . . . 0 C--O 1.224 -0.249 0 N-CA-C 110.058 -0.349 . . . . 0.0 110.058 . . . . . . . . . 0 0 . 1 . 021 nuclear nobuild core ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 6.6 m-20 -53.16 -61.18 2.47 Favored 'General case' 0 N--CA 1.448 -0.563 0 C-N-CA 124.053 0.941 . . . . 0.0 110.588 175.7 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 25.5 mt-10 -51.33 -49.89 60.52 Favored 'General case' 0 C--N 1.332 -0.169 0 N-CA-C 111.308 0.114 . . . . 0.0 111.308 178.765 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 8.8 mp -55.87 -48.08 76.2 Favored 'General case' 0 C--N 1.334 -0.105 0 CA-C-O 120.747 0.308 . . . . 0.0 110.454 178.032 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 50' ' ' PHE . . . . . . . . . . . . . 63.8 t80 -58.34 -48.94 78.95 Favored 'General case' 0 N--CA 1.448 -0.533 0 C-N-CA 123.198 0.599 . . . . 0.0 110.481 -178.989 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 1.2 mp0 -56.77 -50.27 72.8 Favored 'General case' 0 N--CA 1.455 -0.224 0 N-CA-C 110.51 -0.182 . . . . 0.0 110.51 176.854 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 39.1 mt-10 -54.04 -47.18 71.86 Favored 'General case' 0 CA--C 1.529 0.166 0 CA-C-O 121.1 0.476 . . . . 0.0 110.972 178.597 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 90.8 mt -68.96 -42.38 76.71 Favored 'General case' 0 N--CA 1.451 -0.424 0 C-N-CA 123.509 0.724 . . . . 0.0 111.931 -177.05 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 52.5 t0 . . . . . 0 CA--C 1.537 0.461 0 C-N-CA 124.286 1.034 . . . . 0.0 111.31 -175.545 . . . . . . . . 0 0 . 1 . 021 nuclear nobuild core ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 35.3 mt-10 . . . . . 0 CA--C 1.533 0.322 0 N-CA-C 106.809 -1.552 . . . . 0.0 106.809 . . . . . . . . . 0 0 . 1 . 021 nuclear nobuild core ' A' A ' 61' ' ' VAL . . . . . . . . . . . . . 3.4 t -129.08 108.76 17.51 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.516 0 CA-C-N 118.469 0.577 . . . . 0.0 112.125 -172.418 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 75.7 m -77.82 163.76 25.79 Favored 'General case' 0 CA--C 1.538 0.483 0 C-N-CA 124.467 1.107 . . . . 0.0 111.512 173.813 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 63' ' ' PHE . . . . . . . . . . . . . 61.7 t80 -59.69 -38.26 81.08 Favored 'General case' 0 CA--C 1.534 0.353 0 N-CA-C 113.028 0.751 . . . . 0.0 113.028 -172.806 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 50.0 mt-10 -61.74 -59.57 4.97 Favored 'General case' 0 CA--C 1.532 0.256 0 O-C-N 121.902 -0.499 . . . . 0.0 110.167 -179.067 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 16.6 pt-20 -61.55 -35.94 79.19 Favored 'General case' 0 CA--C 1.539 0.536 0 O-C-N 121.458 -0.776 . . . . 0.0 111.644 178.561 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 18.5 t80 -52.74 -22.89 5.77 Favored 'General case' 0 CA--C 1.536 0.426 0 C-N-CA 123.703 0.801 . . . . 0.0 112.439 169.932 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 67' ' ' GLN . . . . . . . . . . . . . 34.2 mm-40 -53.69 -21.55 7.25 Favored 'General case' 0 CA--C 1.537 0.453 0 CA-C-N 119.789 1.177 . . . . 0.0 113.001 171.063 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 70.8 t -55.49 -36.7 42.49 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.651 0 CA-C-N 119.886 1.221 . . . . 0.0 110.464 169.454 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 12.4 tp -72.59 -44.22 62.31 Favored 'General case' 0 N--CA 1.457 -0.108 0 N-CA-C 108.061 -1.088 . . . . 0.0 108.061 177.662 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 70' ' ' VAL . . . . . . . . . . . . . 54.3 t . . . . . 0 CA--C 1.534 0.36 0 N-CA-C 110.157 -0.312 . . . . 0.0 110.157 175.946 . . . . . . . . 0 0 . 1 . 022 nuclear nobuild core ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 85.1 Cg_exo . . . . . 0 N--CA 1.46 -0.495 0 N-CA-C 113.665 0.602 . . . . 0.0 113.665 . . . . . . . . . 0 0 . 1 . 022 nuclear nobuild core ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 3.2 mp0 -58.13 -48.92 78.74 Favored 'General case' 0 N--CA 1.456 -0.135 0 C-N-CA 123.88 0.872 . . . . 0.0 111.531 176.893 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 58.5 mm-40 -66.38 -38.5 87.68 Favored 'General case' 0 N--CA 1.448 -0.565 0 N-CA-C 109.085 -0.709 . . . . 0.0 109.085 179.343 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 48.2 mt -62.32 -35.62 79.62 Favored 'General case' 0 N--CA 1.451 -0.415 0 C-N-CA 123.436 0.694 . . . . 0.0 112.536 174.877 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 23.4 tptm -61.07 -49.18 78.39 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 118.88 0.764 . . . . 0.0 109.599 169.045 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . -49.7 -51.57 27.94 Favored Glycine 0 CA--C 1.534 1.22 0 N-CA-C 111.092 -0.803 . . . . 0.0 111.092 176.055 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 9' ' ' ILE . . . . . . . . . . . . . 2.8 mm -58.12 -54.22 35.2 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.241 0 C-N-CA 126.28 1.832 . . . . 0.0 109.327 177.117 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 10' ' ' PHE . . . . . . . . . . . . . 50.6 t80 -47.9 -52.21 20.21 Favored 'General case' 0 N--CA 1.449 -0.476 0 C-N-CA 123.503 0.721 . . . . 0.0 109.219 178.693 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 52.0 mt-10 -61.22 -51.4 69.16 Favored 'General case' 0 CA--C 1.532 0.281 0 C-N-CA 123.063 0.545 . . . . 0.0 110.553 179.724 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 37.7 tttm -45.1 -53.26 8.19 Favored 'General case' 0 C--N 1.338 0.108 0 C-N-CA 124.42 1.088 . . . . 0.0 111.124 177.981 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 68.2 m-85 -78.6 -43.78 25.58 Favored 'General case' 0 N--CA 1.454 -0.24 0 C-N-CA 121.041 -0.264 . . . . 0.0 110.97 -175.832 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -58.55 -28.73 65.76 Favored 'General case' 0 CA--C 1.532 0.284 0 C-N-CA 124.181 0.992 . . . . 0.0 112.228 179.779 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.452 -0.342 0 C-N-CA 122.999 0.519 . . . . 0.0 112.191 174.106 . . . . . . . . 0 0 . 1 . 022 nuclear nobuild core ' A' A ' 20' ' ' PRO . . . . . . . . . . . . . 12.8 Cg_endo . . . . . 0 CA--C 1.537 0.656 0 N-CA-C 114.385 0.879 . . . . 0.0 114.385 . . . . . . . . . 0 0 . 1 . 022 nuclear nobuild core ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -80.84 -25.26 37.85 Favored 'General case' 0 N--CA 1.451 -0.42 0 C-N-CA 125.591 1.556 . . . . 0.0 111.814 -174.685 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 59.1 tt0 -153.33 121.62 6.22 Favored 'General case' 0 N--CA 1.451 -0.409 0 N-CA-C 110.013 -0.366 . . . . 0.0 110.013 -165.9 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 50.0 mt -77.65 131.81 37.93 Favored 'General case' 0 N--CA 1.449 -0.511 0 N-CA-C 109.338 -0.616 . . . . 0.0 109.338 -174.798 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 50.9 p -75.2 167.02 22.71 Favored 'General case' 0 N--CA 1.448 -0.538 0 N-CA-C 108.448 -0.945 . . . . 0.0 108.448 169.038 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 30.9 ttmt -58.06 -37.84 75.18 Favored 'General case' 0 CA--C 1.538 0.505 0 O-C-N 121.984 -0.448 . . . . 0.0 110.104 173.963 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 24.6 mt-10 -67.68 -47.2 70.15 Favored 'General case' 0 N--CA 1.455 -0.212 0 O-C-N 121.529 -0.732 . . . . 0.0 110.667 179.008 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 23.7 mt-10 -57.49 -44.7 85.16 Favored 'General case' 0 CA--C 1.534 0.364 0 N-CA-C 109.525 -0.546 . . . . 0.0 109.525 177.455 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 15.3 mt -54.0 -48.23 70.64 Favored 'General case' 0 CA--C 1.508 -0.646 0 CA-C-N 118.317 0.508 . . . . 0.0 112.192 169.205 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 52.4 tttp -60.64 -43.12 97.91 Favored 'General case' 0 C--N 1.322 -0.593 0 CA-C-N 118.602 0.637 . . . . 0.0 110.268 -176.505 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 87.7 mt -60.88 -52.01 66.88 Favored 'General case' 0 C--N 1.328 -0.355 0 O-C-N 122.18 -0.325 . . . . 0.0 111.324 175.263 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 7.1 tt -48.15 -58.22 4.81 Favored 'General case' 0 C--N 1.334 -0.108 0 C-N-CA 124.38 1.072 . . . . 0.0 109.27 175.887 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 46.6 mt -59.14 -54.16 50.15 Favored 'General case' 0 N--CA 1.449 -0.512 0 C-N-CA 123.96 0.904 . . . . 0.0 109.868 -175.6 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 25.7 mt-30 -56.55 -48.91 76.31 Favored 'General case' 0 C--O 1.227 -0.13 0 CA-C-N 118.548 0.613 . . . . 0.0 110.996 -177.515 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 11.2 m -72.36 -47.52 48.88 Favored 'General case' 0 N--CA 1.453 -0.298 0 CA-C-N 116.325 -0.398 . . . . 0.0 110.691 -171.983 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 76.3 mm-40 -91.77 -33.4 15.01 Favored 'General case' 0 N--CA 1.451 -0.425 0 C-N-CA 123.553 0.741 . . . . 0.0 112.295 -169.438 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 79.8 m-85 . . . . . 0 CA--C 1.539 0.54 0 C-N-CA 123.969 0.907 . . . . 0.0 112.857 -171.105 . . . . . . . . 0 0 . 1 . 022 nuclear nobuild core ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 49.3 tp . . . . . 0 N--CA 1.454 -0.27 0 CA-C-O 120.964 0.412 . . . . 0.0 111.833 . . . . . . . . . 0 0 . 1 . 022 nuclear nobuild core ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 13.5 m-20 -59.48 -49.41 77.91 Favored 'General case' 0 N--CA 1.45 -0.458 0 C-N-CA 123.104 0.561 . . . . 0.0 109.908 -177.627 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 47.8 mt-10 -51.94 -53.13 44.78 Favored 'General case' 0 N--CA 1.454 -0.253 0 CA-C-N 116.357 -0.383 . . . . 0.0 110.644 174.413 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 6.0 mp -53.6 -52.44 59.81 Favored 'General case' 0 CA--C 1.527 0.068 0 CA-C-O 121.256 0.551 . . . . 0.0 110.428 178.304 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 50' ' ' PHE . . . . . . . . . . . . . 39.3 t80 -55.76 -45.37 78.08 Favored 'General case' 0 N--CA 1.446 -0.647 0 O-C-N 122.015 -0.428 . . . . 0.0 110.584 -178.065 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 35.5 mt-10 -67.6 -40.76 84.74 Favored 'General case' 0 N--CA 1.456 -0.17 0 CA-C-N 118.237 0.471 . . . . 0.0 112.069 179.67 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 30.8 mt-10 -53.15 -46.95 69.09 Favored 'General case' 0 N--CA 1.456 -0.128 0 C-N-CA 122.964 0.506 . . . . 0.0 110.147 174.326 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 76.2 mt -80.85 -55.89 4.5 Favored 'General case' 0 N--CA 1.45 -0.426 0 C-N-CA 122.849 0.46 . . . . 0.0 111.462 -173.358 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 14.3 t0 . . . . . 0 N--CA 1.448 -0.538 0 C-N-CA 126.173 1.789 . . . . 0.0 107.624 -179.156 . . . . . . . . 0 0 . 1 . 022 nuclear nobuild core ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 7.3 mm-40 . . . . . 0 CA--C 1.535 0.376 0 N-CA-C 102.94 -2.985 . . . . 0.0 102.94 . . . . . . . . . 0 0 . 1 . 022 nuclear nobuild core ' A' A ' 61' ' ' VAL . . . . . . . . . . . . . 91.8 t -96.21 111.56 26.67 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.432 0 CA-C-N 120.365 1.439 . . . . 0.0 112.992 -167.791 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 60.4 p -80.41 161.46 24.94 Favored 'General case' 0 CA--C 1.541 0.606 0 O-C-N 121.428 -0.795 . . . . 0.0 112.173 175.866 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 63' ' ' PHE . . . . . . . . . . . . . 63.6 t80 -58.65 -40.29 83.0 Favored 'General case' 0 N--CA 1.464 0.246 0 C-N-CA 123.026 0.53 . . . . 0.0 112.428 -172.885 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 20.8 pm0 -61.82 -50.64 71.47 Favored 'General case' 0 N--CA 1.448 -0.535 0 O-C-N 121.865 -0.522 . . . . 0.0 111.355 -178.267 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 10.5 pt-20 -71.38 -31.55 67.43 Favored 'General case' 0 CA--C 1.53 0.195 0 O-C-N 121.398 -0.814 . . . . 0.0 110.948 178.232 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 25.0 t80 -51.83 -27.93 14.14 Favored 'General case' 0 CA--C 1.54 0.591 0 CA-C-N 118.526 0.603 . . . . 0.0 111.747 169.472 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 67' ' ' GLN . . . . . . . . . . . . . 46.7 mm-40 -54.54 -29.79 51.97 Favored 'General case' 0 N--CA 1.469 0.492 0 O-C-N 120.742 -1.224 . . . . 0.0 113.022 171.393 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 82.9 t -61.38 -32.8 54.24 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.405 0 O-C-N 121.173 -0.954 . . . . 0.0 110.028 172.575 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 1.2 tt -71.78 -48.75 44.44 Favored 'General case' 0 N--CA 1.454 -0.243 0 N-CA-C 106.206 -1.776 . . . . 0.0 106.206 177.788 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 70' ' ' VAL . . . . . . . . . . . . . 42.9 t . . . . . 0 CA--C 1.535 0.373 0 C-N-CA 122.176 0.19 . . . . 0.0 110.494 175.922 . . . . . . . . 0 0 . 1 . 023 nuclear nobuild core ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 79.8 Cg_exo . . . . . 0 N--CA 1.456 -0.702 0 N-CA-C 112.284 0.071 . . . . 0.0 112.284 . . . . . . . . . 0 0 . 1 . 023 nuclear nobuild core ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 48.2 mt-10 -63.74 -49.68 72.1 Favored 'General case' 0 CA--C 1.529 0.166 0 C-N-CA 123.59 0.756 . . . . 0.0 110.923 177.209 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 46.9 mm-40 -58.65 -45.76 88.64 Favored 'General case' 0 N--CA 1.455 -0.204 0 N-CA-C 108.959 -0.756 . . . . 0.0 108.959 176.016 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 66.9 mt -60.83 -37.96 83.83 Favored 'General case' 0 N--CA 1.447 -0.579 0 C-N-CA 124.141 0.976 . . . . 0.0 112.56 179.848 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 2.6 tppp? -57.99 -53.85 53.55 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 119.249 0.932 . . . . 0.0 109.575 168.832 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . -49.17 -52.99 20.94 Favored Glycine 0 CA--C 1.536 1.344 0 N-CA-C 111.651 -0.58 . . . . 0.0 111.651 178.005 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 9' ' ' ILE . . . . . . . . . . . . . 1.9 mm -56.83 -51.38 68.34 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.231 0 C-N-CA 127.056 2.142 . . . . 0.0 109.265 176.205 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 10' ' ' PHE . . . . . . . . . . . . . 21.7 t80 -51.62 -48.95 63.1 Favored 'General case' 0 N--CA 1.445 -0.68 0 O-C-N 121.365 -0.834 . . . . 0.0 108.955 179.659 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 49.8 mt-10 -63.77 -49.39 73.16 Favored 'General case' 0 CA--C 1.531 0.237 0 CA-C-O 118.679 -0.677 . . . . 0.0 111.281 179.344 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 48.2 tptt -39.09 -51.47 1.87 Allowed 'General case' 0 N--CA 1.467 0.41 0 C-N-CA 124.74 1.216 . . . . 0.0 110.662 174.072 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 80.8 m-85 -81.43 -57.69 3.37 Favored 'General case' 0 N--CA 1.451 -0.4 0 C-N-CA 121.074 -0.25 . . . . 0.0 111.532 -177.632 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -48.63 -43.63 36.57 Favored 'General case' 0 C--N 1.331 -0.204 0 C-N-CA 124.665 1.186 . . . . 0.0 112.374 -177.242 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.53 0.183 0 C-N-CA 124.272 1.029 . . . . 0.0 112.921 -179.821 . . . . . . . . 0 0 . 1 . 023 nuclear nobuild core ' A' A ' 20' ' ' PRO . . . . . . . . . . . . . 68.8 Cg_endo . . . . . 0 N--CA 1.456 -0.72 0 N-CA-C 112.855 0.29 . . . . 0.0 112.855 . . . . . . . . . 0 0 . 1 . 023 nuclear nobuild core ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 35.7 m120 -91.24 -5.2 55.16 Favored 'General case' 0 C--O 1.234 0.267 0 C-N-CA 125.207 1.403 . . . . 0.0 113.763 -168.716 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 49.2 tt0 -141.42 129.6 22.19 Favored 'General case' 0 CA--C 1.541 0.599 0 C-N-CA 123.674 0.79 . . . . 0.0 111.69 -169.684 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 63.0 mt -102.42 137.39 40.73 Favored 'General case' 0 C--N 1.344 0.359 0 C-N-CA 125.107 1.363 . . . . 0.0 111.958 -179.358 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 78.1 p -79.51 172.95 13.09 Favored 'General case' 0 C--O 1.234 0.25 0 C-N-CA 124.609 1.164 . . . . 0.0 109.368 168.542 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 58.7 mttm -56.66 -47.58 79.48 Favored 'General case' 0 N--CA 1.456 -0.161 0 O-C-N 122.124 -0.36 . . . . 0.0 110.031 172.007 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 41.5 tt0 -64.2 -46.39 84.14 Favored 'General case' 0 N--CA 1.45 -0.433 0 N-CA-C 110.286 -0.264 . . . . 0.0 110.286 -175.911 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 1.1 mp0 -61.6 -41.69 97.8 Favored 'General case' 0 N--CA 1.45 -0.47 0 CA-C-O 118.532 -0.746 . . . . 0.0 110.098 177.671 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 12.8 mt -57.0 -44.89 83.19 Favored 'General case' 0 CA--C 1.512 -0.519 0 CA-C-N 119.746 1.157 . . . . 0.0 112.611 169.476 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 4.8 ttpm? -61.7 -47.55 84.77 Favored 'General case' 0 C--N 1.323 -0.549 0 CA-C-N 118.495 0.589 . . . . 0.0 109.905 -176.113 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 9.8 mp -60.53 -48.23 82.68 Favored 'General case' 0 C--N 1.329 -0.289 0 C-N-CA 122.539 0.336 . . . . 0.0 111.198 176.715 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 7.4 tt -50.38 -58.25 6.12 Favored 'General case' 0 C--N 1.333 -0.138 0 C-N-CA 123.7 0.8 . . . . 0.0 109.552 175.441 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 42.0 mt -57.45 -53.46 57.85 Favored 'General case' 0 N--CA 1.452 -0.339 0 CA-C-N 115.656 -0.702 . . . . 0.0 109.295 -177.527 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 22.2 tt0 -54.6 -49.31 70.75 Favored 'General case' 0 N--CA 1.453 -0.301 0 C-N-CA 123.683 0.793 . . . . 0.0 111.659 -177.281 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 2.7 m -72.8 -50.4 24.5 Favored 'General case' 0 CA--C 1.532 0.269 0 C-N-CA 120.968 -0.293 . . . . 0.0 110.869 -175.416 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 65.5 mm-40 -92.67 -30.02 15.79 Favored 'General case' 0 N--CA 1.45 -0.453 0 N-CA-C 113.254 0.835 . . . . 0.0 113.254 -165.966 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 80.8 m-85 . . . . . 0 CA--C 1.535 0.368 0 C-N-CA 124.019 0.928 . . . . 0.0 111.413 -175.256 . . . . . . . . 0 0 . 1 . 023 nuclear nobuild core ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 65.6 tp . . . . . 0 C--O 1.227 -0.115 0 CA-C-O 121.063 0.458 . . . . 0.0 111.923 . . . . . . . . . 0 0 . 1 . 023 nuclear nobuild core ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 16.0 m-20 -60.02 -51.9 67.68 Favored 'General case' 0 N--CA 1.447 -0.624 0 CA-C-O 120.918 0.39 . . . . 0.0 111.305 -179.839 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 44.0 tt0 -56.05 -48.26 76.35 Favored 'General case' 0 N--CA 1.451 -0.419 0 CA-C-N 115.998 -0.546 . . . . 0.0 109.759 177.157 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 62.1 tp -56.02 -50.94 69.5 Favored 'General case' 0 N--CA 1.452 -0.362 0 C-N-CA 122.893 0.477 . . . . 0.0 110.216 178.943 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 50' ' ' PHE . . . . . . . . . . . . . 64.3 t80 -54.77 -50.44 68.44 Favored 'General case' 0 N--CA 1.45 -0.444 0 C-N-CA 123.649 0.78 . . . . 0.0 110.217 179.54 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 35.4 mt-10 -59.21 -47.26 86.0 Favored 'General case' 0 N--CA 1.454 -0.252 0 CA-C-O 120.677 0.275 . . . . 0.0 110.905 179.552 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 35.3 mm-40 -62.34 -37.0 83.95 Favored 'General case' 0 C--N 1.332 -0.17 0 C-N-CA 123.025 0.53 . . . . 0.0 111.75 179.962 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 79.9 mt -72.97 -44.95 60.51 Favored 'General case' 0 N--CA 1.449 -0.478 0 O-C-N 122.038 -0.414 . . . . 0.0 111.53 178.176 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 27.4 t70 . . . . . 0 C--O 1.235 0.298 0 CA-C-O 121.023 0.439 . . . . 0.0 111.795 -170.01 . . . . . . . . 0 0 . 1 . 023 nuclear nobuild core ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 36.4 mt-10 . . . . . 0 CA--C 1.53 0.188 0 CA-C-O 121.211 0.529 . . . . 0.0 110.062 . . . . . . . . . 0 0 . 1 . 023 nuclear nobuild core ' A' A ' 61' ' ' VAL . . . . . . . . . . . . . 3.6 t -80.42 117.69 26.78 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.251 0 C-N-CA 123.827 0.851 . . . . 0.0 110.955 -166.361 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 87.0 p -76.71 157.01 32.06 Favored 'General case' 0 CA--C 1.532 0.267 0 CA-C-N 118.161 0.437 . . . . 0.0 110.466 177.484 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 63' ' ' PHE . . . . . . . . . . . . . 79.3 t80 -55.22 -32.13 62.01 Favored 'General case' 0 CA--C 1.533 0.291 0 O-C-N 121.762 -0.586 . . . . 0.0 112.394 177.087 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 44.3 mt-10 -64.95 -61.63 2.05 Favored 'General case' 0 N--CA 1.451 -0.404 0 O-C-N 121.803 -0.56 . . . . 0.0 110.12 178.329 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 8.4 pt-20 -66.21 -27.53 68.05 Favored 'General case' 0 CA--C 1.538 0.508 0 O-C-N 121.143 -0.973 . . . . 0.0 111.522 -177.824 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 18.0 t80 -52.22 -25.26 8.8 Favored 'General case' 0 CA--C 1.537 0.468 0 C-N-CA 123.848 0.859 . . . . 0.0 111.931 168.449 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 67' ' ' GLN . . . . . . . . . . . . . 67.9 mm-40 -55.17 -23.95 24.26 Favored 'General case' 0 CA--C 1.538 0.482 0 CA-C-N 119.678 1.126 . . . . 0.0 113.01 171.435 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 91.6 t -60.86 -36.32 70.79 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.532 0 CA-C-N 119.575 1.08 . . . . 0.0 110.233 169.914 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 1.4 tt -72.38 -46.05 57.04 Favored 'General case' 0 N--CA 1.453 -0.283 0 N-CA-C 106.694 -1.595 . . . . 0.0 106.694 178.659 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 70' ' ' VAL . . . . . . . . . . . . . 40.3 t . . . . . 0 CA--C 1.536 0.408 0 O-C-N 122.092 -0.38 . . . . 0.0 110.743 175.193 . . . . . . . . 0 0 . 1 . 024 nuclear nobuild core ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 92.8 Cg_exo . . . . . 0 N--CA 1.459 -0.505 0 N-CA-C 113.037 0.36 . . . . 0.0 113.037 . . . . . . . . . 0 0 . 1 . 024 nuclear nobuild core ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 3.0 mp0 -57.43 -50.71 72.12 Favored 'General case' 0 N--CA 1.455 -0.191 0 C-N-CA 123.957 0.903 . . . . 0.0 111.51 177.978 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 54.0 mm-40 -60.86 -44.46 97.0 Favored 'General case' 0 N--CA 1.451 -0.389 0 N-CA-C 108.667 -0.864 . . . . 0.0 108.667 177.693 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 21.0 mt -60.46 -35.75 76.62 Favored 'General case' 0 N--CA 1.447 -0.579 0 C-N-CA 123.492 0.717 . . . . 0.0 112.212 -179.023 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 23.9 tptm -61.09 -51.9 67.18 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 118.799 0.727 . . . . 0.0 110.731 169.369 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . -53.27 -52.16 42.39 Favored Glycine 0 CA--C 1.53 1.028 0 N-CA-C 110.412 -1.075 . . . . 0.0 110.412 -179.434 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 9' ' ' ILE . . . . . . . . . . . . . 77.5 mt -53.34 -54.61 17.05 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.345 0 C-N-CA 126.466 1.906 . . . . 0.0 110.1 173.289 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 10' ' ' PHE . . . . . . . . . . . . . 53.5 t80 -49.36 -53.34 22.89 Favored 'General case' 0 N--CA 1.45 -0.475 0 N-CA-C 108.84 -0.8 . . . . 0.0 108.84 -179.075 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 51.3 mt-10 -60.81 -52.93 63.0 Favored 'General case' 0 N--CA 1.455 -0.213 0 C-N-CA 122.623 0.369 . . . . 0.0 110.333 -178.273 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 17.2 ttpp -45.88 -54.84 7.51 Favored 'General case' 0 C--O 1.23 0.074 0 C-N-CA 125.142 1.377 . . . . 0.0 111.322 178.73 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 57.9 m-85 -77.18 -48.21 18.24 Favored 'General case' 0 N--CA 1.451 -0.415 0 N-CA-C 110.009 -0.367 . . . . 0.0 110.009 -175.191 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -47.91 -50.08 27.92 Favored 'General case' 0 N--CA 1.463 0.215 0 C-N-CA 124.641 1.176 . . . . 0.0 111.413 179.461 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.453 -0.279 0 C-N-CA 123.717 0.807 . . . . 0.0 112.526 177.279 . . . . . . . . 0 0 . 1 . 024 nuclear nobuild core ' A' A ' 20' ' ' PRO . . . . . . . . . . . . . 4.8 Cg_endo . . . . . 0 CA--C 1.536 0.597 0 N-CA-C 116.576 1.722 . . . . 0.0 116.576 . . . . . . . . . 0 0 . 1 . 024 nuclear nobuild core ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 53.1 m-80 -91.49 -5.66 53.85 Favored 'General case' 0 N--CA 1.449 -0.523 0 C-N-CA 123.695 0.798 . . . . 0.0 112.023 -171.969 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -152.43 127.52 9.75 Favored 'General case' 0 CA--C 1.538 0.493 0 CA-C-N 119.671 1.123 . . . . 0.0 112.852 -167.942 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 70.2 mt -94.54 124.82 38.8 Favored 'General case' 0 C--O 1.235 0.328 0 O-C-N 121.501 -0.749 . . . . 0.0 110.555 174.761 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 4.9 p -79.02 177.67 8.62 Favored 'General case' 0 C--O 1.238 0.463 0 N-CA-C 107.841 -1.17 . . . . 0.0 107.841 166.411 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 98.7 mttt -54.94 -39.77 69.22 Favored 'General case' 0 N--CA 1.451 -0.377 0 O-C-N 122.192 -0.318 . . . . 0.0 110.338 173.304 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 28.5 mt-10 -69.94 -45.61 67.1 Favored 'General case' 0 N--CA 1.454 -0.272 0 N-CA-C 109.65 -0.5 . . . . 0.0 109.65 -173.113 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 1.6 mp0 -55.17 -50.14 70.1 Favored 'General case' 0 N--CA 1.45 -0.464 0 N-CA-C 109.24 -0.652 . . . . 0.0 109.24 173.676 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 8.0 mt -56.33 -41.59 76.31 Favored 'General case' 0 CA--C 1.513 -0.473 0 N-CA-C 113.198 0.814 . . . . 0.0 113.198 174.365 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 64.7 tttm -62.6 -51.84 65.74 Favored 'General case' 0 C--N 1.321 -0.651 0 CA-C-N 118.485 0.584 . . . . 0.0 110.026 -177.383 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 4.0 mm? -60.41 -46.15 91.03 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.115 -0.493 . . . . 0.0 111.143 178.008 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 6.6 tt -51.23 -57.49 8.68 Favored 'General case' 0 C--N 1.333 -0.152 0 C-N-CA 124.217 1.007 . . . . 0.0 109.399 174.649 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 35.1 mt -55.07 -56.78 15.95 Favored 'General case' 0 C--N 1.331 -0.22 0 C-N-CA 123.23 0.612 . . . . 0.0 109.557 -178.065 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 23.5 mt-30 -52.25 -53.48 43.27 Favored 'General case' 0 N--CA 1.456 -0.135 0 C-N-CA 123.088 0.555 . . . . 0.0 111.671 -178.67 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 13.4 m -74.07 -47.73 34.64 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 116.266 -0.424 . . . . 0.0 110.822 -169.96 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 69.8 mm-40 -85.71 -34.59 21.21 Favored 'General case' 0 N--CA 1.449 -0.513 0 C-N-CA 123.207 0.603 . . . . 0.0 111.313 -170.986 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 82.5 m-85 . . . . . 0 CA--C 1.536 0.438 0 C-N-CA 123.67 0.788 . . . . 0.0 112.278 -171.562 . . . . . . . . 0 0 . 1 . 024 nuclear nobuild core ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 58.2 tp . . . . . 0 C--O 1.225 -0.204 0 N-CA-C 109.739 -0.467 . . . . 0.0 109.739 . . . . . . . . . 0 0 . 1 . 024 nuclear nobuild core ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 5.6 m-20 -56.77 -53.51 56.96 Favored 'General case' 0 N--CA 1.45 -0.472 0 C-N-CA 124.067 0.947 . . . . 0.0 110.868 177.285 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 76.5 tt0 -54.78 -50.55 68.2 Favored 'General case' 0 C--N 1.33 -0.254 0 C-N-CA 122.942 0.497 . . . . 0.0 110.528 177.929 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 59.5 tp -57.31 -48.36 79.13 Favored 'General case' 0 N--CA 1.455 -0.18 0 CA-C-O 121.27 0.557 . . . . 0.0 109.979 178.856 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 50' ' ' PHE . . . . . . . . . . . . . 80.3 t80 -56.18 -48.12 76.99 Favored 'General case' 0 N--CA 1.45 -0.469 0 C-N-CA 123.777 0.831 . . . . 0.0 110.43 179.492 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 33.6 mt-10 -59.6 -46.77 87.98 Favored 'General case' 0 N--CA 1.455 -0.207 0 C-N-CA 122.883 0.473 . . . . 0.0 110.612 177.641 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 44.5 tt0 -54.47 -49.22 70.62 Favored 'General case' 0 CA--C 1.53 0.182 0 C-N-CA 123.065 0.546 . . . . 0.0 110.589 177.416 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 72.8 mt -70.1 -44.49 68.89 Favored 'General case' 0 N--CA 1.45 -0.449 0 C-N-CA 123.229 0.612 . . . . 0.0 111.672 -177.102 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 52.1 t0 . . . . . 0 CA--C 1.535 0.371 0 C-N-CA 125.34 1.456 . . . . 0.0 109.655 177.108 . . . . . . . . 0 0 . 1 . 024 nuclear nobuild core ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 37.3 mt-10 . . . . . 0 N--CA 1.455 -0.223 0 N-CA-C 107.087 -1.449 . . . . 0.0 107.087 . . . . . . . . . 0 0 . 1 . 024 nuclear nobuild core ' A' A ' 61' ' ' VAL . . . . . . . . . . . . . 3.0 t -108.47 115.32 48.96 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.244 0 N-CA-C 109.865 -0.42 . . . . 0.0 109.865 -177.554 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 78.1 p -79.52 161.68 25.87 Favored 'General case' 0 CA--C 1.536 0.405 0 C-N-CA 123.842 0.857 . . . . 0.0 110.086 171.272 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 63' ' ' PHE . . . . . . . . . . . . . 60.4 t80 -59.15 -38.56 79.98 Favored 'General case' 0 N--CA 1.462 0.172 0 O-C-N 121.613 -0.679 . . . . 0.0 111.732 -176.064 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 22.0 mp0 -63.38 -57.29 10.81 Favored 'General case' 0 N--CA 1.447 -0.613 0 N-CA-C 109.163 -0.68 . . . . 0.0 109.163 -175.071 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 15.5 pt-20 -66.4 -32.81 74.43 Favored 'General case' 0 CA--C 1.537 0.464 0 O-C-N 121.545 -0.722 . . . . 0.0 111.459 179.007 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 18.6 t80 -53.22 -24.85 12.12 Favored 'General case' 0 CA--C 1.538 0.502 0 O-C-N 121.467 -0.771 . . . . 0.0 111.73 169.553 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 67' ' ' GLN . . . . . . . . . . . . . 33.8 mm-40 -54.05 -22.96 11.99 Favored 'General case' 0 CA--C 1.535 0.389 0 CA-C-N 119.569 1.077 . . . . 0.0 113.291 172.218 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 69.7 t -53.25 -37.92 29.71 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.487 0 CA-C-N 119.484 1.038 . . . . 0.0 110.38 170.073 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 19.9 tp -74.6 -48.55 25.9 Favored 'General case' 0 N--CA 1.456 -0.165 0 N-CA-C 108.3 -1.0 . . . . 0.0 108.3 177.53 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 70' ' ' VAL . . . . . . . . . . . . . 56.5 t . . . . . 0 C--O 1.225 -0.233 0 C-N-CA 122.574 0.35 . . . . 0.0 110.641 -179.718 . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' A' A ' 1' ' ' LYS . . . . . . . . . . . . . 7.9 mptt . . . . . 0 N--CA 1.449 -0.48 0 N-CA-C 107.377 -1.342 . . . . 0.0 107.377 . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 87.3 p -63.7 154.91 78.81 Favored Pre-proline 0 CA--C 1.534 0.336 0 CA-C-O 118.981 -0.533 . . . . 0.0 109.974 179.628 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 95.4 Cg_exo -44.16 -40.41 12.43 Favored 'Trans proline' 0 N--CA 1.458 -0.614 0 C-N-CA 123.082 2.521 . . . . 0.0 112.657 170.068 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 2.9 mp0 -60.38 -48.74 80.47 Favored 'General case' 0 N--CA 1.455 -0.216 0 C-N-CA 124.005 0.922 . . . . 0.0 112.04 176.114 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 32.8 mt-10 -62.18 -44.41 96.66 Favored 'General case' 0 N--CA 1.453 -0.282 0 N-CA-C 109.19 -0.67 . . . . 0.0 109.19 177.802 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 40.9 mt -60.48 -38.01 82.88 Favored 'General case' 0 N--CA 1.449 -0.504 0 C-N-CA 123.455 0.702 . . . . 0.0 111.869 177.648 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 20.8 tptm -60.62 -49.72 76.39 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 118.442 0.564 . . . . 0.0 110.221 170.635 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . -50.84 -50.1 39.1 Favored Glycine 0 CA--C 1.531 1.061 0 N-CA-C 110.63 -0.988 . . . . 0.0 110.63 177.176 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 9' ' ' ILE . . . . . . . . . . . . . 19.5 mm -58.98 -54.76 29.63 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.235 0 C-N-CA 125.826 1.65 . . . . 0.0 109.958 176.904 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 10' ' ' PHE . . . . . . . . . . . . . 32.3 t80 -47.66 -52.78 16.97 Favored 'General case' 0 N--CA 1.451 -0.419 0 O-C-N 121.605 -0.685 . . . . 0.0 109.703 177.762 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 52.9 mt-10 -60.02 -51.19 70.71 Favored 'General case' 0 N--CA 1.453 -0.318 0 C-N-CA 123.668 0.787 . . . . 0.0 110.359 -179.578 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 58.4 tttt -44.27 -59.91 2.16 Favored 'General case' 0 C--N 1.339 0.115 0 C-N-CA 124.126 0.97 . . . . 0.0 110.214 175.913 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 63.0 m-85 -75.42 -38.73 59.63 Favored 'General case' 0 N--CA 1.452 -0.345 0 C-N-CA 120.449 -0.5 . . . . 0.0 110.88 -169.124 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -57.24 -58.85 6.44 Favored 'General case' 0 C--O 1.237 0.411 0 CA-C-O 122.013 0.911 . . . . 0.0 110.015 174.939 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -54.99 -35.92 64.85 Favored 'General case' 0 N--CA 1.454 -0.267 0 C-N-CA 124.282 1.033 . . . . 0.0 111.441 178.972 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 20.0 ttmm -55.09 -36.83 66.07 Favored 'General case' 0 CA--C 1.533 0.327 0 CA-C-N 118.139 0.427 . . . . 0.0 111.48 178.348 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 34.7 tt0 -76.09 -54.48 6.77 Favored 'General case' 0 C--N 1.34 0.188 0 N-CA-C 108.737 -0.838 . . . . 0.0 108.737 169.731 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 157.07 -54.25 0.4 Allowed Glycine 0 CA--C 1.521 0.418 0 N-CA-C 110.358 -1.097 . . . . 0.0 110.358 178.565 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 13.9 t0 -58.65 119.77 39.63 Favored Pre-proline 0 CA--C 1.532 0.269 0 N-CA-C 108.221 -1.029 . . . . 0.0 108.221 177.802 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 20' ' ' PRO . . . . . . . . . . . . . 72.2 Cg_endo -80.6 -28.93 2.52 Favored 'Trans proline' 0 N--CA 1.455 -0.793 0 C-N-CA 121.951 1.767 . . . . 0.0 112.781 -175.835 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 92.9 m-20 -97.69 -15.15 20.51 Favored 'General case' 0 N--CA 1.454 -0.242 0 C-N-CA 124.464 1.106 . . . . 0.0 113.325 -166.772 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 7.1 tp60 -138.67 127.23 23.27 Favored 'General case' 0 CA--C 1.537 0.443 0 C-N-CA 123.725 0.81 . . . . 0.0 109.992 -168.307 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 74.8 mt -95.07 129.32 42.21 Favored 'General case' 0 CA--C 1.531 0.241 0 C-N-CA 124.301 1.041 . . . . 0.0 110.782 178.666 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 1.5 p -79.16 176.02 10.06 Favored 'General case' 0 C--O 1.238 0.472 0 N-CA-C 108.301 -1.0 . . . . 0.0 108.301 167.103 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 58.1 mttp -54.24 -38.77 66.14 Favored 'General case' 0 N--CA 1.451 -0.39 0 CA-C-O 119.352 -0.356 . . . . 0.0 110.902 175.162 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 31.3 mm-40 -71.42 -47.4 56.21 Favored 'General case' 0 CA--C 1.518 -0.26 0 CA-C-N 118.436 0.562 . . . . 0.0 110.557 -171.243 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 2.2 mp0 -53.97 -48.96 69.81 Favored 'General case' 0 N--CA 1.451 -0.418 0 CA-C-N 115.87 -0.605 . . . . 0.0 109.549 172.368 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 13.1 mt -56.97 -43.52 81.71 Favored 'General case' 0 C--O 1.218 -0.554 0 C-N-CA 120.023 -0.671 . . . . 0.0 112.304 174.59 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 37.6 ttpt -61.67 -47.86 83.44 Favored 'General case' 0 C--N 1.32 -0.702 0 CA-C-N 118.5 0.591 . . . . 0.0 110.121 -176.641 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 11.8 tp -65.56 -43.8 88.76 Favored 'General case' 0 CA--C 1.533 0.326 0 CA-C-O 120.609 0.242 . . . . 0.0 110.877 179.823 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 7.1 tt -50.73 -58.71 5.25 Favored 'General case' 0 CA--C 1.522 -0.119 0 C-N-CA 124.146 0.979 . . . . 0.0 109.549 173.521 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 31.0 mt -58.93 -52.73 64.52 Favored 'General case' 0 C--O 1.219 -0.501 0 N-CA-C 108.782 -0.821 . . . . 0.0 108.782 -177.882 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 22.9 tt0 -49.5 -45.62 47.28 Favored 'General case' 0 C--N 1.332 -0.194 0 O-C-N 121.37 -0.831 . . . . 0.0 111.775 179.25 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 7.9 m -74.09 -54.74 7.18 Favored 'General case' 0 CA--C 1.533 0.325 0 CA-C-O 120.61 0.243 . . . . 0.0 111.612 -177.81 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 29.5 mm-40 -91.98 -33.4 14.86 Favored 'General case' 0 N--CA 1.452 -0.339 0 C-N-CA 124.008 0.923 . . . . 0.0 113.138 -166.36 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 79.6 m-85 -147.37 64.89 9.05 Favored Pre-proline 0 CA--C 1.536 0.439 0 C-N-CA 124.98 1.312 . . . . 0.0 111.525 -171.912 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 27.5 Cg_endo -60.79 -27.29 84.58 Favored 'Trans proline' 0 N--CA 1.458 -0.594 0 C-N-CA 122.524 2.15 . . . . 0.0 112.785 -170.575 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 2.5 p -56.67 -53.16 60.88 Favored 'General case' 0 N--CA 1.449 -0.485 0 C-N-CA 124.66 1.184 . . . . 0.0 110.378 175.91 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 72.0 mt -59.16 -17.5 27.7 Favored 'General case' 0 CA--C 1.532 0.271 0 C-N-CA 125.604 1.562 . . . . 0.0 113.635 -170.815 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 93.8 mt -49.41 -36.49 22.27 Favored 'General case' 0 CA--C 1.537 0.458 0 CA-C-N 118.413 0.551 . . . . 0.0 110.932 168.305 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 56.2 mtmt -109.61 -47.32 3.38 Favored 'General case' 0 N--CA 1.45 -0.467 0 C-N-CA 126.511 1.924 . . . . 0.0 110.681 177.138 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . -57.99 137.97 49.18 Favored Glycine 0 CA--C 1.525 0.691 0 C-N-CA 125.178 1.37 . . . . 0.0 111.97 -170.655 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 43' ' ' GLY . . . . . . . . . . . . . . . 78.59 -55.1 4.12 Favored Glycine 0 CA--C 1.527 0.789 0 N-CA-C 110.347 -1.101 . . . . 0.0 110.347 -178.936 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 44' ' ' SER . . . . . . . . . . . . . 4.5 m -160.35 145.03 14.5 Favored 'General case' 0 N--CA 1.442 -0.826 0 C-N-CA 124.97 1.308 . . . . 0.0 107.59 174.055 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 6.5 p -59.69 143.0 51.9 Favored 'General case' 0 N--CA 1.451 -0.415 0 N-CA-C 108.93 -0.767 . . . . 0.0 108.93 171.446 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 48.3 tp -39.34 -49.2 1.97 Allowed 'General case' 0 CA--C 1.519 -0.242 0 C-N-CA 127.02 2.128 . . . . 0.0 112.842 -169.169 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 7.4 m-20 -64.07 -43.38 95.64 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-N 115.843 -0.617 . . . . 0.0 111.1 -174.898 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 29.7 mm-40 -71.14 -42.24 69.42 Favored 'General case' 0 N--CA 1.45 -0.45 0 N-CA-C 109.263 -0.643 . . . . 0.0 109.263 177.219 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 56.5 tp -53.96 -47.64 71.13 Favored 'General case' 0 N--CA 1.452 -0.367 0 N-CA-C 109.539 -0.541 . . . . 0.0 109.539 177.448 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 50' ' ' PHE . . . . . . . . . . . . . 82.9 t80 -51.69 -53.73 35.93 Favored 'General case' 0 N--CA 1.454 -0.266 0 C-N-CA 123.657 0.783 . . . . 0.0 110.614 177.987 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 72.2 mm-40 -56.06 -49.12 74.64 Favored 'General case' 0 CA--C 1.532 0.283 0 CA-C-O 120.605 0.24 . . . . 0.0 110.968 177.429 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 50.2 mm-40 -57.73 -40.99 80.92 Favored 'General case' 0 CA--C 1.531 0.219 0 C-N-CA 122.779 0.432 . . . . 0.0 112.138 179.801 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 62.2 mt -71.44 -41.15 69.83 Favored 'General case' 0 N--CA 1.45 -0.464 0 C-N-CA 122.857 0.463 . . . . 0.0 111.011 179.16 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 19.6 t70 -70.14 57.2 0.16 Allowed 'General case' 0 CA--C 1.541 0.621 0 C-N-CA 125.966 1.707 . . . . 0.0 112.136 -178.386 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 30.7 mmmt -56.29 -36.33 68.52 Favored 'General case' 0 CA--C 1.53 0.201 0 O-C-N 120.758 -1.214 . . . . 0.0 112.295 -179.322 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 56' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -69.79 -15.4 63.11 Favored 'General case' 0 CA--C 1.537 0.444 0 N-CA-C 112.485 0.55 . . . . 0.0 112.485 179.167 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . 75.04 14.96 81.35 Favored Glycine 0 CA--C 1.53 0.971 0 CA-C-O 118.562 -1.132 . . . . 0.0 114.908 169.635 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -77.02 -34.22 57.39 Favored 'General case' 0 C--N 1.34 0.175 0 CA-C-N 119.901 1.85 . . . . 0.0 110.078 174.607 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . 133.92 -67.78 0.55 Allowed Glycine 0 N--CA 1.448 -0.552 0 N-CA-C 107.559 -2.216 . . . . 0.0 107.559 -176.555 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 56.5 mt-10 -78.21 155.13 30.51 Favored 'General case' 0 N--CA 1.452 -0.345 0 N-CA-C 109.42 -0.585 . . . . 0.0 109.42 -174.865 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 61' ' ' VAL . . . . . . . . . . . . . 3.7 t -103.91 120.94 54.81 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.422 0 C-N-CA 123.332 0.653 . . . . 0.0 111.354 -167.183 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 95.1 p -77.45 163.7 26.11 Favored 'General case' 0 N--CA 1.463 0.195 0 C-N-CA 123.196 0.598 . . . . 0.0 110.492 174.931 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 63' ' ' PHE . . . . . . . . . . . . . 68.9 t80 -59.38 -32.99 70.65 Favored 'General case' 0 CA--C 1.528 0.133 0 O-C-N 122.032 -0.418 . . . . 0.0 111.879 176.091 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 39.2 mm-40 -66.97 -59.1 3.78 Favored 'General case' 0 N--CA 1.446 -0.639 0 N-CA-C 109.363 -0.606 . . . . 0.0 109.363 -179.437 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 8.3 pt-20 -66.91 -29.58 69.49 Favored 'General case' 0 CA--C 1.54 0.578 0 O-C-N 121.5 -0.75 . . . . 0.0 111.313 -177.656 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 13.3 t80 -50.63 -28.53 9.01 Favored 'General case' 0 CA--C 1.536 0.417 0 C-N-CA 123.825 0.85 . . . . 0.0 111.891 168.779 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 67' ' ' GLN . . . . . . . . . . . . . 80.5 mm-40 -55.32 -23.32 23.08 Favored 'General case' 0 CA--C 1.535 0.401 0 CA-C-N 119.696 1.135 . . . . 0.0 112.962 174.668 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 88.4 t -55.25 -32.38 28.42 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.526 0 CA-C-N 119.472 1.033 . . . . 0.0 110.765 171.701 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 37.2 tp -71.33 -47.72 54.81 Favored 'General case' 0 N--CA 1.454 -0.257 0 N-CA-C 107.159 -1.423 . . . . 0.0 107.159 179.47 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 70' ' ' VAL . . . . . . . . . . . . . 18.5 t -59.62 -39.57 79.87 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.348 0 C-N-CA 122.88 0.472 . . . . 0.0 110.142 -179.983 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 53.5 tptt -55.21 -56.59 18.22 Favored 'General case' 0 N--CA 1.453 -0.289 0 C-N-CA 123.277 0.631 . . . . 0.0 109.978 171.189 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 2.1 mptm? -50.43 -45.47 55.83 Favored 'General case' 0 CA--C 1.537 0.46 0 N-CA-C 112.415 0.524 . . . . 0.0 112.415 175.264 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 73' ' ' ILE . . . . . . . . . . . . . 78.8 mt -56.79 -50.57 74.4 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.248 0 N-CA-C 109.446 -0.576 . . . . 0.0 109.446 175.47 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 74' ' ' SER . . . . . 0.528 ' O ' ' OXT' ' A' ' 75' ' ' GLN . 17.9 m -56.06 -42.15 76.21 Favored 'General case' 0 CA--C 1.529 0.161 0 C-N-CA 123.398 0.679 . . . . 0.0 110.854 179.783 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 75' ' ' GLN . . . . . 0.528 ' OXT' ' O ' ' A' ' 74' ' ' SER . 40.1 mt-30 . . . . . 0 C--O 1.27 2.169 0 N-CA-C 108.629 -0.878 . . . . 0.0 108.629 169.448 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 1' ' ' LYS . . . . . . . . . . . . . 32.9 mttp . . . . . 0 N--CA 1.451 -0.393 0 N-CA-C 108.72 -0.844 . . . . 0.0 108.72 . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 88.2 p -69.31 159.44 83.32 Favored Pre-proline 0 CA--C 1.534 0.361 0 CA-C-O 119.247 -0.406 . . . . 0.0 110.564 179.872 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 86.9 Cg_exo -47.26 -40.11 27.57 Favored 'Trans proline' 0 N--CA 1.457 -0.664 0 C-N-CA 123.091 2.527 . . . . 0.0 112.338 168.86 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 40.3 tt0 -61.11 -49.37 77.56 Favored 'General case' 0 CA--C 1.529 0.17 0 C-N-CA 123.389 0.676 . . . . 0.0 111.103 177.534 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 29.7 mt-10 -60.75 -45.63 93.54 Favored 'General case' 0 N--CA 1.454 -0.272 0 N-CA-C 109.009 -0.738 . . . . 0.0 109.009 177.943 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 19.9 mt -58.41 -40.19 81.8 Favored 'General case' 0 N--CA 1.447 -0.611 0 C-N-CA 123.755 0.822 . . . . 0.0 111.192 179.142 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 21.4 tptm -60.12 -53.05 62.36 Favored 'General case' 0 C--N 1.333 -0.131 0 CA-C-N 118.798 0.726 . . . . 0.0 110.898 171.054 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . -50.5 -52.2 29.55 Favored Glycine 0 CA--C 1.533 1.192 0 N-CA-C 111.269 -0.732 . . . . 0.0 111.269 179.15 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 9' ' ' ILE . . . . . . . . . . . . . 2.4 mm -56.04 -55.04 20.43 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.305 0 C-N-CA 126.475 1.91 . . . . 0.0 108.944 175.818 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 10' ' ' PHE . . . . . . . . . . . . . 38.6 t80 -49.1 -49.89 39.63 Favored 'General case' 0 N--CA 1.448 -0.534 0 O-C-N 121.725 -0.609 . . . . 0.0 109.846 179.797 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 51.0 mt-10 -62.05 -50.99 69.77 Favored 'General case' 0 N--CA 1.455 -0.197 0 C-N-CA 123.081 0.553 . . . . 0.0 110.567 179.417 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 68.9 tttt -44.52 -51.62 8.7 Favored 'General case' 0 CA--C 1.53 0.21 0 C-N-CA 124.341 1.057 . . . . 0.0 110.9 177.167 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 63.1 m-85 -78.4 -46.31 20.21 Favored 'General case' 0 CA--C 1.53 0.206 0 O-C-N 122.341 -0.224 . . . . 0.0 111.296 -176.403 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -57.23 -42.35 81.26 Favored 'General case' 0 C--N 1.329 -0.318 0 O-C-N 121.384 -0.823 . . . . 0.0 111.659 -178.427 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -51.62 -29.77 18.8 Favored 'General case' 0 CA--C 1.533 0.308 0 C-N-CA 123.603 0.761 . . . . 0.0 111.921 173.772 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 29.5 ttmt -67.48 -33.76 75.78 Favored 'General case' 0 CA--C 1.534 0.334 0 C-N-CA 122.843 0.457 . . . . 0.0 110.761 179.64 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 46.6 mm-40 -69.46 -48.91 59.3 Favored 'General case' 0 C--N 1.343 0.303 0 N-CA-C 107.728 -1.212 . . . . 0.0 107.728 168.224 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 147.58 -59.0 0.47 Allowed Glycine 0 N--CA 1.451 -0.33 0 N-CA-C 108.837 -1.705 . . . . 0.0 108.837 176.671 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 33.9 t0 -68.6 111.33 7.84 Favored Pre-proline 0 CA--C 1.534 0.338 0 CA-C-O 118.334 -0.841 . . . . 0.0 109.295 178.249 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 20' ' ' PRO . . . . . . . . . . . . . 36.4 Cg_endo -60.76 -20.82 67.6 Favored 'Trans proline' 0 N--CA 1.457 -0.62 0 C-N-CA 121.978 1.785 . . . . 0.0 112.63 -179.752 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 48.5 m-80 -85.06 -1.16 56.52 Favored 'General case' 0 N--CA 1.453 -0.288 0 C-N-CA 124.481 1.112 . . . . 0.0 113.137 -173.17 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 23.6 tt0 -151.27 124.99 9.05 Favored 'General case' 0 CA--C 1.542 0.637 0 CA-C-N 119.749 1.159 . . . . 0.0 113.887 -169.271 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 82.7 mt -98.82 138.11 36.44 Favored 'General case' 0 C--N 1.345 0.386 0 C-N-CA 125.296 1.438 . . . . 0.0 111.632 178.376 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 88.9 p -80.69 174.17 11.88 Favored 'General case' 0 CA--C 1.532 0.283 0 C-N-CA 123.466 0.706 . . . . 0.0 109.734 168.3 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 7.6 mtpm? -56.92 -44.28 82.26 Favored 'General case' 0 C--O 1.226 -0.173 0 N-CA-C 109.721 -0.474 . . . . 0.0 109.721 171.352 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 1.8 mp0 -63.09 -51.95 64.61 Favored 'General case' 0 N--CA 1.451 -0.424 0 C-N-CA 123.285 0.634 . . . . 0.0 110.259 -176.861 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -57.67 -41.77 82.23 Favored 'General case' 0 N--CA 1.451 -0.401 0 CA-C-O 118.564 -0.731 . . . . 0.0 110.422 176.687 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 14.3 mt -57.79 -43.66 85.74 Favored 'General case' 0 CA--C 1.513 -0.446 0 CA-C-N 119.614 1.097 . . . . 0.0 113.126 169.744 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 21.0 ttmm -61.11 -49.36 77.61 Favored 'General case' 0 N--CA 1.449 -0.497 0 CA-C-N 118.773 0.715 . . . . 0.0 109.857 -178.163 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 95.9 mt -62.02 -45.49 93.35 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.39 -0.368 . . . . 0.0 111.169 179.156 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 7.6 tt -50.84 -57.85 7.42 Favored 'General case' 0 C--O 1.232 0.132 0 C-N-CA 124.098 0.959 . . . . 0.0 109.405 173.668 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 40.7 mt -55.56 -58.01 9.53 Favored 'General case' 0 N--CA 1.455 -0.179 0 N-CA-C 109.637 -0.505 . . . . 0.0 109.637 -178.794 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 22.8 tt0 -53.07 -50.45 64.35 Favored 'General case' 0 N--CA 1.452 -0.349 0 C-N-CA 124.202 1.001 . . . . 0.0 111.674 -176.012 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 15.0 m -74.48 -49.97 20.11 Favored 'General case' 0 N--CA 1.453 -0.303 0 CA-C-N 116.34 -0.391 . . . . 0.0 110.898 -173.017 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 73.2 mm-40 -94.58 -32.5 13.41 Favored 'General case' 0 N--CA 1.448 -0.554 0 N-CA-C 112.685 0.624 . . . . 0.0 112.685 -167.06 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 81.6 m-85 -138.81 68.84 43.71 Favored Pre-proline 0 CA--C 1.538 0.494 0 C-N-CA 123.49 0.716 . . . . 0.0 112.443 -173.919 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 88.7 Cg_exo -47.51 -29.42 10.26 Favored 'Trans proline' 0 N--CA 1.459 -0.525 0 C-N-CA 123.479 2.786 . . . . 0.0 113.388 169.638 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 4.6 p -61.88 -66.84 0.48 Allowed 'General case' 0 N--CA 1.447 -0.614 0 C-N-CA 124.321 1.049 . . . . 0.0 108.695 175.034 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 95.8 mt -53.22 -35.51 60.0 Favored 'General case' 0 N--CA 1.456 -0.166 0 C-N-CA 124.48 1.112 . . . . 0.0 112.036 -178.628 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 19.5 tp -49.21 -42.04 39.0 Favored 'General case' 0 CA--C 1.534 0.359 0 C-N-CA 122.515 0.326 . . . . 0.0 111.301 174.488 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 5.7 mptp? -88.35 -36.5 16.57 Favored 'General case' 0 CA--C 1.533 0.3 0 C-N-CA 123.868 0.867 . . . . 0.0 110.882 176.841 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . -75.05 54.55 2.66 Favored Glycine 0 CA--C 1.531 1.078 0 C-N-CA 124.873 1.225 . . . . 0.0 113.631 -172.668 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 43' ' ' GLY . . . . . . . . . . . . . . . -176.48 142.41 5.93 Favored Glycine 0 CA--C 1.524 0.629 0 N-CA-C 108.266 -1.934 . . . . 0.0 108.266 174.874 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 44' ' ' SER . . . . . . . . . . . . . 3.4 m -48.47 -53.33 18.36 Favored 'General case' 0 CA--C 1.534 0.349 0 C-N-CA 124.865 1.266 . . . . 0.0 113.054 -169.943 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 45.7 p -150.93 161.27 43.04 Favored 'General case' 0 C--O 1.234 0.269 0 N-CA-C 107.003 -1.48 . . . . 0.0 107.003 169.401 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 57.3 tp -53.19 -43.4 67.14 Favored 'General case' 0 C--O 1.223 -0.305 0 N-CA-C 109.936 -0.394 . . . . 0.0 109.936 169.474 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 5.6 m-20 -58.96 -52.62 64.98 Favored 'General case' 0 N--CA 1.449 -0.524 0 C-N-CA 123.734 0.814 . . . . 0.0 111.027 179.781 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 33.8 mt-10 -59.37 -45.59 91.0 Favored 'General case' 0 N--CA 1.455 -0.18 0 CA-C-N 116.618 -0.265 . . . . 0.0 111.125 177.88 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 59.7 mt -54.9 -54.72 38.98 Favored 'General case' 0 C--O 1.224 -0.238 0 N-CA-C 109.636 -0.505 . . . . 0.0 109.636 174.802 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 50' ' ' PHE . . . . . . . . . . . . . 80.4 t80 -52.43 -49.92 63.6 Favored 'General case' 0 N--CA 1.449 -0.475 0 C-N-CA 123.965 0.906 . . . . 0.0 110.36 -177.527 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 27.7 tp10 -58.72 -48.34 81.5 Favored 'General case' 0 N--CA 1.454 -0.268 0 CA-C-O 120.755 0.312 . . . . 0.0 110.83 177.143 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 42.8 tt0 -56.68 -39.71 74.28 Favored 'General case' 0 CA--C 1.53 0.174 0 C-N-CA 123.631 0.772 . . . . 0.0 111.156 179.598 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 38.1 mt -78.71 -43.99 24.56 Favored 'General case' 0 N--CA 1.448 -0.56 0 C-N-CA 122.952 0.501 . . . . 0.0 112.114 -178.636 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 53.1 t0 -73.57 57.54 0.56 Allowed 'General case' 0 CA--C 1.538 0.493 0 C-N-CA 125.101 1.361 . . . . 0.0 111.361 -177.356 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 16.0 mmtp -61.4 -33.46 73.72 Favored 'General case' 0 C--N 1.333 -0.14 0 C-N-CA 124.083 0.953 . . . . 0.0 112.143 -177.161 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 56' ' ' ASN . . . . . . . . . . . . . 31.5 p30 -75.39 -9.53 58.65 Favored 'General case' 0 CA--C 1.536 0.434 0 N-CA-C 112.203 0.445 . . . . 0.0 112.203 176.775 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . 62.05 32.32 81.87 Favored Glycine 0 CA--C 1.53 0.999 0 CA-C-O 119.235 -0.759 . . . . 0.0 113.374 179.261 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 1.5 p30 -78.35 -6.99 56.76 Favored 'General case' 0 CA--C 1.535 0.381 0 CA-C-N 119.045 1.422 . . . . 0.0 112.634 -179.174 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . 88.02 11.51 67.4 Favored Glycine 0 CA--C 1.53 0.969 0 CA-C-N 118.399 0.545 . . . . 0.0 112.557 177.492 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 31.5 mt-10 -155.41 178.13 10.58 Favored 'General case' 0 N--CA 1.452 -0.331 0 C-N-CA 129.238 3.015 . . . . 0.0 104.944 173.726 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 61' ' ' VAL . . . . . . . . . . . . . 5.1 t -117.02 115.2 48.14 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.193 0 N-CA-C 109.685 -0.487 . . . . 0.0 109.685 -178.599 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 12.6 t -84.89 164.31 18.46 Favored 'General case' 0 CA--C 1.537 0.465 0 C-N-CA 122.65 0.38 . . . . 0.0 111.572 173.537 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 63' ' ' PHE . . . . . . . . . . . . . 64.4 t80 -62.01 -39.63 92.89 Favored 'General case' 0 N--CA 1.464 0.238 0 N-CA-C 112.65 0.611 . . . . 0.0 112.65 -170.044 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 50.9 mt-10 -62.33 -57.09 12.61 Favored 'General case' 0 N--CA 1.453 -0.292 0 N-CA-C 109.639 -0.504 . . . . 0.0 109.639 -178.471 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 20.3 pt-20 -64.28 -34.33 77.88 Favored 'General case' 0 CA--C 1.539 0.547 0 O-C-N 121.639 -0.663 . . . . 0.0 111.425 -179.692 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 17.8 t80 -52.03 -25.4 8.43 Favored 'General case' 0 CA--C 1.538 0.493 0 C-N-CA 123.828 0.851 . . . . 0.0 112.237 169.357 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 67' ' ' GLN . . . . . . . . . . . . . 45.6 mm-40 -54.64 -23.78 18.7 Favored 'General case' 0 CA--C 1.537 0.459 0 CA-C-N 119.745 1.157 . . . . 0.0 113.197 172.473 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 83.0 t -53.96 -33.16 23.55 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.485 0 CA-C-N 119.162 0.892 . . . . 0.0 110.817 170.469 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 19.3 tp -75.47 -53.11 9.2 Favored 'General case' 0 N--CA 1.452 -0.345 0 N-CA-C 108.134 -1.061 . . . . 0.0 108.134 173.163 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 70' ' ' VAL . . . . . . . . . . . . . 58.1 t -50.04 -44.75 22.34 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.352 0 CA-C-N 118.324 0.511 . . . . 0.0 111.74 -175.295 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 5.6 ptpp? -63.36 -37.37 87.01 Favored 'General case' 0 CA--C 1.529 0.169 0 O-C-N 121.573 -0.704 . . . . 0.0 112.127 179.274 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 72' ' ' LYS . . . . . . . . . . . . 0.273 0.1 OUTLIER -68.01 -44.39 76.66 Favored 'General case' 0 N--CA 1.443 -0.817 0 C-N-CA 125.558 1.543 . . . . 0.0 108.616 177.61 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 73' ' ' ILE . . . . . . . . . . . . . 65.3 mt -54.23 -45.7 67.51 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.335 0 O-C-N 121.327 -0.858 . . . . 0.0 109.007 171.503 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 11.1 m -73.03 3.1 5.8 Favored 'General case' 0 CA--C 1.538 0.498 0 N-CA-C 113.167 0.803 . . . . 0.0 113.167 177.983 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 75' ' ' GLN . . . . . . . . . . . . . 7.4 mm100 . . . . . 0 C--O 1.27 2.144 0 C-N-CA 126.848 2.059 . . . . 0.0 113.135 -177.845 . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' A' A ' 1' ' ' LYS . . . . . . . . . . . . . 73.9 mmtt . . . . . 0 N--CA 1.451 -0.394 0 N-CA-C 108.41 -0.959 . . . . 0.0 108.41 . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 86.6 p -79.22 158.99 73.7 Favored Pre-proline 0 CA--C 1.535 0.366 0 N-CA-C 109.178 -0.675 . . . . 0.0 109.178 171.87 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 85.8 Cg_exo -46.46 -39.78 22.52 Favored 'Trans proline' 0 N--CA 1.455 -0.78 0 C-N-CA 122.921 2.414 . . . . 0.0 112.015 168.786 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 2.8 mp0 -61.3 -47.07 87.64 Favored 'General case' 0 N--CA 1.455 -0.175 0 C-N-CA 123.841 0.857 . . . . 0.0 111.942 176.607 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -62.88 -44.23 96.67 Favored 'General case' 0 C--N 1.331 -0.215 0 N-CA-C 108.974 -0.75 . . . . 0.0 108.974 178.108 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 6' ' ' LEU . . . . . 0.475 HD13 HG22 ' A' ' 70' ' ' VAL . 12.8 mt -59.43 -40.58 87.2 Favored 'General case' 0 N--CA 1.449 -0.501 0 C-N-CA 122.646 0.379 . . . . 0.0 111.844 177.047 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 51.7 tptt -58.62 -47.11 85.46 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 118.414 0.552 . . . . 0.0 110.307 170.167 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . -52.89 -54.65 27.47 Favored Glycine 0 CA--C 1.53 0.989 0 N-CA-C 110.744 -0.943 . . . . 0.0 110.744 179.648 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 9' ' ' ILE . . . . . . . . . . . . . 65.9 mt -51.12 -58.14 2.25 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.13 0 C-N-CA 125.407 1.483 . . . . 0.0 109.523 171.639 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 10' ' ' PHE . . . . . . . . . . . . . 23.7 t80 -49.91 -48.11 51.84 Favored 'General case' 0 N--CA 1.442 -0.826 0 O-C-N 122.006 -0.434 . . . . 0.0 110.07 -175.883 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 55.3 mt-10 -64.88 -50.24 67.34 Favored 'General case' 0 N--CA 1.452 -0.33 0 C-N-CA 123.483 0.713 . . . . 0.0 110.636 179.118 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 21.8 ttpt -43.55 -50.37 7.22 Favored 'General case' 0 N--CA 1.461 0.114 0 C-N-CA 124.161 0.984 . . . . 0.0 110.384 175.422 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 59.6 m-85 -78.73 -44.97 22.24 Favored 'General case' 0 N--CA 1.449 -0.475 0 CA-C-N 116.47 -0.332 . . . . 0.0 111.862 -175.137 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -67.52 -35.04 78.34 Favored 'General case' 0 N--CA 1.466 0.342 0 C-N-CA 125.139 1.376 . . . . 0.0 113.24 -176.545 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -58.04 -29.36 65.29 Favored 'General case' 0 N--CA 1.452 -0.373 0 C-N-CA 123.039 0.536 . . . . 0.0 111.455 -178.956 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 9.0 mtmp? -58.69 -50.78 72.62 Favored 'General case' 0 CA--C 1.531 0.245 0 CA-C-N 117.945 0.338 . . . . 0.0 111.298 -176.097 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 31.3 tt0 -75.83 -40.46 54.81 Favored 'General case' 0 N--CA 1.457 -0.082 0 N-CA-C 110.0 -0.37 . . . . 0.0 110.0 177.667 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 163.08 -79.75 0.14 Allowed Glycine 0 C--N 1.335 0.496 0 C-N-CA 120.839 -0.696 . . . . 0.0 112.263 170.043 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 42.4 t0 -63.33 110.31 3.46 Favored Pre-proline 0 CA--C 1.533 0.315 0 CA-C-O 118.35 -0.834 . . . . 0.0 110.265 -169.947 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 20' ' ' PRO . . . . . . . . . . . . . 26.4 Cg_endo -58.1 -21.34 50.48 Favored 'Trans proline' 0 N--CA 1.456 -0.723 0 C-N-CA 122.001 1.801 . . . . 0.0 112.66 -178.72 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 38.8 m-80 -87.56 -7.18 57.87 Favored 'General case' 0 N--CA 1.453 -0.316 0 C-N-CA 124.831 1.253 . . . . 0.0 112.962 -175.521 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 9.9 tt0 -144.89 125.1 13.71 Favored 'General case' 0 CA--C 1.539 0.523 0 CA-C-N 119.294 0.952 . . . . 0.0 113.256 -171.942 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 52.1 mt -96.07 142.98 27.62 Favored 'General case' 0 C--N 1.343 0.284 0 C-N-CA 124.8 1.24 . . . . 0.0 111.423 179.349 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 93.2 p -92.35 174.61 7.2 Favored 'General case' 0 CA--C 1.538 0.512 0 C-N-CA 124.091 0.956 . . . . 0.0 108.974 167.029 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 97.6 mttt -54.6 -49.4 70.51 Favored 'General case' 0 C--N 1.339 0.135 0 O-C-N 121.895 -0.503 . . . . 0.0 111.49 -179.173 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 24.2 mt-10 -63.73 -43.51 96.31 Favored 'General case' 0 CA--C 1.519 -0.215 0 CA-C-O 121.234 0.54 . . . . 0.0 110.414 -175.105 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 57.6 mt-10 -58.22 -47.55 83.14 Favored 'General case' 0 N--CA 1.45 -0.426 0 CA-C-N 115.929 -0.578 . . . . 0.0 109.709 176.149 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 11.4 mt -56.8 -41.3 77.51 Favored 'General case' 0 CA--C 1.511 -0.545 0 N-CA-C 112.932 0.716 . . . . 0.0 112.932 171.683 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 84.8 tttt -61.5 -49.74 75.53 Favored 'General case' 0 C--N 1.324 -0.515 0 CA-C-N 118.747 0.703 . . . . 0.0 109.604 -178.37 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 10.4 mp -60.15 -46.89 88.13 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.394 -0.366 . . . . 0.0 111.101 177.847 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 7.5 tt -51.9 -57.27 9.89 Favored 'General case' 0 C--N 1.333 -0.12 0 C-N-CA 123.652 0.781 . . . . 0.0 109.682 175.366 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 43.2 mt -55.44 -53.61 54.15 Favored 'General case' 0 N--CA 1.454 -0.252 0 C-N-CA 123.994 0.918 . . . . 0.0 109.246 -178.522 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 22.7 tt0 -55.21 -46.48 75.91 Favored 'General case' 0 N--CA 1.451 -0.386 0 C-N-CA 123.665 0.786 . . . . 0.0 111.629 -177.508 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 5.3 m -73.96 -53.11 10.8 Favored 'General case' 0 CA--C 1.532 0.258 0 C-N-CA 120.916 -0.314 . . . . 0.0 111.03 -176.307 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 79.4 mm-40 -91.82 -39.05 11.98 Favored 'General case' 0 N--CA 1.45 -0.442 0 C-N-CA 123.762 0.825 . . . . 0.0 112.751 -166.953 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 17.7 m-85 -134.91 62.99 56.22 Favored Pre-proline 0 CA--C 1.539 0.541 0 N-CA-C 113.22 0.822 . . . . 0.0 113.22 -169.132 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 85.4 Cg_exo -46.84 -34.73 16.59 Favored 'Trans proline' 0 CA--C 1.535 0.551 0 C-N-CA 123.275 2.65 . . . . 0.0 112.924 169.547 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 2.6 p -52.86 -54.66 31.29 Favored 'General case' 0 N--CA 1.447 -0.605 0 C-N-CA 125.777 1.631 . . . . 0.0 109.642 176.731 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 76.5 mt -70.05 -38.36 75.77 Favored 'General case' 0 N--CA 1.451 -0.409 0 C-N-CA 123.776 0.83 . . . . 0.0 111.239 178.785 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 12.0 tp -52.16 -49.23 64.2 Favored 'General case' 0 CA--C 1.53 0.179 0 CA-C-O 121.027 0.441 . . . . 0.0 109.913 176.618 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 9.1 mtpm? -69.28 -49.44 55.99 Favored 'General case' 0 N--CA 1.451 -0.377 0 C-N-CA 123.61 0.764 . . . . 0.0 110.525 176.021 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . -75.73 62.31 2.81 Favored Glycine 0 CA--C 1.527 0.831 0 C-N-CA 124.945 1.26 . . . . 0.0 112.624 -173.876 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 43' ' ' GLY . . . . . . . . . . . . . . . -162.2 149.07 16.94 Favored Glycine 0 CA--C 1.521 0.437 0 N-CA-C 108.393 -1.883 . . . . 0.0 108.393 172.207 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 44' ' ' SER . . . . . . . . . . . . . 3.0 m -63.94 -45.06 90.86 Favored 'General case' 0 N--CA 1.453 -0.303 0 CA-C-N 117.842 0.821 . . . . 0.0 109.757 -179.119 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 41.3 p -152.81 160.95 43.11 Favored 'General case' 0 N--CA 1.452 -0.354 0 N-CA-C 107.177 -1.416 . . . . 0.0 107.177 170.816 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 52.6 tp -52.79 -44.19 66.42 Favored 'General case' 0 N--CA 1.457 -0.115 0 N-CA-C 109.375 -0.602 . . . . 0.0 109.375 168.864 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 5.0 m-20 -55.78 -52.56 63.54 Favored 'General case' 0 N--CA 1.449 -0.495 0 C-N-CA 124.575 1.15 . . . . 0.0 110.602 177.805 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 4.0 tm-20 -53.49 -52.27 60.1 Favored 'General case' 0 C--N 1.331 -0.218 0 C-N-CA 122.512 0.325 . . . . 0.0 110.784 176.22 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 95.6 mt -55.18 -49.53 71.63 Favored 'General case' 0 CA--C 1.529 0.169 0 CA-C-O 121.282 0.563 . . . . 0.0 110.305 178.671 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 50' ' ' PHE . . . . . . . . . . . . . 62.4 t80 -55.49 -50.67 69.3 Favored 'General case' 0 N--CA 1.45 -0.426 0 C-N-CA 123.827 0.851 . . . . 0.0 110.828 -179.115 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 36.0 mt-10 -59.3 -45.93 89.94 Favored 'General case' 0 N--CA 1.454 -0.234 0 C-N-CA 123.289 0.636 . . . . 0.0 110.547 177.994 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 12.5 tm-20 -56.25 -46.16 79.73 Favored 'General case' 0 N--CA 1.456 -0.172 0 C-N-CA 123.358 0.663 . . . . 0.0 110.072 178.708 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 91.6 mt -72.6 -43.34 63.44 Favored 'General case' 0 N--CA 1.45 -0.435 0 C-N-CA 123.021 0.528 . . . . 0.0 112.04 -176.58 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 47.4 t0 -73.54 66.24 1.0 Allowed 'General case' 0 CA--C 1.537 0.459 0 C-N-CA 124.206 1.002 . . . . 0.0 112.206 -172.616 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 14.2 mptt -49.95 -43.64 50.11 Favored 'General case' 0 CA--C 1.531 0.234 0 C-N-CA 124.299 1.04 . . . . 0.0 112.127 173.766 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 56' ' ' ASN . . . . . . . . . . . . . 7.5 p30 -70.71 -14.12 62.33 Favored 'General case' 0 CA--C 1.536 0.432 0 N-CA-C 112.518 0.562 . . . . 0.0 112.518 -177.349 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . 66.99 18.06 68.39 Favored Glycine 0 CA--C 1.53 1.022 0 CA-C-O 119.063 -0.854 . . . . 0.0 114.327 173.038 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 3.0 p-10 -79.64 -3.05 45.42 Favored 'General case' 0 CA--C 1.533 0.318 0 CA-C-N 119.411 1.605 . . . . 0.0 113.058 -177.635 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . 81.55 30.08 37.63 Favored Glycine 0 CA--C 1.528 0.859 0 CA-C-O 119.63 -0.539 . . . . 0.0 111.841 178.903 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 30.3 mt-10 -156.43 176.09 13.16 Favored 'General case' 0 CA--C 1.528 0.129 0 C-N-CA 128.145 2.578 . . . . 0.0 105.924 169.904 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 61' ' ' VAL . . . . . . . . . . . . . 3.5 t -123.57 115.36 45.07 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.183 0 N-CA-C 109.373 -0.603 . . . . 0.0 109.373 179.582 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 62.4 p -77.95 156.96 29.92 Favored 'General case' 0 CA--C 1.532 0.267 0 C-N-CA 123.515 0.726 . . . . 0.0 110.395 177.794 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 63' ' ' PHE . . . . . . . . . . . . . 71.4 t80 -55.11 -34.97 64.15 Favored 'General case' 0 N--CA 1.463 0.207 0 N-CA-C 112.318 0.488 . . . . 0.0 112.318 178.042 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 45.8 mt-10 -58.1 -67.56 0.33 Allowed 'General case' 0 N--CA 1.452 -0.339 0 N-CA-C 109.903 -0.406 . . . . 0.0 109.903 176.78 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 9.8 pt-20 -65.24 -28.55 69.44 Favored 'General case' 0 CA--C 1.534 0.348 0 O-C-N 121.842 -0.536 . . . . 0.0 111.669 -175.015 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 8.2 t80 -49.15 -29.88 5.98 Favored 'General case' 0 CA--C 1.532 0.276 0 C-N-CA 123.391 0.677 . . . . 0.0 112.283 169.102 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 67' ' ' GLN . . . . . . . . . . . . . 97.8 mm-40 -56.86 -19.93 20.25 Favored 'General case' 0 CA--C 1.54 0.571 0 CA-C-N 119.661 1.119 . . . . 0.0 112.933 175.993 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 69.8 t -56.97 -34.29 44.23 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.552 0 CA-C-N 119.61 1.095 . . . . 0.0 110.878 169.472 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 9.4 tt -70.9 -44.36 66.42 Favored 'General case' 0 N--CA 1.456 -0.147 0 N-CA-C 107.179 -1.415 . . . . 0.0 107.179 -179.675 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 70' ' ' VAL . . . . . 0.475 HG22 HD13 ' A' ' 6' ' ' LEU . 22.2 t -58.96 -43.62 89.17 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.371 0 N-CA-C 109.913 -0.403 . . . . 0.0 109.913 176.879 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 79.0 tttt -53.46 -53.59 49.24 Favored 'General case' 0 N--CA 1.455 -0.206 0 C-N-CA 122.88 0.472 . . . . 0.0 110.545 171.628 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 5.5 mptp? -50.34 -45.45 54.98 Favored 'General case' 0 CA--C 1.537 0.475 0 N-CA-C 112.073 0.397 . . . . 0.0 112.073 174.604 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 73' ' ' ILE . . . . . . . . . . . . . 52.2 mt -59.29 -53.65 45.16 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.307 0 CA-C-N 118.361 0.528 . . . . 0.0 110.216 176.302 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 2.5 m 64.06 -39.93 0.22 Allowed 'General case' 0 CA--C 1.537 0.468 0 C-N-CA 128.095 2.558 . . . . 0.0 115.274 -175.54 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 75' ' ' GLN . . . . . . . . . . . . . 38.4 mm-40 . . . . . 0 C--O 1.27 2.156 0 O-C-N 121.418 -0.801 . . . . 0.0 110.487 -174.886 . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' A' A ' 1' ' ' LYS . . . . . . . . . . . . . 29.3 mttp . . . . . 0 N--CA 1.45 -0.436 0 N-CA-C 108.469 -0.937 . . . . 0.0 108.469 . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 90.7 p -72.44 153.12 91.99 Favored Pre-proline 0 CA--C 1.534 0.345 0 CA-C-O 118.931 -0.557 . . . . 0.0 110.053 177.639 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 99.2 Cg_exo -44.2 -42.13 13.16 Favored 'Trans proline' 0 N--CA 1.458 -0.58 0 C-N-CA 123.305 2.67 . . . . 0.0 112.463 169.571 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 2.9 mp0 -58.59 -50.33 74.2 Favored 'General case' 0 N--CA 1.454 -0.246 0 C-N-CA 123.762 0.825 . . . . 0.0 111.971 176.473 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 31.9 mt-10 -60.35 -45.57 93.02 Favored 'General case' 0 C--N 1.332 -0.183 0 N-CA-C 109.101 -0.703 . . . . 0.0 109.101 178.254 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 20.2 mt -59.45 -38.03 79.67 Favored 'General case' 0 N--CA 1.446 -0.651 0 C-N-CA 122.841 0.457 . . . . 0.0 111.998 178.116 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 78.3 tttt -64.55 -44.48 90.62 Favored 'General case' 0 N--CA 1.449 -0.504 0 CA-C-N 118.292 0.496 . . . . 0.0 110.664 172.769 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . -54.55 -51.71 50.18 Favored Glycine 0 CA--C 1.529 0.966 0 N-CA-C 109.893 -1.283 . . . . 0.0 109.893 177.709 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 9' ' ' ILE . . . . . . . . . . . . . 63.1 mt -53.84 -56.79 7.46 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.23 0 C-N-CA 125.935 1.694 . . . . 0.0 110.055 173.245 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 10' ' ' PHE . . . . . . . . . . . . . 51.9 t80 -45.97 -53.43 10.01 Favored 'General case' 0 N--CA 1.451 -0.414 0 C-N-CA 123.169 0.588 . . . . 0.0 109.843 179.019 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 44.3 mt-10 -62.8 -51.92 65.21 Favored 'General case' 0 CA--C 1.532 0.265 0 C-N-CA 122.756 0.423 . . . . 0.0 110.731 -178.591 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 26.4 ttpt -45.8 -53.72 9.16 Favored 'General case' 0 C--N 1.338 0.102 0 C-N-CA 125.15 1.38 . . . . 0.0 111.077 178.186 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 57.0 m-85 -77.28 -44.36 30.03 Favored 'General case' 0 N--CA 1.45 -0.44 0 N-CA-C 110.107 -0.331 . . . . 0.0 110.107 -175.456 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -52.99 -45.92 68.07 Favored 'General case' 0 C--O 1.225 -0.204 0 C-N-CA 123.652 0.781 . . . . 0.0 111.897 178.956 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -64.03 -19.78 65.45 Favored 'General case' 0 C--N 1.331 -0.21 0 N-CA-C 113.007 0.743 . . . . 0.0 113.007 178.075 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 36.9 ttmt -71.75 87.32 0.96 Allowed 'General case' 0 N--CA 1.448 -0.563 0 N-CA-C 107.685 -1.228 . . . . 0.0 107.685 -178.952 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 12.1 tm-20 78.57 -46.2 0.41 Allowed 'General case' 0 CA--C 1.531 0.217 0 C-N-CA 126.275 1.83 . . . . 0.0 111.206 -178.102 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . -67.26 176.74 22.29 Favored Glycine 0 CA--C 1.532 1.101 0 CA-C-O 121.833 0.685 . . . . 0.0 111.656 177.387 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 10.5 t70 -79.08 135.59 58.29 Favored Pre-proline 0 CA--C 1.532 0.268 0 N-CA-C 107.486 -1.302 . . . . 0.0 107.486 172.653 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 20' ' ' PRO . . . . . . . . . . . . . 19.2 Cg_endo -52.54 -26.9 30.44 Favored 'Trans proline' 0 CA--C 1.535 0.567 0 C-N-CA 122.919 2.413 . . . . 0.0 113.988 -179.162 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 44.8 m-80 -85.0 -7.59 59.08 Favored 'General case' 0 N--CA 1.453 -0.289 0 C-N-CA 123.779 0.832 . . . . 0.0 112.877 -178.523 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 11.4 tt0 -156.87 117.63 3.64 Favored 'General case' 0 CA--C 1.538 0.482 0 CA-C-N 119.648 1.113 . . . . 0.0 112.903 -169.017 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 19.2 mt -79.66 136.31 36.77 Favored 'General case' 0 C--O 1.234 0.278 0 C-N-CA 124.566 1.146 . . . . 0.0 110.918 179.43 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 12.4 p -97.42 -179.62 4.55 Favored 'General case' 0 CA--C 1.54 0.583 0 N-CA-C 107.322 -1.362 . . . . 0.0 107.322 164.796 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 62.4 mttp -55.14 -47.11 75.55 Favored 'General case' 0 C--O 1.226 -0.135 0 O-C-N 121.941 -0.475 . . . . 0.0 112.157 -173.097 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 34.4 tt0 -64.09 -46.3 84.88 Favored 'General case' 0 N--CA 1.456 -0.173 0 CA-C-N 118.16 0.436 . . . . 0.0 110.62 -174.54 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 2.6 mp0 -54.7 -49.93 69.52 Favored 'General case' 0 N--CA 1.451 -0.414 0 N-CA-C 109.578 -0.527 . . . . 0.0 109.578 175.214 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 9.6 mt -55.88 -43.74 77.48 Favored 'General case' 0 CA--C 1.51 -0.573 0 N-CA-C 113.266 0.839 . . . . 0.0 113.266 173.473 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 84.8 tttt -62.45 -48.54 79.21 Favored 'General case' 0 C--N 1.323 -0.567 0 CA-C-N 118.512 0.596 . . . . 0.0 109.769 -175.858 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 81.5 mt -62.44 -47.51 83.75 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.875 178.905 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 6.7 tt -49.5 -58.22 5.59 Favored 'General case' 0 CA--C 1.522 -0.12 0 C-N-CA 123.979 0.912 . . . . 0.0 109.264 174.023 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 39.9 mt -56.68 -57.99 10.01 Favored 'General case' 0 N--CA 1.451 -0.4 0 C-N-CA 123.533 0.733 . . . . 0.0 109.281 -177.404 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 7.0 tp-100 -52.2 -49.7 63.38 Favored 'General case' 0 N--CA 1.455 -0.206 0 C-N-CA 123.04 0.536 . . . . 0.0 111.161 -176.343 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 11.4 m -75.74 -49.38 18.37 Favored 'General case' 0 N--CA 1.454 -0.258 0 CA-C-N 116.223 -0.444 . . . . 0.0 111.069 -171.574 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 70.4 mm-40 -89.67 -29.25 18.92 Favored 'General case' 0 N--CA 1.45 -0.458 0 C-N-CA 123.362 0.665 . . . . 0.0 111.771 -169.465 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 94.1 m-85 -146.07 65.0 10.47 Favored Pre-proline 0 CA--C 1.537 0.443 0 C-N-CA 124.425 1.09 . . . . 0.0 111.63 -174.66 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 37.9 Cg_endo -58.86 -28.36 87.01 Favored 'Trans proline' 0 N--CA 1.457 -0.675 0 C-N-CA 122.29 1.993 . . . . 0.0 110.894 178.008 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 2.8 p -53.65 -57.1 12.02 Favored 'General case' 0 N--CA 1.447 -0.59 0 C-N-CA 125.992 1.717 . . . . 0.0 109.421 173.279 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 94.2 mt -63.64 -43.95 95.29 Favored 'General case' 0 N--CA 1.452 -0.341 0 C-N-CA 123.768 0.827 . . . . 0.0 110.908 178.754 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 3.2 tm? -52.23 -50.02 62.83 Favored 'General case' 0 CA--C 1.527 0.094 0 CA-C-O 120.954 0.407 . . . . 0.0 110.1 -179.424 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 97.9 mttt -74.35 -63.57 1.21 Allowed 'General case' 0 N--CA 1.45 -0.427 0 CA-C-O 121.757 0.789 . . . . 0.0 110.293 179.368 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . -80.45 68.04 3.4 Favored Glycine 0 CA--C 1.523 0.589 0 C-N-CA 124.59 1.09 . . . . 0.0 110.795 -177.32 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 43' ' ' GLY . . . . . . . . . . . . . . . -163.43 176.83 39.54 Favored Glycine 0 CA--C 1.524 0.594 0 N-CA-C 110.208 -1.157 . . . . 0.0 110.208 176.881 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 44' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -57.18 162.32 2.7 Favored 'General case' 0 N--CA 1.452 -0.344 0 C-N-CA 124.072 0.949 . . . . 0.0 110.123 172.859 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 68.7 p -61.96 155.74 22.88 Favored 'General case' 0 CA--C 1.532 0.286 0 N-CA-C 108.735 -0.839 . . . . 0.0 108.735 173.778 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 66.6 tp -50.27 -46.87 55.41 Favored 'General case' 0 C--O 1.224 -0.246 0 O-C-N 121.968 -0.458 . . . . 0.0 111.714 -171.395 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 5.3 m-20 -60.6 -46.11 91.46 Favored 'General case' 0 N--CA 1.451 -0.4 0 C-N-CA 123.339 0.656 . . . . 0.0 111.542 179.803 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 93.0 mt-10 -59.64 -52.12 66.91 Favored 'General case' 0 N--CA 1.455 -0.181 0 N-CA-C 109.557 -0.535 . . . . 0.0 109.557 177.383 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 46.9 tp -58.47 -46.39 86.71 Favored 'General case' 0 N--CA 1.452 -0.364 0 N-CA-C 109.416 -0.587 . . . . 0.0 109.416 -178.147 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 50' ' ' PHE . . . . . . . . . . . . . 71.2 t80 -54.6 -50.11 68.83 Favored 'General case' 0 N--CA 1.449 -0.497 0 C-N-CA 123.934 0.894 . . . . 0.0 110.249 177.281 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 41.2 tt0 -57.35 -49.84 74.88 Favored 'General case' 0 N--CA 1.453 -0.279 0 C-N-CA 122.275 0.23 . . . . 0.0 110.761 177.411 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 39.9 mt-10 -55.18 -44.57 75.36 Favored 'General case' 0 CA--C 1.53 0.196 0 C-N-CA 123.141 0.576 . . . . 0.0 111.458 178.931 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 84.7 mt -71.3 -42.66 68.38 Favored 'General case' 0 N--CA 1.451 -0.388 0 C-N-CA 122.955 0.502 . . . . 0.0 111.582 -178.879 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 21.4 t0 -70.59 72.08 0.5 Allowed 'General case' 0 CA--C 1.534 0.331 0 C-N-CA 124.289 1.036 . . . . 0.0 110.363 177.553 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 2.7 mmmp? -65.39 -33.08 75.13 Favored 'General case' 0 N--CA 1.452 -0.369 0 C-N-CA 123.071 0.548 . . . . 0.0 111.66 172.941 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 56' ' ' ASN . . . . . . . . . . . . . 1.1 p30 -64.71 -39.46 93.69 Favored 'General case' 0 CA--C 1.535 0.366 0 C-N-CA 122.561 0.344 . . . . 0.0 111.319 -175.864 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . 110.09 -11.24 31.67 Favored Glycine 0 CA--C 1.531 1.049 0 C-N-CA 124.115 0.864 . . . . 0.0 114.09 172.021 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 9.5 p-10 -78.15 11.37 2.35 Favored 'General case' 0 CA--C 1.535 0.367 0 CA-C-N 119.696 1.748 . . . . 0.0 113.84 -171.56 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . 70.33 32.66 68.4 Favored Glycine 0 CA--C 1.526 0.739 0 CA-C-O 118.894 -0.948 . . . . 0.0 112.156 177.596 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 46.9 mt-10 -157.91 171.25 20.6 Favored 'General case' 0 CA--C 1.532 0.254 0 C-N-CA 126.6 1.96 . . . . 0.0 107.466 169.929 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 61' ' ' VAL . . . . . . . . . . . . . 4.4 t -127.78 111.75 25.6 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.408 0 C-N-CA 123.006 0.522 . . . . 0.0 111.213 -169.679 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 8.6 t -83.3 177.4 8.53 Favored 'General case' 0 CA--C 1.537 0.467 0 CA-C-O 121.249 0.547 . . . . 0.0 111.991 172.572 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 63' ' ' PHE . . . . . . . . . . . . . 40.2 t80 -64.97 -47.59 77.06 Favored 'General case' 0 N--CA 1.461 0.086 0 C-N-CA 123.615 0.766 . . . . 0.0 112.723 -168.693 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 23.1 mp0 -59.87 -56.24 24.19 Favored 'General case' 0 N--CA 1.452 -0.342 0 N-CA-C 108.862 -0.792 . . . . 0.0 108.862 -175.984 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 18.0 pt-20 -62.84 -35.1 78.85 Favored 'General case' 0 CA--C 1.537 0.45 0 N-CA-C 112.102 0.408 . . . . 0.0 112.102 179.429 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 7.4 t80 -50.06 -31.73 13.81 Favored 'General case' 0 CA--C 1.535 0.397 0 O-C-N 121.172 -0.955 . . . . 0.0 112.403 169.542 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 67' ' ' GLN . . . . . . . . . . . . . 14.7 mm-40 -55.66 -20.43 14.07 Favored 'General case' 0 CA--C 1.54 0.593 0 CA-C-N 119.388 0.995 . . . . 0.0 113.372 174.265 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 76.8 t -53.63 -28.8 16.58 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.56 0 CA-C-N 119.654 1.116 . . . . 0.0 110.929 169.942 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 31.1 tp -70.69 -39.13 73.66 Favored 'General case' 0 CA--C 1.532 0.27 0 O-C-N 121.094 -1.004 . . . . 0.0 108.293 176.706 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 70' ' ' VAL . . . . . . . . . . . . . 11.5 t -66.54 -36.23 76.8 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.256 0 O-C-N 121.786 -0.571 . . . . 0.0 109.699 176.911 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 79.0 tttt -56.14 -53.35 58.11 Favored 'General case' 0 CA--C 1.532 0.265 0 O-C-N 122.004 -0.435 . . . . 0.0 110.167 168.957 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 2.7 mptm? -49.48 -45.58 47.04 Favored 'General case' 0 CA--C 1.536 0.429 0 N-CA-C 112.106 0.41 . . . . 0.0 112.106 174.601 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 73' ' ' ILE . . . . . . . . . . . . . 98.6 mt -58.75 -56.99 13.12 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.324 0 N-CA-C 109.735 -0.469 . . . . 0.0 109.735 175.542 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 12.0 t -178.18 -70.91 0.01 OUTLIER 'General case' 0 N--CA 1.454 -0.235 0 C-N-CA 126.182 1.793 . . . . 0.0 108.817 178.829 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 75' ' ' GLN . . . . . . . . . . . . . 25.4 mp0 . . . . . 0 C--O 1.27 2.182 0 CA-C-O 121.431 0.634 . . . . 0.0 109.318 -174.134 . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' A' A ' 1' ' ' LYS . . . . . . . . . . . . . 2.5 mptp? . . . . . 0 N--CA 1.45 -0.461 0 N-CA-C 108.336 -0.987 . . . . 0.0 108.336 . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 80.7 p -68.7 160.79 75.48 Favored Pre-proline 0 CA--C 1.535 0.39 0 N-CA-C 109.301 -0.629 . . . . 0.0 109.301 169.926 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 98.0 Cg_exo -45.69 -41.91 19.24 Favored 'Trans proline' 0 N--CA 1.459 -0.501 0 C-N-CA 123.168 2.579 . . . . 0.0 112.619 169.803 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 45.0 mt-10 -61.79 -45.51 93.58 Favored 'General case' 0 N--CA 1.454 -0.256 0 C-N-CA 123.046 0.539 . . . . 0.0 111.249 178.152 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 31.7 mt-10 -65.28 -44.3 88.43 Favored 'General case' 0 N--CA 1.45 -0.436 0 N-CA-C 109.108 -0.701 . . . . 0.0 109.108 178.378 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 14.6 mt -55.02 -42.87 73.12 Favored 'General case' 0 N--CA 1.453 -0.323 0 C-N-CA 123.684 0.794 . . . . 0.0 111.075 175.843 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 23.3 tptm -61.53 -52.14 65.7 Favored 'General case' 0 C--O 1.226 -0.136 0 CA-C-N 118.483 0.583 . . . . 0.0 111.113 172.954 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . -51.06 -49.3 43.49 Favored Glycine 0 CA--C 1.533 1.18 0 N-CA-C 111.081 -0.808 . . . . 0.0 111.081 179.297 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 9' ' ' ILE . . . . . . . . . . . . . 3.0 mm -58.81 -55.48 22.9 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.257 0 C-N-CA 126.885 2.074 . . . . 0.0 109.037 176.46 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 10' ' ' PHE . . . . . . . . . . . . . 58.7 t80 -46.15 -52.24 12.61 Favored 'General case' 0 N--CA 1.451 -0.398 0 C-N-CA 123.242 0.617 . . . . 0.0 109.938 177.785 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 52.6 mt-10 -62.06 -51.56 67.49 Favored 'General case' 0 CA--C 1.532 0.287 0 C-N-CA 123.213 0.605 . . . . 0.0 110.738 -179.986 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 67.2 tttt -44.65 -51.91 8.7 Favored 'General case' 0 N--CA 1.462 0.15 0 C-N-CA 124.877 1.271 . . . . 0.0 111.128 177.7 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 58.1 m-85 -77.75 -46.24 22.3 Favored 'General case' 0 N--CA 1.454 -0.259 0 O-C-N 122.304 -0.248 . . . . 0.0 110.645 -175.532 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -56.34 -41.48 76.13 Favored 'General case' 0 C--N 1.332 -0.17 0 C-N-CA 123.491 0.716 . . . . 0.0 111.793 -179.655 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -46.58 -36.06 6.49 Favored 'General case' 0 CA--C 1.53 0.181 0 C-N-CA 124.518 1.127 . . . . 0.0 112.232 177.8 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 46.0 mtmt -59.48 -31.21 69.13 Favored 'General case' 0 CA--C 1.536 0.404 0 CA-C-N 118.464 0.575 . . . . 0.0 111.835 -179.622 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 25.3 tp10 -71.68 -22.06 61.71 Favored 'General case' 0 CA--C 1.532 0.262 0 C-N-CA 123.843 0.857 . . . . 0.0 111.208 175.821 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 108.91 -53.28 0.6 Allowed Glycine 0 CA--C 1.523 0.553 0 N-CA-C 108.694 -1.763 . . . . 0.0 108.694 -171.159 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 42.9 t0 -81.17 112.45 32.99 Favored Pre-proline 0 CA--C 1.537 0.475 0 CA-C-O 118.636 -0.697 . . . . 0.0 110.443 179.548 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 20' ' ' PRO . . . . . . . . . . . . . 41.4 Cg_endo -65.53 -21.79 59.49 Favored 'Trans proline' 0 N--CA 1.458 -0.598 0 C-N-CA 122.059 1.839 . . . . 0.0 113.201 177.143 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 51.0 m-80 -81.51 -4.12 55.04 Favored 'General case' 0 C--O 1.234 0.272 0 N-CA-C 113.58 0.955 . . . . 0.0 113.58 -169.21 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 43.5 tt0 -155.52 130.87 9.59 Favored 'General case' 0 CA--C 1.533 0.322 0 CA-C-N 119.333 0.969 . . . . 0.0 112.428 -168.311 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 40.2 mt -102.66 123.58 46.63 Favored 'General case' 0 N--CA 1.453 -0.283 0 C-N-CA 124.651 1.18 . . . . 0.0 111.85 179.13 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -84.21 170.84 13.33 Favored 'General case' 0 CA--C 1.537 0.471 0 C-N-CA 123.625 0.77 . . . . 0.0 109.591 165.202 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 98.4 mttt -51.14 -49.94 59.85 Favored 'General case' 0 C--N 1.339 0.123 0 N-CA-C 113.333 0.864 . . . . 0.0 113.333 -168.949 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 38.6 tp10 -63.2 -45.12 93.21 Favored 'General case' 0 N--CA 1.456 -0.152 0 O-C-N 121.983 -0.448 . . . . 0.0 111.045 -173.249 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 1.9 mp0 -53.66 -51.19 63.94 Favored 'General case' 0 N--CA 1.452 -0.358 0 N-CA-C 109.598 -0.519 . . . . 0.0 109.598 173.319 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 9.2 mt -55.73 -41.72 74.29 Favored 'General case' 0 CA--C 1.513 -0.472 0 N-CA-C 113.173 0.805 . . . . 0.0 113.173 173.748 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 60.0 tttm -61.82 -51.96 66.13 Favored 'General case' 0 C--N 1.325 -0.494 0 CA-C-N 118.67 0.668 . . . . 0.0 109.82 -177.249 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 10.5 mp -63.2 -44.09 96.32 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.146 -0.479 . . . . 0.0 110.606 -179.936 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 7.4 tt -50.32 -58.25 6.07 Favored 'General case' 0 C--N 1.332 -0.167 0 C-N-CA 123.789 0.835 . . . . 0.0 109.543 173.074 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 29.4 mt -54.19 -62.13 1.85 Allowed 'General case' 0 N--CA 1.455 -0.193 0 C-N-CA 123.561 0.744 . . . . 0.0 109.605 -179.103 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 25.5 tt0 -55.73 -45.08 78.05 Favored 'General case' 0 N--CA 1.452 -0.331 0 C-N-CA 123.575 0.75 . . . . 0.0 111.534 -173.096 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 19.8 m -78.44 -48.0 16.33 Favored 'General case' 0 C--N 1.33 -0.28 0 C-N-CA 122.367 0.267 . . . . 0.0 111.313 -173.376 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 66.7 mm-40 -96.42 -31.02 13.05 Favored 'General case' 0 N--CA 1.45 -0.463 0 N-CA-C 112.766 0.654 . . . . 0.0 112.766 -167.748 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 69.7 m-85 -139.41 60.31 16.5 Favored Pre-proline 0 CA--C 1.53 0.197 0 C-N-CA 123.522 0.729 . . . . 0.0 110.462 -176.205 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 21.1 Cg_endo -55.07 -30.12 68.73 Favored 'Trans proline' 0 N--CA 1.457 -0.669 0 C-N-CA 122.904 2.403 . . . . 0.0 111.956 -172.997 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 1.5 m -54.06 -44.97 71.55 Favored 'General case' 0 N--CA 1.45 -0.449 0 C-N-CA 124.875 1.27 . . . . 0.0 110.314 178.754 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 58.2 mt -65.97 -21.26 66.41 Favored 'General case' 0 N--CA 1.454 -0.241 0 C-N-CA 123.793 0.837 . . . . 0.0 111.986 -177.037 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 21.8 tp -66.38 -29.87 70.14 Favored 'General case' 0 N--CA 1.454 -0.263 0 CA-C-N 117.956 0.344 . . . . 0.0 110.252 175.323 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 2.6 mptp? -87.21 154.74 20.48 Favored 'General case' 0 N--CA 1.438 -1.031 0 N-CA-C 106.646 -1.612 . . . . 0.0 106.646 167.599 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . 77.24 -42.74 1.94 Allowed Glycine 0 CA--C 1.531 1.089 0 O-C-N 121.666 -0.647 . . . . 0.0 112.742 176.145 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 43' ' ' GLY . . . . . . . . . . . . . . . -67.96 69.02 0.32 Allowed Glycine 0 CA--C 1.532 1.145 0 C-N-CA 124.55 1.071 . . . . 0.0 112.323 177.202 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 44' ' ' SER . . . . . . . . . . . . . 80.5 p 34.07 -93.12 0.01 OUTLIER 'General case' 0 N--CA 1.451 -0.394 0 C-N-CA 128.681 2.792 . . . . 0.0 113.988 169.895 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 82.2 p -141.17 167.86 21.16 Favored 'General case' 0 N--CA 1.454 -0.238 0 N-CA-C 105.506 -2.035 . . . . 0.0 105.506 168.709 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 58.8 tp -55.79 -46.88 77.9 Favored 'General case' 0 C--O 1.226 -0.153 0 CA-C-N 118.904 0.774 . . . . 0.0 110.775 174.051 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 5.7 m-20 -61.03 -54.5 44.06 Favored 'General case' 0 N--CA 1.45 -0.431 0 C-N-CA 123.395 0.678 . . . . 0.0 110.788 -179.215 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 59.1 mm-40 -58.29 -43.67 88.17 Favored 'General case' 0 N--CA 1.455 -0.217 0 C-N-CA 120.681 -0.407 . . . . 0.0 110.535 178.676 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 46.5 tp -61.17 -47.47 86.02 Favored 'General case' 0 N--CA 1.452 -0.335 0 N-CA-C 109.746 -0.465 . . . . 0.0 109.746 179.816 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 50' ' ' PHE . . . . . . . . . . . . . 70.4 t80 -51.96 -49.61 62.87 Favored 'General case' 0 C--N 1.331 -0.209 0 C-N-CA 124.022 0.929 . . . . 0.0 110.367 176.595 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 36.0 mt-10 -62.46 -44.11 97.2 Favored 'General case' 0 CA--C 1.532 0.266 0 C-N-CA 122.45 0.3 . . . . 0.0 111.687 177.464 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 34.4 mt-10 -57.36 -40.75 78.75 Favored 'General case' 0 C--N 1.332 -0.183 0 C-N-CA 122.921 0.488 . . . . 0.0 110.962 176.097 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 94.6 mt -66.33 -67.32 0.46 Allowed 'General case' 0 N--CA 1.449 -0.499 0 C-N-CA 123.054 0.542 . . . . 0.0 109.971 176.732 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 39.8 t0 -87.69 74.97 9.07 Favored 'General case' 0 N--CA 1.454 -0.267 0 N-CA-C 108.192 -1.04 . . . . 0.0 108.192 177.368 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 46.7 tptt -81.65 -30.44 32.76 Favored 'General case' 0 N--CA 1.452 -0.342 0 CA-C-N 115.652 -0.703 . . . . 0.0 111.369 179.471 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 56' ' ' ASN . . . . . . . . . . . . . 31.7 p-10 -139.96 29.82 2.06 Favored 'General case' 0 CA--C 1.528 0.131 0 C-N-CA 123.669 0.788 . . . . 0.0 112.029 -170.533 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . -109.48 -97.89 2.49 Favored Glycine 0 C--N 1.339 0.721 0 N-CA-C 108.977 -1.649 . . . . 0.0 108.977 174.576 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 5.1 p-10 -139.81 -45.5 0.44 Allowed 'General case' 0 N--CA 1.446 -0.637 0 C-N-CA 125.625 1.57 . . . . 0.0 111.782 -170.66 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . 158.38 -64.3 0.3 Allowed Glycine 0 CA--C 1.526 0.739 0 N-CA-C 107.931 -2.068 . . . . 0.0 107.931 -173.65 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 11.3 mp0 -78.83 132.29 36.79 Favored 'General case' 0 N--CA 1.454 -0.266 0 N-CA-C 108.375 -0.972 . . . . 0.0 108.375 -177.195 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 61' ' ' VAL . . . . . . . . . . . . . 15.2 t -79.18 110.54 15.01 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.375 0 C-N-CA 123.399 0.68 . . . . 0.0 111.397 -166.42 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 8.7 t -79.36 172.91 13.14 Favored 'General case' 0 CA--C 1.537 0.465 0 CA-C-O 120.815 0.34 . . . . 0.0 111.316 169.668 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 63' ' ' PHE . . . . . . . . . . . . . 55.1 t80 -63.45 -36.83 85.04 Favored 'General case' 0 N--CA 1.464 0.265 0 N-CA-C 113.3 0.852 . . . . 0.0 113.3 -168.679 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 21.1 mp0 -67.55 -58.4 4.77 Favored 'General case' 0 N--CA 1.453 -0.321 0 N-CA-C 108.864 -0.791 . . . . 0.0 108.864 -177.857 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 17.8 pt-20 -59.58 -35.04 73.49 Favored 'General case' 0 CA--C 1.539 0.549 0 O-C-N 121.775 -0.578 . . . . 0.0 111.796 177.351 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 19.2 t80 -51.39 -28.6 13.13 Favored 'General case' 0 CA--C 1.534 0.344 0 O-C-N 121.288 -0.882 . . . . 0.0 112.489 169.89 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 67' ' ' GLN . . . . . . . . . . . . . 74.8 mm-40 -54.38 -23.73 16.85 Favored 'General case' 0 CA--C 1.538 0.497 0 CA-C-N 120.119 1.327 . . . . 0.0 113.063 174.04 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 86.5 t -55.64 -27.93 22.4 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.704 0 CA-C-N 119.44 1.018 . . . . 0.0 111.042 172.079 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 8.4 tt -71.44 -41.03 69.96 Favored 'General case' 0 CA--C 1.529 0.164 0 O-C-N 120.892 -1.13 . . . . 0.0 108.256 176.597 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 70' ' ' VAL . . . . . . . . . . . . . 15.7 t -66.28 -33.61 64.68 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.498 0 O-C-N 121.705 -0.622 . . . . 0.0 109.812 176.642 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 76.7 tttt -57.69 -54.36 47.76 Favored 'General case' 0 N--CA 1.455 -0.222 0 O-C-N 121.81 -0.557 . . . . 0.0 109.973 168.997 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 2.6 mptm? -50.97 -45.41 60.85 Favored 'General case' 0 CA--C 1.536 0.404 0 C-N-CA 122.436 0.295 . . . . 0.0 111.774 174.506 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 73' ' ' ILE . . . . . . . . . . . . . 73.5 mt -57.44 -49.1 81.32 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.23 0 CA-C-N 117.954 0.343 . . . . 0.0 110.454 176.909 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 30.0 t -159.61 -54.32 0.06 Allowed 'General case' 0 C--N 1.333 -0.122 0 N-CA-C 112.667 0.617 . . . . 0.0 112.667 -170.323 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 75' ' ' GLN . . . . . . . . . . . . . 15.8 mm100 . . . . . 0 C--O 1.27 2.146 0 O-C-N 121.85 -0.531 . . . . 0.0 111.371 -167.677 . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' A' A ' 1' ' ' LYS . . . . . . . . . . . . . 43.9 mmtm . . . . . 0 N--CA 1.451 -0.397 0 N-CA-C 108.4 -0.963 . . . . 0.0 108.4 . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 86.8 p -70.13 157.6 89.46 Favored Pre-proline 0 CA--C 1.536 0.415 0 CA-C-O 119.012 -0.518 . . . . 0.0 109.869 175.004 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 88.8 Cg_exo -46.34 -42.72 22.25 Favored 'Trans proline' 0 N--CA 1.458 -0.592 0 C-N-CA 123.136 2.557 . . . . 0.0 112.465 169.908 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 45.7 mt-10 -59.25 -48.14 82.72 Favored 'General case' 0 C--O 1.232 0.159 0 C-N-CA 123.504 0.722 . . . . 0.0 111.083 177.687 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 31.6 mt-10 -61.42 -46.22 91.04 Favored 'General case' 0 C--O 1.221 -0.41 0 N-CA-C 108.957 -0.757 . . . . 0.0 108.957 177.263 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 14.8 mt -59.25 -40.38 85.8 Favored 'General case' 0 N--CA 1.451 -0.417 0 C-N-CA 123.596 0.759 . . . . 0.0 111.477 -178.334 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -60.18 -53.93 51.89 Favored 'General case' 0 CA--C 1.53 0.206 0 C-N-CA 123.332 0.653 . . . . 0.0 110.73 170.987 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . -51.84 -49.03 49.57 Favored Glycine 0 CA--C 1.533 1.192 0 N-CA-C 111.295 -0.722 . . . . 0.0 111.295 179.205 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 9' ' ' ILE . . . . . . . . . . . . . 3.4 mm -59.41 -52.07 65.21 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.265 0 C-N-CA 127.416 2.286 . . . . 0.0 109.254 177.339 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 10' ' ' PHE . . . . . . . . . . . . . 51.9 t80 -48.13 -53.21 17.42 Favored 'General case' 0 N--CA 1.45 -0.463 0 N-CA-C 109.306 -0.627 . . . . 0.0 109.306 177.234 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 44.5 mt-10 -60.48 -52.97 62.94 Favored 'General case' 0 CA--C 1.53 0.173 0 C-N-CA 122.438 0.295 . . . . 0.0 110.682 179.411 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 39.4 tttm -43.06 -54.82 4.13 Favored 'General case' 0 N--CA 1.455 -0.177 0 C-N-CA 125.025 1.33 . . . . 0.0 110.668 179.832 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 70.0 m-85 -78.47 -44.1 25.43 Favored 'General case' 0 N--CA 1.454 -0.238 0 CA-C-O 119.533 -0.27 . . . . 0.0 111.386 -176.254 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -52.19 -37.96 56.41 Favored 'General case' 0 N--CA 1.463 0.208 0 C-N-CA 123.351 0.66 . . . . 0.0 112.086 179.118 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -72.28 -14.11 61.68 Favored 'General case' 0 N--CA 1.451 -0.402 0 N-CA-C 113.597 0.962 . . . . 0.0 113.597 179.589 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 64.6 mttm -78.0 62.69 2.84 Favored 'General case' 0 C--N 1.343 0.301 0 CA-C-N 120.345 1.43 . . . . 0.0 109.251 -179.22 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 33.5 mt-10 60.74 116.24 0.01 OUTLIER 'General case' 0 N--CA 1.446 -0.638 0 C-N-CA 127.283 2.233 . . . . 0.0 111.453 -167.388 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 146.18 179.94 22.73 Favored Glycine 0 N--CA 1.447 -0.581 0 N-CA-C 107.616 -2.194 . . . . 0.0 107.616 -173.385 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 30.5 t0 -77.94 121.89 84.73 Favored Pre-proline 0 N--CA 1.45 -0.45 0 N-CA-C 106.06 -1.829 . . . . 0.0 106.06 169.675 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 20' ' ' PRO . . . . . . . . . . . . . 17.8 Cg_endo -53.8 -25.95 36.94 Favored 'Trans proline' 0 CA--C 1.54 0.804 0 C-N-CA 121.956 1.771 . . . . 0.0 112.351 177.844 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 31.9 m-80 -86.22 -7.62 58.4 Favored 'General case' 0 CA--C 1.533 0.314 0 C-N-CA 124.615 1.166 . . . . 0.0 112.97 -179.1 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 25.3 tt0 -155.57 115.53 3.71 Favored 'General case' 0 CA--C 1.538 0.506 0 CA-C-N 119.443 1.02 . . . . 0.0 111.81 -168.907 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 32.3 mt -80.49 128.32 33.45 Favored 'General case' 0 C--O 1.234 0.283 0 C-N-CA 123.513 0.725 . . . . 0.0 112.015 -171.421 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -86.12 175.25 8.63 Favored 'General case' 0 CA--C 1.541 0.629 0 N-CA-C 108.108 -1.071 . . . . 0.0 108.108 166.13 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 98.6 mttt -56.15 -44.83 79.63 Favored 'General case' 0 N--CA 1.456 -0.165 0 C-N-CA 123.394 0.678 . . . . 0.0 112.187 -172.209 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 24.8 mt-10 -65.46 -46.84 78.23 Favored 'General case' 0 CA--C 1.521 -0.136 0 CA-C-O 121.116 0.484 . . . . 0.0 110.551 -173.56 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 2.0 mp0 -53.36 -51.32 62.85 Favored 'General case' 0 N--CA 1.451 -0.424 0 CA-C-N 115.734 -0.666 . . . . 0.0 109.257 174.089 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 8.6 mt -55.42 -42.17 73.77 Favored 'General case' 0 CA--C 1.511 -0.551 0 N-CA-C 113.646 0.98 . . . . 0.0 113.646 173.486 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 84.1 tttt -60.63 -56.67 18.54 Favored 'General case' 0 C--N 1.324 -0.533 0 N-CA-C 108.835 -0.802 . . . . 0.0 108.835 -178.291 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 4.2 mm? -58.37 -43.65 88.54 Favored 'General case' 0 C--N 1.328 -0.341 0 C-N-CA 120.887 -0.325 . . . . 0.0 110.92 -178.348 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 9.3 tt -51.99 -57.85 8.25 Favored 'General case' 0 CA--C 1.53 0.179 0 C-N-CA 123.533 0.733 . . . . 0.0 109.906 173.769 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 38.9 mt -54.46 -58.41 7.58 Favored 'General case' 0 C--N 1.332 -0.159 0 C-N-CA 123.739 0.816 . . . . 0.0 110.309 -178.596 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 23.8 mm100 -52.32 -55.01 24.32 Favored 'General case' 0 N--CA 1.453 -0.277 0 C-N-CA 124.603 1.161 . . . . 0.0 110.846 -176.96 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 11.9 m -74.42 -43.43 56.31 Favored 'General case' 0 N--CA 1.449 -0.479 0 CA-C-N 115.602 -0.727 . . . . 0.0 111.202 -169.558 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 71.8 mm-40 -100.1 -29.36 12.55 Favored 'General case' 0 N--CA 1.448 -0.572 0 N-CA-C 113.583 0.956 . . . . 0.0 113.583 -167.734 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 50.9 m-85 -137.53 63.07 39.36 Favored Pre-proline 0 C--O 1.234 0.276 0 N-CA-C 113.157 0.799 . . . . 0.0 113.157 -171.23 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 57.8 Cg_endo -59.57 -29.41 89.82 Favored 'Trans proline' 0 CA--C 1.539 0.744 0 C-N-CA 121.798 1.665 . . . . 0.0 109.726 169.343 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 1.3 m -62.46 -23.17 66.75 Favored 'General case' 0 N--CA 1.45 -0.44 0 C-N-CA 127.14 2.176 . . . . 0.0 111.561 178.423 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 43.3 mt -90.52 -53.14 4.56 Favored 'General case' 0 N--CA 1.449 -0.518 0 N-CA-C 108.788 -0.819 . . . . 0.0 108.788 169.508 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 27.8 tp -44.25 -50.83 8.73 Favored 'General case' 0 CA--C 1.528 0.101 0 C-N-CA 124.772 1.229 . . . . 0.0 112.592 -172.868 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 32.6 mtmm 20.83 -88.18 0.0 OUTLIER 'General case' 0 N--CA 1.449 -0.522 0 C-N-CA 128.308 2.643 . . . . 0.0 115.711 -179.226 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . -76.82 2.38 59.82 Favored Glycine 0 CA--C 1.532 1.1 0 C-N-CA 124.157 0.884 . . . . 0.0 114.226 -172.042 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 43' ' ' GLY . . . . . . . . . . . . . . . 77.73 -63.42 3.44 Favored Glycine 0 CA--C 1.525 0.717 0 CA-C-N 118.511 1.156 . . . . 0.0 111.356 176.747 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 44' ' ' SER . . . . . . . . . . . . . 46.2 t 52.25 -136.08 1.4 Allowed 'General case' 0 CA--C 1.535 0.385 0 N-CA-C 107.987 -1.116 . . . . 0.0 107.987 -169.608 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 58.3 p -130.5 143.88 51.04 Favored 'General case' 0 N--CA 1.451 -0.378 0 N-CA-C 107.452 -1.314 . . . . 0.0 107.452 167.448 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 22.7 mt -54.62 -42.02 70.69 Favored 'General case' 0 C--O 1.221 -0.438 0 N-CA-C 107.913 -1.143 . . . . 0.0 107.913 173.23 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 5.4 m-20 -53.28 -53.64 47.92 Favored 'General case' 0 N--CA 1.449 -0.521 0 C-N-CA 124.633 1.173 . . . . 0.0 111.66 176.901 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 19.9 tp10 -56.89 -52.06 66.65 Favored 'General case' 0 N--CA 1.456 -0.146 0 N-CA-C 110.403 -0.221 . . . . 0.0 110.403 177.513 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 3.9 mm? -56.08 -45.43 79.35 Favored 'General case' 0 C--O 1.225 -0.213 0 CA-C-O 120.969 0.414 . . . . 0.0 110.264 179.781 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 50' ' ' PHE . . . . . . . . . . . . . 64.9 t80 -58.86 -50.89 72.3 Favored 'General case' 0 N--CA 1.448 -0.533 0 C-N-CA 124.117 0.967 . . . . 0.0 110.084 -178.287 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 24.9 tp10 -59.46 -46.42 88.83 Favored 'General case' 0 N--CA 1.453 -0.306 0 N-CA-C 109.996 -0.372 . . . . 0.0 109.996 178.555 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 13.6 tm-20 -57.44 -44.24 84.54 Favored 'General case' 0 CA--C 1.531 0.231 0 C-N-CA 123.609 0.764 . . . . 0.0 110.493 -179.824 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 84.6 mt -72.09 -45.23 61.47 Favored 'General case' 0 N--CA 1.45 -0.429 0 C-N-CA 123.5 0.72 . . . . 0.0 111.568 -178.363 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 47.1 t0 -75.15 63.86 1.35 Allowed 'General case' 0 CA--C 1.533 0.319 0 C-N-CA 123.699 0.8 . . . . 0.0 110.697 -177.786 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 37.9 mmtm -54.11 -39.42 66.4 Favored 'General case' 0 N--CA 1.455 -0.182 0 C-N-CA 123.501 0.72 . . . . 0.0 112.473 -179.1 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 56' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -78.29 -5.11 51.07 Favored 'General case' 0 CA--C 1.535 0.387 0 N-CA-C 112.943 0.72 . . . . 0.0 112.943 -179.858 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . 61.57 35.87 91.76 Favored Glycine 0 CA--C 1.529 0.926 0 CA-C-O 119.368 -0.684 . . . . 0.0 113.825 172.682 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 1.7 p30 -78.22 -16.11 58.15 Favored 'General case' 0 CA--C 1.534 0.337 0 CA-C-N 118.827 1.314 . . . . 0.0 112.306 179.282 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . 103.92 2.5 45.79 Favored Glycine 0 CA--C 1.53 1.021 0 C-N-CA 124.187 0.899 . . . . 0.0 112.647 179.902 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 59.5 mt-10 -152.77 173.01 15.83 Favored 'General case' 0 CA--C 1.532 0.272 0 C-N-CA 128.126 2.57 . . . . 0.0 106.431 173.577 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 61' ' ' VAL . . . . . . . . . . . . . 8.9 t -108.93 109.54 28.71 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.446 0 CA-C-N 118.554 0.616 . . . . 0.0 110.78 -175.911 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 3.8 m -78.76 154.03 30.31 Favored 'General case' 0 CA--C 1.537 0.45 0 C-N-CA 123.296 0.638 . . . . 0.0 111.107 173.418 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 63' ' ' PHE . . . . . . . . . . . . . 69.7 t80 -51.13 -42.37 60.7 Favored 'General case' 0 CA--C 1.534 0.358 0 C-N-CA 123.524 0.73 . . . . 0.0 112.711 -173.334 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 12.6 pt-20 -59.18 -37.09 76.52 Favored 'General case' 0 CA--C 1.534 0.349 0 N-CA-C 112.746 0.647 . . . . 0.0 112.746 -178.565 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 18.7 pt-20 -91.23 -30.52 16.59 Favored 'General case' 0 CA--C 1.531 0.239 0 C-N-CA 123.091 0.557 . . . . 0.0 110.062 -179.087 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 7.9 t80 -49.97 -27.28 5.17 Favored 'General case' 0 CA--C 1.536 0.421 0 C-N-CA 123.86 0.864 . . . . 0.0 111.071 167.815 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 67' ' ' GLN . . . . . . . . . . . . . 68.9 mm-40 -49.55 -27.61 4.63 Favored 'General case' 0 CA--C 1.537 0.47 0 CA-C-N 119.259 0.936 . . . . 0.0 113.448 171.586 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 69.2 t -53.17 -32.25 18.81 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.58 0 O-C-N 121.368 -0.833 . . . . 0.0 111.368 172.613 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 8.5 tt -71.54 -42.69 67.59 Favored 'General case' 0 N--CA 1.455 -0.192 0 N-CA-C 107.946 -1.131 . . . . 0.0 107.946 178.806 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 70' ' ' VAL . . . . . . . . . . . . . 19.0 t -62.14 -43.03 97.31 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.286 0 N-CA-C 109.721 -0.474 . . . . 0.0 109.721 177.272 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 33.2 ttpt -53.9 -51.1 64.8 Favored 'General case' 0 N--CA 1.455 -0.224 0 C-N-CA 122.748 0.419 . . . . 0.0 110.364 171.598 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 13.7 mptt -53.15 -44.95 68.18 Favored 'General case' 0 CA--C 1.535 0.37 0 N-CA-C 112.608 0.596 . . . . 0.0 112.608 174.929 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 73' ' ' ILE . . . . . . . . . . . . . 88.6 mt -56.32 -50.73 70.24 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.439 0 N-CA-C 109.161 -0.681 . . . . 0.0 109.161 173.322 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 5.7 t 73.14 -62.31 0.47 Allowed 'General case' 0 CA--C 1.53 0.197 0 C-N-CA 126.09 1.756 . . . . 0.0 111.75 175.017 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 75' ' ' GLN . . . . . 0.828 ' OXT' ' OE1' ' A' ' 75' ' ' GLN . 0.7 OUTLIER . . . . . 0 C--O 1.27 2.164 0 C-N-CA 123.884 0.874 . . . . 0.0 109.274 179.148 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 1' ' ' LYS . . . . . . . . . . . . . 33.1 mmtp . . . . . 0 N--CA 1.451 -0.377 0 N-CA-C 108.207 -1.034 . . . . 0.0 108.207 . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 56.6 p -78.92 158.27 75.31 Favored Pre-proline 0 CA--C 1.536 0.435 0 N-CA-C 109.191 -0.67 . . . . 0.0 109.191 175.318 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 97.1 Cg_exo -45.17 -41.29 16.59 Favored 'Trans proline' 0 N--CA 1.458 -0.598 0 C-N-CA 123.271 2.647 . . . . 0.0 112.821 172.392 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 3.0 mp0 -59.06 -49.84 76.34 Favored 'General case' 0 N--CA 1.456 -0.125 0 C-N-CA 123.54 0.736 . . . . 0.0 111.757 176.751 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 46.6 mm-40 -62.63 -43.15 99.53 Favored 'General case' 0 C--N 1.331 -0.204 0 N-CA-C 109.201 -0.666 . . . . 0.0 109.201 179.165 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 12.8 mt -60.34 -36.66 78.49 Favored 'General case' 0 N--CA 1.446 -0.664 0 CA-C-O 119.266 -0.397 . . . . 0.0 111.916 175.67 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 79.3 tttt -64.64 -45.07 88.38 Favored 'General case' 0 N--CA 1.448 -0.55 0 CA-C-N 118.813 0.733 . . . . 0.0 110.526 172.294 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . -52.8 -52.36 39.26 Favored Glycine 0 CA--C 1.53 1.028 0 N-CA-C 110.169 -1.172 . . . . 0.0 110.169 177.253 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 9' ' ' ILE . . . . . . . . . . . . . 15.1 mm -54.19 -58.25 4.12 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.198 0 C-N-CA 125.631 1.572 . . . . 0.0 109.391 173.848 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 10' ' ' PHE . . . . . . . . . . . . . 28.5 t80 -46.05 -51.11 14.3 Favored 'General case' 0 N--CA 1.448 -0.566 0 C-N-CA 123.173 0.589 . . . . 0.0 109.995 179.854 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 48.0 mt-10 -63.4 -49.94 71.81 Favored 'General case' 0 CA--C 1.53 0.195 0 C-N-CA 123.657 0.783 . . . . 0.0 111.037 -179.385 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 41.1 tttp -42.57 -51.16 5.24 Favored 'General case' 0 C--N 1.341 0.212 0 C-N-CA 124.635 1.174 . . . . 0.0 110.649 176.693 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 81.2 m-85 -78.79 -51.27 9.99 Favored 'General case' 0 N--CA 1.452 -0.348 0 CA-C-N 116.521 -0.309 . . . . 0.0 110.504 -178.78 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -56.93 -25.56 57.76 Favored 'General case' 0 N--CA 1.465 0.287 0 C-N-CA 126.347 1.859 . . . . 0.0 114.436 -174.46 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -81.58 -14.5 56.73 Favored 'General case' 0 N--CA 1.453 -0.318 0 CA-C-O 118.276 -0.868 . . . . 0.0 113.278 177.3 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 99.1 mttt -62.77 -57.74 9.86 Favored 'General case' 0 CA--C 1.531 0.248 0 CA-C-N 120.031 1.287 . . . . 0.0 110.174 -174.231 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -154.75 103.28 2.43 Favored 'General case' 0 N--CA 1.449 -0.484 0 CA-C-O 123.381 1.562 . . . . 0.0 111.187 167.7 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 158.99 -151.08 21.97 Favored Glycine 0 CA--C 1.525 0.67 0 N-CA-C 105.585 -3.006 . . . . 0.0 105.585 -169.036 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 11.7 t70 -115.51 146.64 37.06 Favored Pre-proline 0 C--O 1.224 -0.27 0 N-CA-C 106.351 -1.722 . . . . 0.0 106.351 169.767 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 20' ' ' PRO . . . . . . . . . . . . . 10.4 Cg_endo -50.15 -23.64 9.91 Favored 'Trans proline' 0 CA--C 1.542 0.902 0 C-N-CA 121.978 1.785 . . . . 0.0 114.546 176.92 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 38.9 m-80 -98.88 -1.96 38.85 Favored 'General case' 0 CA--C 1.538 0.486 0 C-N-CA 125.395 1.478 . . . . 0.0 112.827 -178.955 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 4.4 tp60 -145.22 116.84 8.1 Favored 'General case' 0 CA--C 1.55 0.964 0 C-N-CA 124.684 1.194 . . . . 0.0 112.42 -168.152 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 44.3 mt -91.71 128.83 37.7 Favored 'General case' 0 C--N 1.344 0.331 0 C-N-CA 124.592 1.157 . . . . 0.0 112.578 -175.354 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 98.3 p -79.4 167.71 20.48 Favored 'General case' 0 CA--C 1.537 0.462 0 C-N-CA 123.779 0.832 . . . . 0.0 109.316 167.665 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 97.4 mttt -54.79 -47.7 73.66 Favored 'General case' 0 C--N 1.339 0.141 0 O-C-N 121.866 -0.521 . . . . 0.0 111.342 -179.421 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 42.2 tt0 -61.41 -44.06 97.79 Favored 'General case' 0 N--CA 1.454 -0.234 0 CA-C-O 120.695 0.283 . . . . 0.0 110.729 -178.138 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 69.5 mt-10 -59.58 -48.8 80.25 Favored 'General case' 0 N--CA 1.448 -0.525 0 N-CA-C 109.717 -0.475 . . . . 0.0 109.717 177.329 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 7.5 mt -54.16 -42.53 69.71 Favored 'General case' 0 CA--C 1.511 -0.549 0 N-CA-C 113.084 0.772 . . . . 0.0 113.084 170.868 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 82.5 tttt -62.46 -50.1 72.81 Favored 'General case' 0 N--CA 1.448 -0.565 0 CA-C-N 118.68 0.673 . . . . 0.0 109.593 -177.304 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 79.1 mt -59.95 -45.43 92.66 Favored 'General case' 0 C--O 1.235 0.341 0 C-N-CA 122.725 0.41 . . . . 0.0 111.506 178.272 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 7.9 tt -53.63 -56.74 14.57 Favored 'General case' 0 N--CA 1.455 -0.188 0 C-N-CA 123.77 0.828 . . . . 0.0 109.169 174.851 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 50.2 mt -55.72 -51.08 68.56 Favored 'General case' 0 N--CA 1.454 -0.267 0 C-N-CA 123.813 0.845 . . . . 0.0 109.751 -178.569 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 35.5 mt-30 -49.51 -54.6 17.01 Favored 'General case' 0 N--CA 1.458 -0.032 0 C-N-CA 123.165 0.586 . . . . 0.0 111.236 176.982 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 6.0 m -70.71 -48.66 53.47 Favored 'General case' 0 N--CA 1.454 -0.267 0 CA-C-N 116.059 -0.519 . . . . 0.0 111.095 -170.93 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 19.6 mm-40 -97.57 -37.34 9.98 Favored 'General case' 0 N--CA 1.45 -0.445 0 C-N-CA 123.759 0.824 . . . . 0.0 113.131 -167.339 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 27.0 m-85 -139.8 65.66 31.89 Favored Pre-proline 0 CA--C 1.536 0.411 0 C-N-CA 122.93 0.492 . . . . 0.0 112.155 -168.744 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 41.5 Cg_endo -61.39 -27.67 83.04 Favored 'Trans proline' 0 N--CA 1.457 -0.669 0 C-N-CA 122.728 2.285 . . . . 0.0 111.779 -178.882 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 2.7 p -55.23 -52.64 62.74 Favored 'General case' 0 N--CA 1.45 -0.451 0 C-N-CA 124.591 1.156 . . . . 0.0 109.36 172.719 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 93.5 mt -72.99 -29.36 62.99 Favored 'General case' 0 N--CA 1.449 -0.517 0 CA-C-N 115.163 -0.926 . . . . 0.0 111.434 179.667 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 15.5 tp -55.38 -50.79 68.79 Favored 'General case' 0 C--N 1.34 0.175 0 CA-C-N 118.485 0.584 . . . . 0.0 109.979 170.506 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 74.1 mmtt -59.63 -60.6 3.58 Favored 'General case' 0 N--CA 1.45 -0.464 0 N-CA-C 108.906 -0.776 . . . . 0.0 108.906 173.739 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . 70.24 -62.02 0.8 Allowed Glycine 0 CA--C 1.531 1.053 0 C-N-CA 125.272 1.415 . . . . 0.0 114.687 168.826 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 43' ' ' GLY . . . . . . . . . . . . . . . 121.21 -77.23 0.33 Allowed Glycine 0 CA--C 1.522 0.479 0 N-CA-C 105.228 -3.149 . . . . 0.0 105.228 -169.011 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 44' ' ' SER . . . . . . . . . . . . . 1.6 m -63.79 141.01 58.93 Favored 'General case' 0 N--CA 1.451 -0.399 0 N-CA-C 108.036 -1.098 . . . . 0.0 108.036 168.221 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 27.4 p -77.74 169.71 17.82 Favored 'General case' 0 C--O 1.234 0.261 0 CA-C-N 118.2 0.454 . . . . 0.0 111.008 -171.252 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 65.1 tp -42.58 -45.67 4.65 Favored 'General case' 0 C--O 1.223 -0.297 0 C-N-CA 125.331 1.452 . . . . 0.0 111.982 178.471 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 6.7 m-20 -58.09 -51.2 70.69 Favored 'General case' 0 N--CA 1.452 -0.369 0 C-N-CA 123.306 0.643 . . . . 0.0 111.392 179.276 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 3.2 mp0 -60.44 -46.93 88.28 Favored 'General case' 0 N--CA 1.457 -0.116 0 N-CA-C 109.983 -0.377 . . . . 0.0 109.983 177.955 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 94.5 mt -56.73 -46.19 81.49 Favored 'General case' 0 C--O 1.225 -0.236 0 N-CA-C 109.946 -0.39 . . . . 0.0 109.946 178.66 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 50' ' ' PHE . . . . . . . . . . . . . 68.7 t80 -57.23 -51.88 67.58 Favored 'General case' 0 N--CA 1.45 -0.446 0 C-N-CA 124.034 0.934 . . . . 0.0 110.457 179.561 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 53.5 mm-40 -57.39 -48.2 79.7 Favored 'General case' 0 CA--C 1.532 0.275 0 CA-C-O 120.594 0.235 . . . . 0.0 110.98 176.559 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 47.5 tp10 -55.3 -44.4 75.7 Favored 'General case' 0 CA--C 1.53 0.204 0 C-N-CA 123.759 0.824 . . . . 0.0 110.865 179.43 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 85.2 mt -69.32 -46.64 66.59 Favored 'General case' 0 N--CA 1.449 -0.5 0 C-N-CA 123.213 0.605 . . . . 0.0 110.923 179.902 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 55.2 t0 -75.51 62.75 1.42 Allowed 'General case' 0 CA--C 1.535 0.402 0 C-N-CA 123.548 0.739 . . . . 0.0 110.57 179.309 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 25.8 mmtm -47.06 -48.09 22.52 Favored 'General case' 0 CA--C 1.528 0.122 0 C-N-CA 124.881 1.272 . . . . 0.0 112.482 179.342 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 56' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -75.9 -6.12 49.36 Favored 'General case' 0 CA--C 1.537 0.451 0 N-CA-C 112.881 0.697 . . . . 0.0 112.881 -177.473 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . 61.33 37.77 94.59 Favored Glycine 0 CA--C 1.528 0.847 0 C-N-CA 123.905 0.764 . . . . 0.0 113.306 171.525 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 2.2 p30 -77.53 -25.29 50.07 Favored 'General case' 0 N--CA 1.455 -0.216 0 CA-C-N 118.36 1.08 . . . . 0.0 111.755 -179.992 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . 127.51 -20.01 5.87 Favored Glycine 0 CA--C 1.525 0.661 0 CA-C-O 118.626 -1.097 . . . . 0.0 112.649 179.778 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . 0.343 0.2 OUTLIER -153.13 149.63 28.25 Favored 'General case' 0 CA--C 1.537 0.469 0 CA-C-N 119.041 1.421 . . . . 0.0 110.735 175.089 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 61' ' ' VAL . . . . . . . . . . . . . 13.6 t -77.23 122.53 32.02 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.42 0 N-CA-C 113.921 1.082 . . . . 0.0 113.921 -164.096 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -77.96 152.09 33.34 Favored 'General case' 0 CA--C 1.536 0.406 0 C-N-CA 123.838 0.855 . . . . 0.0 110.942 174.053 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 63' ' ' PHE . . . . . . . . . . . . . 59.7 t80 -53.81 -31.24 48.38 Favored 'General case' 0 N--CA 1.47 0.566 0 N-CA-C 113.862 1.06 . . . . 0.0 113.862 176.771 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 28.8 mp0 -68.65 -63.52 1.04 Allowed 'General case' 0 N--CA 1.453 -0.318 0 O-C-N 121.581 -0.7 . . . . 0.0 109.112 -179.977 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 18.5 pt-20 -62.27 -28.37 69.67 Favored 'General case' 0 CA--C 1.539 0.522 0 O-C-N 121.274 -0.891 . . . . 0.0 111.828 -179.631 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 12.7 t80 -50.01 -27.54 5.64 Favored 'General case' 0 CA--C 1.534 0.342 0 C-N-CA 123.662 0.785 . . . . 0.0 112.622 169.304 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 67' ' ' GLN . . . . . . . . . . . . . 71.6 mm-40 -55.4 -22.09 18.43 Favored 'General case' 0 CA--C 1.543 0.706 0 CA-C-N 119.812 1.187 . . . . 0.0 112.901 173.925 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 72.5 t -53.23 -29.15 15.65 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.589 0 O-C-N 120.98 -1.075 . . . . 0.0 111.175 169.889 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 18.7 tp -70.91 -42.06 70.42 Favored 'General case' 0 N--CA 1.452 -0.331 0 N-CA-C 107.872 -1.158 . . . . 0.0 107.872 177.438 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 70' ' ' VAL . . . . . . . . . . . . . 24.2 t -62.54 -39.83 85.96 Favored 'Isoleucine or valine' 0 N--CA 1.456 -0.169 0 N-CA-C 109.863 -0.421 . . . . 0.0 109.863 177.077 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 69.9 tttt -53.36 -52.01 60.63 Favored 'General case' 0 CA--C 1.531 0.238 0 O-C-N 122.247 -0.283 . . . . 0.0 110.703 169.925 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 14.3 mptt -55.65 -42.49 75.11 Favored 'General case' 0 CA--C 1.535 0.395 0 N-CA-C 112.083 0.401 . . . . 0.0 112.083 175.568 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 73' ' ' ILE . . . . . . . . . . . . . 94.4 mt -59.61 -58.64 6.2 Favored 'Isoleucine or valine' 0 N--CA 1.462 0.164 0 N-CA-C 109.788 -0.449 . . . . 0.0 109.788 177.103 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 26.2 m -168.54 73.42 0.1 Allowed 'General case' 0 CA--C 1.53 0.185 0 C-N-CA 124.828 1.251 . . . . 0.0 110.097 -171.383 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 75' ' ' GLN . . . . . 0.915 ' OXT' ' NE2' ' A' ' 75' ' ' GLN . 0.0 OUTLIER . . . . . 0 C--O 1.27 2.165 0 O-C-N 121.932 -0.48 . . . . 0.0 109.998 169.14 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 1' ' ' LYS . . . . . 1.04 ' O ' ' OXT' ' A' ' 75' ' ' GLN . 29.0 mtmm . . . . . 0 N--CA 1.451 -0.398 0 N-CA-C 108.52 -0.918 . . . . 0.0 108.52 . . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 84.3 p -68.35 160.85 73.6 Favored Pre-proline 0 CA--C 1.534 0.332 0 C-N-CA 123.62 0.768 . . . . 0.0 111.116 -172.037 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 88.1 Cg_exo -47.58 -37.6 26.96 Favored 'Trans proline' 0 N--CA 1.456 -0.685 0 C-N-CA 122.935 2.424 . . . . 0.0 112.107 168.46 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 40.0 tt0 -63.62 -47.03 83.02 Favored 'General case' 0 N--CA 1.456 -0.164 0 C-N-CA 123.327 0.651 . . . . 0.0 111.293 177.129 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 25.9 mt-10 -60.46 -47.53 85.74 Favored 'General case' 0 N--CA 1.454 -0.241 0 N-CA-C 108.48 -0.933 . . . . 0.0 108.48 176.997 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 17.9 mt -57.75 -37.7 74.08 Favored 'General case' 0 N--CA 1.45 -0.462 0 C-N-CA 123.639 0.776 . . . . 0.0 111.947 178.127 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 21.1 tptm -62.4 -51.84 65.96 Favored 'General case' 0 C--N 1.332 -0.188 0 CA-C-N 118.728 0.695 . . . . 0.0 111.089 171.986 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . -53.95 -50.61 54.16 Favored Glycine 0 CA--C 1.531 1.035 0 N-CA-C 110.136 -1.186 . . . . 0.0 110.136 -179.811 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 9' ' ' ILE . . . . . . . . . . . . . 69.3 mt -55.01 -53.63 32.1 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.385 0 C-N-CA 125.772 1.629 . . . . 0.0 110.27 174.053 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 10' ' ' PHE . . . . . . . . . . . . . 41.0 t80 -49.17 -52.76 24.55 Favored 'General case' 0 N--CA 1.45 -0.457 0 N-CA-C 109.208 -0.664 . . . . 0.0 109.208 179.153 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 50.0 mt-10 -58.91 -50.9 72.3 Favored 'General case' 0 N--CA 1.453 -0.292 0 C-N-CA 122.898 0.479 . . . . 0.0 110.289 -179.468 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 41.0 tttm -48.63 -59.76 3.26 Favored 'General case' 0 CA--C 1.532 0.268 0 C-N-CA 123.462 0.705 . . . . 0.0 111.243 176.879 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 57.8 m-85 -76.57 -30.01 56.87 Favored 'General case' 0 C--O 1.224 -0.26 0 O-C-N 121.913 -0.492 . . . . 0.0 110.946 -169.955 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -66.2 -46.52 77.01 Favored 'General case' 0 N--CA 1.453 -0.275 0 O-C-N 121.932 -0.48 . . . . 0.0 110.259 173.878 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -63.78 -31.94 73.28 Favored 'General case' 0 C--N 1.333 -0.128 0 C-N-CA 123.545 0.738 . . . . 0.0 111.572 176.987 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 9.6 ttpp -61.32 91.27 0.03 OUTLIER 'General case' 0 N--CA 1.451 -0.421 0 N-CA-C 108.962 -0.755 . . . . 0.0 108.962 175.896 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 30.5 mt-10 77.53 -41.49 0.36 Allowed 'General case' 0 CA--C 1.531 0.242 0 C-N-CA 127.425 2.29 . . . . 0.0 112.303 176.715 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . -75.75 -171.93 31.71 Favored Glycine 0 CA--C 1.528 0.9 0 CA-C-O 121.779 0.655 . . . . 0.0 111.992 178.348 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 9.7 t70 -84.59 135.57 40.62 Favored Pre-proline 0 N--CA 1.454 -0.271 0 N-CA-C 107.4 -1.333 . . . . 0.0 107.4 171.412 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 20' ' ' PRO . . . . . . . . . . . . . 13.3 Cg_endo -51.52 -23.9 15.64 Favored 'Trans proline' 0 CA--C 1.535 0.525 0 C-N-CA 123.462 2.775 . . . . 0.0 114.893 -178.389 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 46.4 m-80 -90.39 -2.29 57.96 Favored 'General case' 0 N--CA 1.452 -0.358 0 C-N-CA 123.9 0.88 . . . . 0.0 112.583 -177.257 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 43.6 tt0 -155.79 122.67 5.32 Favored 'General case' 0 CA--C 1.539 0.553 0 CA-C-N 119.799 1.181 . . . . 0.0 113.432 -167.677 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 56.8 mt -89.05 133.16 34.46 Favored 'General case' 0 CA--C 1.532 0.281 0 C-N-CA 124.252 1.021 . . . . 0.0 112.055 -178.682 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 45.1 p -78.27 172.46 13.55 Favored 'General case' 0 CA--C 1.535 0.377 0 C-N-CA 123.534 0.734 . . . . 0.0 109.413 167.676 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 98.0 mttt -57.97 -45.91 85.99 Favored 'General case' 0 C--O 1.226 -0.177 0 O-C-N 121.746 -0.596 . . . . 0.0 109.752 174.34 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 26' ' ' GLU . . . . . 0.421 ' H ' ' CD ' ' A' ' 26' ' ' GLU . 2.0 mp0 -62.57 -48.29 80.12 Favored 'General case' 0 CA--C 1.516 -0.345 0 CA-C-O 121.194 0.521 . . . . 0.0 109.948 -177.311 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 34.2 mt-10 -56.29 -47.37 78.79 Favored 'General case' 0 N--CA 1.449 -0.487 0 CA-C-N 115.467 -0.788 . . . . 0.0 109.661 177.104 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 11.0 mt -55.16 -44.83 75.55 Favored 'General case' 0 CA--C 1.512 -0.496 0 N-CA-C 113.051 0.76 . . . . 0.0 113.051 170.003 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 62.5 tttm -61.73 -48.9 78.64 Favored 'General case' 0 C--N 1.324 -0.533 0 CA-C-N 118.732 0.697 . . . . 0.0 110.019 -176.093 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 4.2 mm? -61.53 -46.07 91.52 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.375 -0.375 . . . . 0.0 111.056 178.142 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 6.0 tt -49.87 -59.17 4.1 Favored 'General case' 0 C--N 1.333 -0.127 0 C-N-CA 123.648 0.779 . . . . 0.0 109.332 173.859 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 49.4 mt -55.78 -58.26 8.58 Favored 'General case' 0 N--CA 1.454 -0.265 0 C-N-CA 123.563 0.745 . . . . 0.0 109.817 -177.738 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 30.0 tt0 -50.97 -52.2 45.03 Favored 'General case' 0 N--CA 1.452 -0.349 0 C-N-CA 124.361 1.064 . . . . 0.0 111.438 -177.807 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 16.3 m -74.54 -49.31 22.4 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.235 -0.439 . . . . 0.0 110.861 -171.26 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 70.8 mm-40 -89.5 -31.99 17.4 Favored 'General case' 0 N--CA 1.449 -0.483 0 C-N-CA 122.7 0.4 . . . . 0.0 111.77 -169.4 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 76.4 m-85 -133.84 64.32 66.59 Favored Pre-proline 0 CA--C 1.535 0.366 0 C-N-CA 124.268 1.027 . . . . 0.0 110.235 -175.541 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 44.5 Cg_endo -60.31 -21.83 68.53 Favored 'Trans proline' 0 N--CA 1.457 -0.649 0 C-N-CA 122.995 2.463 . . . . 0.0 111.867 -178.434 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -63.54 -35.42 80.42 Favored 'General case' 0 N--CA 1.451 -0.406 0 C-N-CA 124.2 1.0 . . . . 0.0 110.297 174.798 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 84.3 mt -90.52 -49.29 6.58 Favored 'General case' 0 N--CA 1.451 -0.398 0 C-N-CA 124.879 1.272 . . . . 0.0 110.298 -176.619 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 59.8 tp 51.2 -73.76 0.01 OUTLIER 'General case' 0 CA--C 1.533 0.324 0 C-N-CA 127.381 2.273 . . . . 0.0 115.174 173.844 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 99.3 mttt -63.85 -40.95 97.78 Favored 'General case' 0 N--CA 1.451 -0.391 0 C-N-CA 124.36 1.064 . . . . 0.0 109.527 169.891 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . 123.21 -53.67 0.73 Allowed Glycine 0 C--N 1.336 0.55 0 C-N-CA 125.967 1.746 . . . . 0.0 108.741 -176.482 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 43' ' ' GLY . . . . . . . . . . . . . . . 174.19 -66.76 0.11 Allowed Glycine 0 C--N 1.332 0.356 0 N-CA-C 105.975 -2.85 . . . . 0.0 105.975 176.208 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 44' ' ' SER . . . . . . . . . . . . . 5.3 p -77.46 176.45 8.87 Favored 'General case' 0 N--CA 1.446 -0.664 0 N-CA-C 107.296 -1.372 . . . . 0.0 107.296 166.682 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 1.9 p -62.91 148.87 46.08 Favored 'General case' 0 N--CA 1.452 -0.337 0 N-CA-C 109.271 -0.64 . . . . 0.0 109.271 171.898 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 62.6 tp -50.49 -45.81 56.59 Favored 'General case' 0 C--O 1.227 -0.084 0 C-N-CA 124.001 0.92 . . . . 0.0 112.606 -169.935 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 5.9 m-20 -57.87 -56.62 19.66 Favored 'General case' 0 N--CA 1.451 -0.415 0 CA-C-O 121.408 0.623 . . . . 0.0 110.129 178.899 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 70.0 mm-40 -54.23 -47.35 72.28 Favored 'General case' 0 N--CA 1.453 -0.323 0 CA-C-N 115.911 -0.586 . . . . 0.0 110.222 178.555 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 6.2 tp -52.8 -53.5 47.55 Favored 'General case' 0 C--O 1.224 -0.283 0 C-N-CA 123.096 0.558 . . . . 0.0 109.921 176.172 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 50' ' ' PHE . . . . . . . . . . . . . 63.1 t80 -52.6 -51.35 60.34 Favored 'General case' 0 N--CA 1.453 -0.299 0 C-N-CA 124.232 1.013 . . . . 0.0 110.486 -179.194 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 2.2 mp0 -56.18 -50.03 72.35 Favored 'General case' 0 CA--C 1.533 0.31 0 CA-C-O 120.529 0.204 . . . . 0.0 111.18 174.89 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 34.6 mt-10 -55.62 -41.75 73.95 Favored 'General case' 0 CA--C 1.531 0.217 0 C-N-CA 123.024 0.53 . . . . 0.0 111.673 179.983 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 76.4 mt -67.04 -54.9 17.16 Favored 'General case' 0 N--CA 1.449 -0.523 0 C-N-CA 122.921 0.488 . . . . 0.0 110.339 177.689 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 11.4 t70 -75.2 79.35 2.33 Favored 'General case' 0 N--CA 1.453 -0.296 0 CA-C-O 121.627 0.727 . . . . 0.0 109.332 -179.136 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 39.9 mmtm -65.08 89.6 0.08 Allowed 'General case' 0 N--CA 1.451 -0.408 0 CA-C-O 121.982 0.896 . . . . 0.0 110.709 173.911 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 56' ' ' ASN . . . . . . . . . . . . 0.264 0.0 OUTLIER 40.83 46.4 2.32 Favored 'General case' 0 C--N 1.325 -0.48 0 C-N-CA 128.87 2.868 . . . . 0.0 114.05 178.703 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . -87.61 -90.53 1.05 Allowed Glycine 0 C--N 1.337 0.608 0 N-CA-C 107.783 -2.127 . . . . 0.0 107.783 171.575 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 6.9 p-10 -137.01 -42.51 0.58 Allowed 'General case' 0 N--CA 1.446 -0.654 0 C-N-CA 125.206 1.402 . . . . 0.0 111.577 -177.986 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . 149.0 -65.9 0.39 Allowed Glycine 0 CA--C 1.523 0.577 0 N-CA-C 108.522 -1.831 . . . . 0.0 108.522 -171.071 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 39.7 mt-10 -74.53 133.73 42.27 Favored 'General case' 0 N--CA 1.455 -0.204 0 N-CA-C 107.615 -1.254 . . . . 0.0 107.615 -174.695 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 61' ' ' VAL . . . . . . . . . . . . . 3.8 t -88.77 111.24 22.35 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.308 0 N-CA-C 112.754 0.65 . . . . 0.0 112.754 -163.913 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 34.3 m -79.45 162.36 25.51 Favored 'General case' 0 CA--C 1.533 0.326 0 C-N-CA 123.094 0.558 . . . . 0.0 111.989 169.876 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 63' ' ' PHE . . . . . . . . . . . . . 57.7 t80 -54.2 -37.89 65.05 Favored 'General case' 0 N--CA 1.464 0.257 0 N-CA-C 113.388 0.885 . . . . 0.0 113.388 -169.568 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 25.3 mp0 -65.39 -57.69 7.72 Favored 'General case' 0 N--CA 1.451 -0.404 0 N-CA-C 109.081 -0.711 . . . . 0.0 109.081 -176.565 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 17.1 pt-20 -61.43 -36.49 80.5 Favored 'General case' 0 CA--C 1.541 0.623 0 O-C-N 121.823 -0.548 . . . . 0.0 111.347 177.478 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 14.6 t80 -52.76 -26.12 13.29 Favored 'General case' 0 CA--C 1.537 0.474 0 C-N-CA 123.943 0.897 . . . . 0.0 112.335 169.922 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 67' ' ' GLN . . . . . . . . . . . . . 60.3 mm-40 -54.82 -23.17 17.06 Favored 'General case' 0 CA--C 1.534 0.337 0 CA-C-N 119.83 1.195 . . . . 0.0 113.077 173.356 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 98.6 t -55.89 -33.76 35.77 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.516 0 CA-C-N 119.341 0.973 . . . . 0.0 110.528 171.526 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 22.5 tp -74.12 -49.92 21.77 Favored 'General case' 0 N--CA 1.455 -0.203 0 N-CA-C 107.754 -1.202 . . . . 0.0 107.754 177.264 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 70' ' ' VAL . . . . . . . . . . . . . 58.9 t -50.55 -42.3 21.59 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.408 0 C-N-CA 123.642 0.777 . . . . 0.0 110.472 179.63 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -51.54 -57.75 8.2 Favored 'General case' 0 N--CA 1.455 -0.204 0 C-N-CA 123.446 0.699 . . . . 0.0 111.053 173.022 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 4.5 mptp? -55.17 -43.5 74.37 Favored 'General case' 0 CA--C 1.534 0.333 0 C-N-CA 122.568 0.347 . . . . 0.0 111.853 176.624 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 73' ' ' ILE . . . . . . . . . . . . . 57.7 mt -58.99 -37.22 66.3 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.375 0 N-CA-C 109.942 -0.392 . . . . 0.0 109.942 175.668 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 25.5 t 60.3 32.18 20.66 Favored 'General case' 0 C--O 1.235 0.313 0 C-N-CA 125.379 1.472 . . . . 0.0 110.408 -174.408 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 75' ' ' GLN . . . . . 1.04 ' OXT' ' O ' ' A' ' 1' ' ' LYS . 4.3 tp-100 . . . . . 0 C--O 1.269 2.109 0 C-N-CA 125.996 1.718 . . . . 0.0 106.612 178.04 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 1' ' ' LYS . . . . . . . . . . . . . 31.8 mtmt . . . . . 0 N--CA 1.452 -0.342 0 N-CA-C 108.561 -0.903 . . . . 0.0 108.561 . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 81.0 p -62.67 157.1 60.63 Favored Pre-proline 0 CA--C 1.532 0.269 0 C-N-CA 122.736 0.414 . . . . 0.0 110.477 -176.287 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 76.3 Cg_exo -48.51 -36.44 31.34 Favored 'Trans proline' 0 N--CA 1.453 -0.856 0 C-N-CA 122.455 2.103 . . . . 0.0 111.821 168.968 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 44.9 mt-10 -62.46 -53.07 60.31 Favored 'General case' 0 CA--C 1.531 0.234 0 C-N-CA 123.807 0.843 . . . . 0.0 111.327 176.77 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 28.7 mt-10 -55.28 -46.85 76.18 Favored 'General case' 0 C--N 1.335 -0.057 0 CA-C-O 121.599 0.714 . . . . 0.0 109.19 176.37 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 58.9 mt -60.65 -35.75 76.98 Favored 'General case' 0 N--CA 1.446 -0.626 0 C-N-CA 124.118 0.967 . . . . 0.0 112.757 178.344 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER -62.24 -47.95 82.11 Favored 'General case' 0 N--CA 1.454 -0.254 0 CA-C-N 119.031 0.832 . . . . 0.0 109.633 170.629 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . -53.75 -52.02 45.07 Favored Glycine 0 CA--C 1.532 1.106 0 N-CA-C 110.698 -0.961 . . . . 0.0 110.698 177.316 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 9' ' ' ILE . . . . . . . . . . . . . 24.0 mm -55.45 -54.45 25.18 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.235 0 C-N-CA 125.341 1.457 . . . . 0.0 109.775 175.152 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 10' ' ' PHE . . . . . . . . . . . . . 34.4 t80 -47.56 -50.75 23.08 Favored 'General case' 0 N--CA 1.45 -0.45 0 C-N-CA 123.445 0.698 . . . . 0.0 109.878 178.872 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 57.7 mt-10 -61.97 -53.14 59.73 Favored 'General case' 0 CA--C 1.53 0.173 0 C-N-CA 122.59 0.356 . . . . 0.0 110.781 178.385 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 39.4 tttm -44.0 -49.64 8.56 Favored 'General case' 0 CA--C 1.527 0.092 0 C-N-CA 124.986 1.314 . . . . 0.0 111.022 178.624 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 57.6 m-85 -78.38 -52.41 8.62 Favored 'General case' 0 N--CA 1.45 -0.437 0 CA-C-O 119.409 -0.329 . . . . 0.0 110.613 -177.64 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -48.01 -60.65 2.45 Favored 'General case' 0 C--N 1.331 -0.199 0 C-N-CA 124.083 0.953 . . . . 0.0 111.043 -179.444 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -55.14 -20.29 9.78 Favored 'General case' 0 CA--C 1.529 0.167 0 C-N-CA 125.148 1.379 . . . . 0.0 113.051 -177.411 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 10.8 ttmm -62.54 -24.52 67.56 Favored 'General case' 0 CA--C 1.535 0.385 0 CA-C-N 118.247 0.476 . . . . 0.0 111.079 -179.657 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 12.2 tm-20 -154.62 -47.48 0.09 Allowed 'General case' 0 C--N 1.341 0.219 0 CA-C-N 118.211 0.459 . . . . 0.0 111.406 -179.877 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . -79.38 175.21 55.13 Favored Glycine 0 CA--C 1.526 0.741 0 N-CA-C 110.526 -1.03 . . . . 0.0 110.526 -179.664 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 8.1 t70 -62.43 140.86 96.6 Favored Pre-proline 0 CA--C 1.535 0.403 0 N-CA-C 107.149 -1.426 . . . . 0.0 107.149 169.216 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 20' ' ' PRO . . . . . . . . . . . . . 12.0 Cg_endo -51.13 -24.87 15.64 Favored 'Trans proline' 0 CA--C 1.536 0.583 0 C-N-CA 123.087 2.525 . . . . 0.0 114.533 -178.042 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 51.8 m-80 -88.58 2.9 52.17 Favored 'General case' 0 CA--C 1.536 0.429 0 C-N-CA 124.77 1.228 . . . . 0.0 113.105 -179.611 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -149.38 116.43 6.01 Favored 'General case' 0 CA--C 1.541 0.619 0 CA-C-N 119.187 0.903 . . . . 0.0 112.683 -169.039 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 77.9 mt -88.2 134.3 33.82 Favored 'General case' 0 CA--C 1.532 0.288 0 C-N-CA 124.563 1.145 . . . . 0.0 111.095 173.654 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 27.5 p -80.38 178.73 8.1 Favored 'General case' 0 CA--C 1.534 0.341 0 N-CA-C 108.543 -0.91 . . . . 0.0 108.543 166.389 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 64.4 mttp -57.98 -38.95 77.01 Favored 'General case' 0 N--CA 1.455 -0.218 0 N-CA-C 109.806 -0.442 . . . . 0.0 109.806 170.127 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 1.8 mp0 -67.95 -50.74 54.13 Favored 'General case' 0 N--CA 1.45 -0.433 0 C-N-CA 122.883 0.473 . . . . 0.0 110.035 -175.755 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 3.0 mp0 -55.79 -44.77 78.1 Favored 'General case' 0 N--CA 1.452 -0.361 0 C-N-CA 119.826 -0.75 . . . . 0.0 110.236 174.87 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 12.7 mt -56.85 -43.43 81.13 Favored 'General case' 0 CA--C 1.513 -0.454 0 CA-C-N 119.067 0.849 . . . . 0.0 113.153 171.798 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 64.5 tttm -60.31 -48.76 80.38 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-N 118.505 0.593 . . . . 0.0 109.679 -178.444 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 87.2 mt -60.16 -47.47 85.8 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.179 -0.464 . . . . 0.0 111.375 178.166 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 7.6 tt -51.99 -57.64 8.87 Favored 'General case' 0 N--CA 1.456 -0.143 0 C-N-CA 124.175 0.99 . . . . 0.0 109.497 175.721 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 47.6 mt -56.0 -54.24 47.21 Favored 'General case' 0 C--O 1.223 -0.298 0 N-CA-C 108.717 -0.845 . . . . 0.0 108.717 -178.54 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 28.3 tt0 -53.65 -49.77 67.21 Favored 'General case' 0 N--CA 1.451 -0.387 0 C-N-CA 123.777 0.831 . . . . 0.0 111.652 -176.296 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 2.1 m -73.75 -52.76 12.1 Favored 'General case' 0 CA--C 1.531 0.223 0 C-N-CA 120.684 -0.407 . . . . 0.0 110.984 -175.546 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 57.3 mm-40 -87.22 -31.91 20.06 Favored 'General case' 0 N--CA 1.448 -0.555 0 C-N-CA 123.183 0.593 . . . . 0.0 112.426 -166.595 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 74.5 m-85 -145.19 64.16 10.64 Favored Pre-proline 0 CA--C 1.534 0.335 0 C-N-CA 123.425 0.69 . . . . 0.0 111.604 -172.341 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 33.5 Cg_endo -58.59 -30.5 92.18 Favored 'Trans proline' 0 N--CA 1.456 -0.73 0 C-N-CA 122.346 2.031 . . . . 0.0 111.538 -177.969 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 10.4 t -65.07 -32.99 74.98 Favored 'General case' 0 N--CA 1.456 -0.152 0 O-C-N 121.7 -0.625 . . . . 0.0 109.91 177.362 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 79.1 mt -82.05 -30.05 31.59 Favored 'General case' 0 N--CA 1.451 -0.382 0 CA-C-O 118.966 -0.54 . . . . 0.0 110.543 177.051 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 13.9 tp -55.55 -51.99 65.24 Favored 'General case' 0 CA--C 1.53 0.201 0 N-CA-C 108.762 -0.829 . . . . 0.0 108.762 169.191 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 35.7 mmtp -64.71 -50.5 66.71 Favored 'General case' 0 N--CA 1.452 -0.346 0 C-N-CA 122.924 0.49 . . . . 0.0 111.365 178.419 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . -54.09 -48.12 64.41 Favored Glycine 0 CA--C 1.528 0.86 0 C-N-CA 124.257 0.932 . . . . 0.0 111.443 -179.378 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 43' ' ' GLY . . . . . . . . . . . . . . . -74.9 63.76 2.37 Favored Glycine 0 CA--C 1.526 0.766 0 N-CA-C 110.061 -1.216 . . . . 0.0 110.061 173.911 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 44' ' ' SER . . . . . . . . . . . . . 27.4 p -26.54 -59.49 0.08 Allowed 'General case' 0 C--N 1.339 0.143 0 C-N-CA 127.933 2.493 . . . . 0.0 112.996 -177.025 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 14.2 p -109.78 134.4 52.06 Favored 'General case' 0 N--CA 1.448 -0.531 0 C-N-CA 124.203 1.001 . . . . 0.0 109.515 170.062 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 19.5 mt -73.26 -46.86 47.48 Favored 'General case' 0 CA--C 1.517 -0.316 0 C-N-CA 124.181 0.992 . . . . 0.0 108.658 -173.25 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 3.4 m-20 -50.3 -44.89 54.23 Favored 'General case' 0 N--CA 1.453 -0.29 0 C-N-CA 125.261 1.425 . . . . 0.0 111.528 -176.219 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 5.9 mp0 -59.57 -48.21 82.53 Favored 'General case' 0 C--N 1.328 -0.327 0 C-N-CA 123.702 0.801 . . . . 0.0 110.468 176.907 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 1.3 tt -58.64 -50.96 71.94 Favored 'General case' 0 CA--C 1.534 0.335 0 CA-C-O 121.824 0.821 . . . . 0.0 109.264 177.573 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 50' ' ' PHE . . . . . . . . . . . . . 52.4 t80 -51.55 -50.55 59.83 Favored 'General case' 0 N--CA 1.452 -0.336 0 C-N-CA 124.778 1.231 . . . . 0.0 110.537 178.246 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 27.0 tp10 -60.81 -43.54 98.06 Favored 'General case' 0 N--CA 1.454 -0.253 0 C-N-CA 122.879 0.472 . . . . 0.0 110.587 177.528 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 12.8 tm-20 -54.61 -43.27 72.05 Favored 'General case' 0 CA--C 1.533 0.316 0 C-N-CA 122.763 0.425 . . . . 0.0 110.756 177.079 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 92.1 mt -68.28 -64.42 0.87 Allowed 'General case' 0 N--CA 1.452 -0.341 0 C-N-CA 122.698 0.399 . . . . 0.0 110.918 175.486 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 18.2 t0 -97.25 95.68 7.89 Favored 'General case' 0 N--CA 1.455 -0.202 0 C-N-CA 124.466 1.106 . . . . 0.0 109.438 178.935 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 74.1 mmtt -70.43 79.52 0.56 Allowed 'General case' 0 N--CA 1.454 -0.259 0 CA-C-O 121.794 0.807 . . . . 0.0 110.454 172.464 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 56' ' ' ASN . . . . . . . . . . . . . 16.8 p-10 28.92 48.81 0.03 OUTLIER 'General case' 0 C--N 1.327 -0.402 0 C-N-CA 130.635 3.574 . . . . 0.0 113.013 -179.543 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . -83.54 -83.0 0.93 Allowed Glycine 0 CA--C 1.524 0.622 0 N-CA-C 109.245 -1.542 . . . . 0.0 109.245 179.445 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 12.5 p-10 -91.63 -22.29 20.36 Favored 'General case' 0 N--CA 1.453 -0.279 0 C-N-CA 124.32 1.048 . . . . 0.0 111.428 179.225 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . 93.61 9.48 60.01 Favored Glycine 0 CA--C 1.53 1.021 0 CA-C-O 119.019 -0.878 . . . . 0.0 112.835 177.916 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 31.7 mt-10 -146.13 173.11 12.49 Favored 'General case' 0 N--CA 1.456 -0.14 0 C-N-CA 127.059 2.144 . . . . 0.0 106.722 172.831 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 61' ' ' VAL . . . . . . . . . . . . . 65.5 t -109.92 103.05 14.87 Favored 'Isoleucine or valine' 0 CA--C 1.529 0.137 0 CA-C-N 118.184 0.447 . . . . 0.0 110.231 -169.164 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 11.9 t -78.81 170.96 15.86 Favored 'General case' 0 CA--C 1.535 0.374 0 CA-C-O 121.16 0.505 . . . . 0.0 111.383 172.52 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 63' ' ' PHE . . . . . . . . . . . . . 57.3 t80 -63.85 -39.58 94.54 Favored 'General case' 0 C--O 1.232 0.137 0 C-N-CA 122.713 0.405 . . . . 0.0 111.332 -173.062 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 50.2 mt-10 -61.4 -58.39 8.41 Favored 'General case' 0 N--CA 1.452 -0.359 0 O-C-N 122.088 -0.383 . . . . 0.0 110.025 -178.745 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 10.8 pt-20 -61.27 -36.4 79.94 Favored 'General case' 0 CA--C 1.537 0.458 0 O-C-N 121.707 -0.621 . . . . 0.0 111.547 178.574 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 24.7 t80 -52.97 -26.68 15.98 Favored 'General case' 0 CA--C 1.54 0.562 0 O-C-N 121.313 -0.867 . . . . 0.0 112.585 169.777 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 67' ' ' GLN . . . . . . . . . . . . . 40.2 mm-40 -54.81 -25.64 29.67 Favored 'General case' 0 CA--C 1.537 0.463 0 CA-C-N 119.819 1.191 . . . . 0.0 112.926 173.051 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 96.5 t -54.58 -32.69 25.53 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.605 0 CA-C-N 118.685 0.675 . . . . 0.0 110.458 172.238 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -77.16 -50.28 13.34 Favored 'General case' 0 N--CA 1.455 -0.211 0 C-N-CA 124.684 1.193 . . . . 0.0 108.696 172.931 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 70' ' ' VAL . . . . . . . . . . . . . 98.0 t -50.64 -45.32 26.69 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.314 0 O-C-N 121.861 -0.525 . . . . 0.0 111.702 -177.674 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 16.1 pttp -60.1 -38.86 84.21 Favored 'General case' 0 CA--C 1.53 0.185 0 O-C-N 121.733 -0.604 . . . . 0.0 111.609 179.24 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 72' ' ' LYS . . . . . . . . . . . . 0.282 0.1 OUTLIER -68.21 -42.03 80.44 Favored 'General case' 0 N--CA 1.441 -0.91 0 C-N-CA 125.551 1.54 . . . . 0.0 108.703 -179.966 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 73' ' ' ILE . . . . . . . . . . . . . 49.0 mm -58.42 -47.46 87.96 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.289 0 CA-C-N 118.722 0.692 . . . . 0.0 109.913 171.635 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 74' ' ' SER . . . . . 0.451 ' C ' ' OXT' ' A' ' 75' ' ' GLN . 19.6 m -61.93 -40.44 95.51 Favored 'General case' 0 CA--C 1.53 0.197 0 C-N-CA 123.312 0.645 . . . . 0.0 111.251 -177.485 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 75' ' ' GLN . . . . . 0.451 ' OXT' ' C ' ' A' ' 74' ' ' SER . 60.6 tt0 . . . . . 0 C--O 1.271 2.204 0 C-N-CA 124.902 1.281 . . . . 0.0 110.893 178.611 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 1' ' ' LYS . . . . . . . . . . . . . 39.4 mmtm . . . . . 0 N--CA 1.45 -0.429 0 N-CA-C 107.793 -1.188 . . . . 0.0 107.793 . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 99.5 p -77.19 158.79 79.21 Favored Pre-proline 0 CA--C 1.534 0.332 0 N-CA-C 108.739 -0.837 . . . . 0.0 108.739 171.248 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 88.6 Cg_exo -48.4 -39.73 35.99 Favored 'Trans proline' 0 N--CA 1.458 -0.587 0 C-N-CA 122.623 2.216 . . . . 0.0 112.58 169.999 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 48.4 mt-10 -60.93 -50.23 74.24 Favored 'General case' 0 C--O 1.232 0.177 0 C-N-CA 123.335 0.654 . . . . 0.0 110.841 177.357 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 45.1 mm-40 -59.58 -46.01 90.18 Favored 'General case' 0 N--CA 1.453 -0.281 0 N-CA-C 108.794 -0.817 . . . . 0.0 108.794 178.008 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 6' ' ' LEU . . . . . 0.422 HD13 HG22 ' A' ' 70' ' ' VAL . 25.6 mt -57.9 -40.1 79.5 Favored 'General case' 0 N--CA 1.445 -0.703 0 CA-C-O 118.653 -0.689 . . . . 0.0 112.333 178.235 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 20.6 tptm -59.5 -52.33 66.02 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 119.506 1.048 . . . . 0.0 110.168 171.94 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . -49.89 -53.84 20.63 Favored Glycine 0 CA--C 1.536 1.372 0 N-CA-C 111.699 -0.561 . . . . 0.0 111.699 177.927 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 9' ' ' ILE . . . . . . . . . . . . . 1.6 mm -53.7 -56.4 9.08 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.163 0 C-N-CA 127.007 2.123 . . . . 0.0 108.825 175.826 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 10' ' ' PHE . . . . . . . . . . . . . 24.0 t80 -49.36 -50.53 39.56 Favored 'General case' 0 N--CA 1.444 -0.732 0 C-N-CA 123.406 0.683 . . . . 0.0 109.374 -179.27 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 53.1 mt-10 -62.41 -48.07 81.31 Favored 'General case' 0 N--CA 1.453 -0.29 0 C-N-CA 123.196 0.598 . . . . 0.0 110.833 -179.147 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 37.1 tttm -44.2 -51.45 8.18 Favored 'General case' 0 CA--C 1.529 0.163 0 C-N-CA 124.006 0.923 . . . . 0.0 111.002 177.207 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 85.1 m-85 -79.38 -49.28 12.61 Favored 'General case' 0 CA--C 1.535 0.376 0 CA-C-O 120.546 0.212 . . . . 0.0 111.12 -177.245 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -55.67 -39.02 70.39 Favored 'General case' 0 N--CA 1.464 0.243 0 C-N-CA 124.532 1.133 . . . . 0.0 112.558 -177.428 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -50.42 -31.34 14.72 Favored 'General case' 0 CA--C 1.532 0.279 0 C-N-CA 123.411 0.684 . . . . 0.0 111.807 175.794 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 7.9 mtmp? -69.58 -30.4 68.17 Favored 'General case' 0 CA--C 1.535 0.395 0 CA-C-N 118.181 0.446 . . . . 0.0 111.388 -179.805 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 49.0 mm-40 -70.4 -48.08 57.82 Favored 'General case' 0 C--N 1.342 0.263 0 N-CA-C 107.961 -1.126 . . . . 0.0 107.961 168.179 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 145.04 -62.98 0.47 Allowed Glycine 0 C--O 1.227 -0.282 0 N-CA-C 108.983 -1.647 . . . . 0.0 108.983 175.916 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 35.1 t0 -65.83 110.68 4.88 Favored Pre-proline 0 CA--C 1.534 0.358 0 CA-C-O 118.548 -0.739 . . . . 0.0 109.117 178.185 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 20' ' ' PRO . . . . . . . . . . . . . 32.8 Cg_endo -59.5 -21.54 62.22 Favored 'Trans proline' 0 N--CA 1.456 -0.725 0 C-N-CA 121.95 1.766 . . . . 0.0 112.414 -178.547 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 41.9 m-80 -85.42 -5.02 59.33 Favored 'General case' 0 N--CA 1.452 -0.331 0 C-N-CA 124.526 1.13 . . . . 0.0 113.205 -174.167 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 27.8 tt0 -142.91 126.34 16.72 Favored 'General case' 0 CA--C 1.543 0.679 0 CA-C-N 119.513 1.051 . . . . 0.0 113.823 -169.553 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 70.4 mt -103.94 138.27 40.75 Favored 'General case' 0 C--N 1.345 0.393 0 C-N-CA 125.451 1.5 . . . . 0.0 112.15 -179.413 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 77.9 p -80.56 172.76 13.34 Favored 'General case' 0 C--O 1.234 0.259 0 C-N-CA 123.966 0.906 . . . . 0.0 109.722 168.021 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 98.3 mttt -55.41 -45.07 76.71 Favored 'General case' 0 C--O 1.226 -0.172 0 N-CA-C 110.169 -0.308 . . . . 0.0 110.169 172.045 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 22.9 mt-10 -65.85 -46.99 76.45 Favored 'General case' 0 CA--C 1.516 -0.336 0 CA-C-O 120.785 0.326 . . . . 0.0 110.559 -175.96 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -61.67 -39.92 93.12 Favored 'General case' 0 C--N 1.327 -0.374 0 C-N-CA 120.062 -0.655 . . . . 0.0 110.056 177.844 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 13.5 mt -57.47 -47.59 81.45 Favored 'General case' 0 C--O 1.218 -0.593 0 CA-C-N 119.346 0.975 . . . . 0.0 111.897 168.554 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 38.4 ttpt -58.08 -47.26 83.75 Favored 'General case' 0 C--N 1.323 -0.582 0 CA-C-N 119.002 0.819 . . . . 0.0 110.077 -175.95 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 3.7 mm? -59.59 -48.04 83.2 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.351 -0.386 . . . . 0.0 111.475 175.498 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 7.9 tt -51.23 -57.49 8.67 Favored 'General case' 0 N--CA 1.456 -0.136 0 C-N-CA 123.563 0.745 . . . . 0.0 109.896 176.061 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 48.0 mt -57.93 -51.2 70.62 Favored 'General case' 0 C--O 1.223 -0.292 0 N-CA-C 109.546 -0.539 . . . . 0.0 109.546 -179.247 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 17.5 tt0 -54.67 -44.15 73.05 Favored 'General case' 0 N--CA 1.452 -0.344 0 O-C-N 121.744 -0.597 . . . . 0.0 111.755 -176.598 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 2.1 m -77.85 -49.03 15.07 Favored 'General case' 0 CA--C 1.534 0.36 0 C-N-CA 120.92 -0.312 . . . . 0.0 111.316 -177.611 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 67.1 mm-40 -96.79 -27.9 14.52 Favored 'General case' 0 N--CA 1.451 -0.383 0 N-CA-C 114.015 1.117 . . . . 0.0 114.015 -165.716 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 97.9 m-85 -145.33 70.21 14.19 Favored Pre-proline 0 CA--C 1.538 0.513 0 C-N-CA 124.559 1.144 . . . . 0.0 112.2 -176.592 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 88.9 Cg_exo -47.91 -34.7 23.03 Favored 'Trans proline' 0 N--CA 1.459 -0.544 0 C-N-CA 123.178 2.585 . . . . 0.0 112.944 171.204 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 3.0 p -54.86 -56.65 17.18 Favored 'General case' 0 N--CA 1.45 -0.467 0 C-N-CA 125.151 1.38 . . . . 0.0 109.594 176.758 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 81.4 mt -62.26 -41.1 98.15 Favored 'General case' 0 N--CA 1.449 -0.478 0 CA-C-N 115.334 -0.848 . . . . 0.0 111.04 177.588 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 12.8 tp -53.61 -48.58 69.17 Favored 'General case' 0 CA--C 1.531 0.243 0 CA-C-N 118.183 0.447 . . . . 0.0 110.32 176.268 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 95.3 mttt -74.09 -49.23 24.91 Favored 'General case' 0 N--CA 1.45 -0.427 0 C-N-CA 123.532 0.733 . . . . 0.0 112.678 -174.638 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . -121.26 0.85 11.53 Favored Glycine 0 CA--C 1.528 0.847 0 N-CA-C 115.624 1.01 . . . . 0.0 115.624 -168.283 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 43' ' ' GLY . . . . . . . . . . . . . . . -76.69 65.35 2.86 Favored Glycine 0 CA--C 1.527 0.784 0 CA-C-N 119.055 1.428 . . . . 0.0 110.337 179.46 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 44' ' ' SER . . . . . . . . . . . . . 25.8 t 55.1 -146.59 0.56 Allowed 'General case' 0 CA--C 1.535 0.367 0 C-N-CA 123.801 0.84 . . . . 0.0 108.98 -169.576 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 22.0 p -110.98 146.16 37.14 Favored 'General case' 0 N--CA 1.454 -0.267 0 N-CA-C 106.929 -1.508 . . . . 0.0 106.929 169.005 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 66.9 tp -51.88 -46.94 64.69 Favored 'General case' 0 C--O 1.225 -0.192 0 C-N-CA 123.431 0.692 . . . . 0.0 112.274 -169.509 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 6.2 m-20 -59.21 -51.51 69.66 Favored 'General case' 0 N--CA 1.45 -0.431 0 C-N-CA 123.017 0.527 . . . . 0.0 110.829 -179.54 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 38.1 mm-40 -61.41 -43.96 97.96 Favored 'General case' 0 N--CA 1.453 -0.317 0 CA-C-N 116.291 -0.413 . . . . 0.0 110.394 -179.905 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 67.0 tp -56.99 -50.65 72.05 Favored 'General case' 0 N--CA 1.451 -0.38 0 N-CA-C 109.431 -0.581 . . . . 0.0 109.431 175.724 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 50' ' ' PHE . . . . . . . . . . . . . 65.4 t80 -54.06 -50.85 65.82 Favored 'General case' 0 N--CA 1.45 -0.439 0 C-N-CA 123.806 0.842 . . . . 0.0 110.508 -178.982 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 59.0 mm-40 -58.22 -47.51 83.27 Favored 'General case' 0 CA--C 1.532 0.267 0 CA-C-O 120.629 0.252 . . . . 0.0 111.151 175.683 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 40.7 tt0 -55.28 -40.3 70.87 Favored 'General case' 0 CA--C 1.531 0.238 0 C-N-CA 123.526 0.73 . . . . 0.0 111.338 179.279 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 84.3 mt -77.18 -49.28 15.52 Favored 'General case' 0 N--CA 1.448 -0.567 0 C-N-CA 122.99 0.516 . . . . 0.0 111.492 -179.341 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 43.8 t0 -74.9 59.74 0.92 Allowed 'General case' 0 CA--C 1.536 0.409 0 C-N-CA 123.828 0.851 . . . . 0.0 111.586 -175.799 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 16.4 mmtp -62.21 -33.72 75.11 Favored 'General case' 0 N--CA 1.456 -0.162 0 C-N-CA 123.54 0.736 . . . . 0.0 111.965 -178.104 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 56' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -74.95 -8.15 55.67 Favored 'General case' 0 CA--C 1.536 0.426 0 N-CA-C 112.355 0.502 . . . . 0.0 112.355 175.868 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . 63.17 36.63 93.7 Favored Glycine 0 CA--C 1.527 0.831 0 C-N-CA 123.724 0.678 . . . . 0.0 113.458 172.01 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 1.6 p30 -78.42 -13.1 59.99 Favored 'General case' 0 CA--C 1.534 0.344 0 CA-C-N 118.697 1.248 . . . . 0.0 112.362 179.198 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . 100.27 -0.72 55.93 Favored Glycine 0 CA--C 1.53 1.016 0 C-N-CA 123.821 0.724 . . . . 0.0 112.368 179.172 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 42.0 mt-10 -147.47 170.95 16.32 Favored 'General case' 0 N--CA 1.452 -0.338 0 C-N-CA 127.626 2.371 . . . . 0.0 106.137 173.528 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 61' ' ' VAL . . . . . . . . . . . . . 16.1 t -102.32 116.22 45.61 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.149 0 N-CA-C 108.807 -0.812 . . . . 0.0 108.807 -179.028 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 78.3 p -79.99 156.67 27.08 Favored 'General case' 0 CA--C 1.537 0.458 0 C-N-CA 122.934 0.493 . . . . 0.0 111.248 174.966 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 63' ' ' PHE . . . . . . . . . . . . . 77.2 t80 -56.11 -32.88 64.59 Favored 'General case' 0 N--CA 1.467 0.383 0 N-CA-C 113.31 0.856 . . . . 0.0 113.31 -178.361 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 13.0 tp10 -65.42 -62.45 1.52 Allowed 'General case' 0 N--CA 1.453 -0.288 0 O-C-N 121.882 -0.511 . . . . 0.0 109.624 178.495 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 12.0 pt-20 -64.97 -27.15 68.64 Favored 'General case' 0 CA--C 1.54 0.578 0 O-C-N 121.182 -0.948 . . . . 0.0 111.553 -177.023 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 15.5 t80 -50.97 -27.53 7.86 Favored 'General case' 0 CA--C 1.534 0.33 0 C-N-CA 123.499 0.72 . . . . 0.0 112.176 168.828 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 67' ' ' GLN . . . . . . . . . . . . . 66.8 mm-40 -53.88 -24.29 15.45 Favored 'General case' 0 CA--C 1.54 0.559 0 CA-C-N 119.814 1.188 . . . . 0.0 113.058 173.314 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 97.2 t -57.06 -31.26 36.46 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.631 0 O-C-N 121.043 -1.036 . . . . 0.0 111.24 171.796 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 7.5 tt -71.93 -44.22 63.99 Favored 'General case' 0 N--CA 1.457 -0.094 0 N-CA-C 107.721 -1.214 . . . . 0.0 107.721 177.959 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 70' ' ' VAL . . . . . 0.422 HG22 HD13 ' A' ' 6' ' ' LEU . 18.2 t -60.06 -42.77 90.94 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.286 0 N-CA-C 109.804 -0.443 . . . . 0.0 109.804 178.07 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 55.0 tttm -51.59 -57.48 9.01 Favored 'General case' 0 N--CA 1.454 -0.241 0 N-CA-C 109.668 -0.493 . . . . 0.0 109.668 170.028 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 5.0 mptp? -49.4 -44.71 45.33 Favored 'General case' 0 CA--C 1.533 0.302 0 C-N-CA 123.317 0.647 . . . . 0.0 112.575 177.95 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 73' ' ' ILE . . . . . . . . . . . . . 58.0 mt -58.79 -55.53 22.56 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.226 0 N-CA-C 109.59 -0.522 . . . . 0.0 109.59 174.327 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 98.8 p -61.25 -45.24 95.34 Favored 'General case' 0 CA--C 1.53 0.189 0 N-CA-C 112.143 0.424 . . . . 0.0 112.143 -170.003 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 75' ' ' GLN . . . . . . . . . . . . . 16.3 pt20 . . . . . 0 C--O 1.27 2.154 0 O-C-N 122.148 -0.345 . . . . 0.0 110.137 -179.128 . . . . . . . . 0 0 . 1 . 011 nuclear nobuild full ' A' A ' 1' ' ' LYS . . . . . . . . . . . . . 74.6 mmtt . . . . . 0 N--CA 1.45 -0.434 0 N-CA-C 108.493 -0.928 . . . . 0.0 108.493 . . . . . . . . . 0 0 . 1 . 011 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 84.6 p -69.0 154.64 94.85 Favored Pre-proline 0 CA--C 1.534 0.365 0 N-CA-C 109.711 -0.477 . . . . 0.0 109.711 175.89 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 84.8 Cg_exo -47.38 -36.71 23.8 Favored 'Trans proline' 0 N--CA 1.456 -0.71 0 C-N-CA 122.761 2.307 . . . . 0.0 112.364 169.256 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 44.7 mt-10 -62.71 -48.94 77.06 Favored 'General case' 0 CA--C 1.529 0.162 0 C-N-CA 123.657 0.783 . . . . 0.0 111.395 176.652 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 29.0 mt-10 -60.11 -46.46 89.55 Favored 'General case' 0 C--N 1.332 -0.164 0 N-CA-C 109.148 -0.686 . . . . 0.0 109.148 177.18 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 27.4 mt -60.29 -39.34 86.55 Favored 'General case' 0 N--CA 1.447 -0.585 0 C-N-CA 123.031 0.532 . . . . 0.0 111.953 179.087 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 19.7 tptm -58.86 -49.12 78.92 Favored 'General case' 0 C--N 1.332 -0.175 0 O-C-N 121.678 -0.639 . . . . 0.0 110.046 170.029 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . -51.66 -50.68 41.87 Favored Glycine 0 CA--C 1.529 0.941 0 N-CA-C 110.401 -1.08 . . . . 0.0 110.401 178.686 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 9' ' ' ILE . . . . . . . . . . . . . 24.4 mm -57.6 -54.95 24.52 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.252 0 C-N-CA 125.324 1.45 . . . . 0.0 109.894 175.795 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 10' ' ' PHE . . . . . . . . . . . . . 25.6 t80 -48.36 -50.84 28.97 Favored 'General case' 0 N--CA 1.446 -0.673 0 O-C-N 121.747 -0.596 . . . . 0.0 109.673 179.815 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 43.6 mt-10 -64.4 -46.69 82.21 Favored 'General case' 0 N--CA 1.453 -0.298 0 CA-C-O 118.687 -0.673 . . . . 0.0 111.429 179.596 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 29.2 ttmt -43.37 -53.3 5.41 Favored 'General case' 0 N--CA 1.464 0.24 0 C-N-CA 124.072 0.949 . . . . 0.0 110.469 175.947 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 80.3 m-85 -78.86 -47.84 15.82 Favored 'General case' 0 N--CA 1.451 -0.392 0 CA-C-N 116.544 -0.298 . . . . 0.0 110.829 -175.346 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -56.75 -45.48 81.99 Favored 'General case' 0 CA--C 1.533 0.32 0 CA-C-O 121.654 0.74 . . . . 0.0 112.1 -177.919 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -53.33 -30.39 38.96 Favored 'General case' 0 CA--C 1.53 0.193 0 C-N-CA 123.96 0.904 . . . . 0.0 111.777 175.967 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 15.4 ttmm -63.15 -33.86 76.38 Favored 'General case' 0 CA--C 1.533 0.302 0 CA-C-N 117.835 0.289 . . . . 0.0 110.484 178.864 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 6.0 tp10 -73.94 -49.18 25.87 Favored 'General case' 0 C--N 1.341 0.209 0 N-CA-C 108.572 -0.899 . . . . 0.0 108.572 171.355 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 153.63 -63.68 0.36 Allowed Glycine 0 CA--C 1.521 0.421 0 N-CA-C 109.701 -1.36 . . . . 0.0 109.701 175.081 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 43.9 t0 -67.52 113.8 16.04 Favored Pre-proline 0 CA--C 1.533 0.306 0 CA-C-O 118.304 -0.855 . . . . 0.0 109.26 -179.9 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 20' ' ' PRO . . . . . . . . . . . . . 29.3 Cg_endo -61.52 -20.0 66.87 Favored 'Trans proline' 0 N--CA 1.456 -0.702 0 C-N-CA 121.91 1.74 . . . . 0.0 113.124 179.505 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 43.1 m-80 -89.81 -6.14 56.22 Favored 'General case' 0 CA--C 1.531 0.228 0 C-N-CA 124.539 1.136 . . . . 0.0 113.601 -170.571 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 30.0 tt0 -148.09 126.35 12.24 Favored 'General case' 0 CA--C 1.541 0.606 0 CA-C-N 119.39 0.995 . . . . 0.0 112.492 -168.138 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 51.2 mt -103.31 135.88 44.13 Favored 'General case' 0 C--N 1.344 0.361 0 C-N-CA 125.295 1.438 . . . . 0.0 111.117 -178.649 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 7.0 p -88.6 178.06 6.61 Favored 'General case' 0 C--O 1.236 0.376 0 N-CA-C 108.475 -0.935 . . . . 0.0 108.475 167.162 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 99.1 mttt -54.16 -43.65 70.77 Favored 'General case' 0 N--CA 1.454 -0.231 0 C-N-CA 122.991 0.516 . . . . 0.0 111.299 -179.754 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 34.3 tt0 -65.84 -46.38 78.73 Favored 'General case' 0 N--CA 1.456 -0.14 0 O-C-N 121.995 -0.441 . . . . 0.0 110.602 -175.636 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 4.1 mp0 -58.39 -45.31 88.57 Favored 'General case' 0 N--CA 1.453 -0.322 0 N-CA-C 109.474 -0.565 . . . . 0.0 109.474 176.609 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 18.9 mt -57.39 -42.02 81.37 Favored 'General case' 0 CA--C 1.512 -0.489 0 C-N-CA 120.288 -0.565 . . . . 0.0 112.262 173.279 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 25.3 ttpp -61.71 -50.96 70.34 Favored 'General case' 0 N--CA 1.447 -0.582 0 CA-C-N 118.725 0.693 . . . . 0.0 109.479 -178.113 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 83.3 mt -59.83 -46.02 90.56 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-O 120.847 0.356 . . . . 0.0 111.398 178.972 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 8.0 tt -53.31 -55.92 20.78 Favored 'General case' 0 C--N 1.332 -0.168 0 C-N-CA 124.002 0.921 . . . . 0.0 109.518 174.695 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 38.4 mt -54.14 -54.39 40.24 Favored 'General case' 0 C--O 1.226 -0.178 0 C-N-CA 123.517 0.727 . . . . 0.0 109.689 -179.412 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 41.2 mt-30 -51.32 -51.84 50.68 Favored 'General case' 0 N--CA 1.457 -0.087 0 C-N-CA 122.954 0.502 . . . . 0.0 111.432 179.249 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 7.0 m -70.19 -53.95 14.93 Favored 'General case' 0 N--CA 1.455 -0.205 0 CA-C-N 116.485 -0.325 . . . . 0.0 111.149 -172.483 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 42.5 mm-40 -94.05 -34.84 12.85 Favored 'General case' 0 N--CA 1.45 -0.438 0 N-CA-C 113.134 0.79 . . . . 0.0 113.134 -167.671 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 17.3 m-85 -133.05 56.41 21.77 Favored Pre-proline 0 CA--C 1.53 0.209 0 C-N-CA 122.626 0.37 . . . . 0.0 111.82 -170.571 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 56.5 Cg_endo -60.57 -27.96 85.77 Favored 'Trans proline' 0 N--CA 1.453 -0.904 0 C-N-CA 122.211 1.941 . . . . 0.0 110.619 -178.974 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -57.7 -32.4 67.34 Favored 'General case' 0 N--CA 1.451 -0.424 0 C-N-CA 125.853 1.661 . . . . 0.0 111.083 -179.202 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 49.7 mt -72.5 -27.5 62.3 Favored 'General case' 0 N--CA 1.45 -0.44 0 C-N-CA 123.016 0.526 . . . . 0.0 111.007 178.229 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 85.3 mt -81.88 69.77 8.64 Favored 'General case' 0 N--CA 1.456 -0.132 0 CA-C-O 123.85 1.786 . . . . 0.0 110.718 -179.095 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -114.94 -151.63 0.49 Allowed 'General case' 0 N--CA 1.437 -1.091 0 C-N-CA 128.848 2.859 . . . . 0.0 105.946 169.592 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . -75.18 52.45 2.57 Favored Glycine 0 CA--C 1.531 1.077 0 O-C-N 121.037 -1.039 . . . . 0.0 111.166 171.633 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 43' ' ' GLY . . . . . . . . . . . . . . . -78.65 60.57 4.06 Favored Glycine 0 CA--C 1.525 0.689 0 N-CA-C 109.999 -1.24 . . . . 0.0 109.999 -177.077 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 44' ' ' SER . . . . . . . . . . . . . 54.3 p 52.22 -102.46 0.13 Allowed 'General case' 0 N--CA 1.442 -0.85 0 C-N-CA 125.8 1.64 . . . . 0.0 110.84 -170.227 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 76.3 p -143.59 159.85 41.71 Favored 'General case' 0 N--CA 1.453 -0.277 0 N-CA-C 106.941 -1.503 . . . . 0.0 106.941 168.836 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 56.8 tp -51.89 -43.83 63.51 Favored 'General case' 0 C--O 1.224 -0.265 0 CA-C-O 120.781 0.324 . . . . 0.0 110.254 170.056 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 5.5 m-20 -56.88 -55.48 33.92 Favored 'General case' 0 N--CA 1.452 -0.325 0 C-N-CA 124.271 1.028 . . . . 0.0 111.313 177.571 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 31.1 mm-40 -59.08 -42.83 91.38 Favored 'General case' 0 C--N 1.331 -0.213 0 O-C-N 122.222 -0.299 . . . . 0.0 111.119 178.692 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 59.1 tp -59.19 -47.42 85.37 Favored 'General case' 0 CA--C 1.531 0.233 0 CA-C-O 121.207 0.527 . . . . 0.0 110.055 176.485 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 50' ' ' PHE . . . . . . . . . . . . . 59.7 t80 -55.03 -49.35 71.78 Favored 'General case' 0 N--CA 1.452 -0.371 0 C-N-CA 123.914 0.885 . . . . 0.0 109.888 178.989 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 78.3 mm-40 -59.2 -46.07 89.4 Favored 'General case' 0 N--CA 1.455 -0.209 0 CA-C-O 120.443 0.163 . . . . 0.0 111.42 175.11 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 36.8 tt0 -52.14 -45.08 64.87 Favored 'General case' 0 CA--C 1.531 0.224 0 C-N-CA 122.735 0.414 . . . . 0.0 111.016 177.651 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 96.4 mt -68.68 -59.58 3.01 Favored 'General case' 0 N--CA 1.451 -0.393 0 C-N-CA 122.982 0.513 . . . . 0.0 110.846 177.655 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 12.0 t0 -113.34 100.14 8.33 Favored 'General case' 0 N--CA 1.455 -0.202 0 C-N-CA 125.648 1.579 . . . . 0.0 110.136 178.209 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 30.6 mmmt -73.67 78.32 1.52 Allowed 'General case' 0 N--CA 1.455 -0.191 0 CA-C-O 122.462 1.125 . . . . 0.0 110.499 174.699 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 56' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER 39.85 38.28 0.44 Allowed 'General case' 0 C--N 1.323 -0.579 0 C-N-CA 130.135 3.374 . . . . 0.0 114.532 179.661 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . -78.97 -80.72 0.74 Allowed Glycine 0 CA--C 1.525 0.677 0 N-CA-C 109.933 -1.267 . . . . 0.0 109.933 -179.8 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 14.2 p-10 -88.61 -8.24 55.03 Favored 'General case' 0 CA--C 1.535 0.369 0 C-N-CA 124.256 1.023 . . . . 0.0 111.644 177.514 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . 69.22 26.54 74.54 Favored Glycine 0 CA--C 1.528 0.875 0 N-CA-C 111.484 -0.647 . . . . 0.0 111.484 -179.315 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 25.6 mt-10 -160.54 175.09 13.11 Favored 'General case' 0 N--CA 1.453 -0.299 0 C-N-CA 128.203 2.601 . . . . 0.0 105.829 -179.826 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 61' ' ' VAL . . . . . . . . . . . . . 98.7 t -113.68 110.2 31.27 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.248 0 N-CA-C 108.924 -0.769 . . . . 0.0 108.924 -179.248 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 4.6 m -79.23 163.21 25.16 Favored 'General case' 0 CA--C 1.535 0.39 0 C-N-CA 124.699 1.2 . . . . 0.0 110.648 174.126 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 63' ' ' PHE . . . . . . . . . . . . . 64.9 t80 -58.48 -34.63 71.1 Favored 'General case' 0 N--CA 1.466 0.33 0 N-CA-C 113.084 0.772 . . . . 0.0 113.084 -177.563 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 12.7 tp10 -65.17 -60.63 2.79 Favored 'General case' 0 CA--C 1.533 0.32 0 O-C-N 121.931 -0.481 . . . . 0.0 109.896 178.255 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 9.9 pt-20 -61.83 -30.9 71.14 Favored 'General case' 0 CA--C 1.539 0.52 0 O-C-N 121.376 -0.827 . . . . 0.0 111.679 -178.506 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 20.6 t80 -51.35 -30.53 18.97 Favored 'General case' 0 CA--C 1.535 0.396 0 O-C-N 121.462 -0.774 . . . . 0.0 112.476 169.019 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 67' ' ' GLN . . . . . . . . . . . . . 77.9 mm-40 -55.52 -23.52 26.77 Favored 'General case' 0 CA--C 1.537 0.461 0 CA-C-N 119.723 1.147 . . . . 0.0 112.769 174.224 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 90.7 t -60.35 -33.09 52.67 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.563 0 CA-C-N 119.512 1.051 . . . . 0.0 110.789 172.068 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 3.2 tm? -72.71 -49.69 29.57 Favored 'General case' 0 N--CA 1.457 -0.085 0 N-CA-C 106.997 -1.483 . . . . 0.0 106.997 -179.35 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 70' ' ' VAL . . . . . . . . . . . . . 22.0 t -55.24 -45.26 77.5 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.406 0 C-N-CA 122.845 0.458 . . . . 0.0 109.982 176.705 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 5.1 ttpm? -54.65 -54.41 42.03 Favored 'General case' 0 N--CA 1.452 -0.327 0 C-N-CA 122.911 0.484 . . . . 0.0 110.328 173.961 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 12.6 mptt -48.7 -46.06 40.03 Favored 'General case' 0 CA--C 1.535 0.391 0 N-CA-C 112.457 0.54 . . . . 0.0 112.457 176.124 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 73' ' ' ILE . . . . . . . . . . . . . 71.2 mt -50.25 -38.06 14.89 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.532 0 CA-C-O 119.157 -0.449 . . . . 0.0 110.857 176.941 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 74' ' ' SER . . . . . 0.555 ' O ' ' OXT' ' A' ' 75' ' ' GLN . 61.0 p 45.27 -94.6 0.02 OUTLIER 'General case' 0 CA--C 1.532 0.287 0 C-N-CA 126.224 1.81 . . . . 0.0 113.145 170.437 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 75' ' ' GLN . . . . . 0.555 ' OXT' ' O ' ' A' ' 74' ' ' SER . 17.7 tt0 . . . . . 0 C--O 1.27 2.181 0 C-N-CA 125.251 1.421 . . . . 0.0 111.015 178.266 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 1' ' ' LYS . . . . . . . . . . . . . 30.2 mmtp . . . . . 0 N--CA 1.45 -0.474 0 N-CA-C 108.31 -0.996 . . . . 0.0 108.31 . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 99.6 p -79.72 157.24 74.64 Favored Pre-proline 0 CA--C 1.533 0.291 0 N-CA-C 109.032 -0.729 . . . . 0.0 109.032 174.988 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 86.2 Cg_exo -48.05 -39.76 33.33 Favored 'Trans proline' 0 N--CA 1.458 -0.616 0 C-N-CA 122.958 2.438 . . . . 0.0 112.015 169.498 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 48.9 mt-10 -62.2 -49.43 75.81 Favored 'General case' 0 N--CA 1.455 -0.191 0 C-N-CA 123.534 0.734 . . . . 0.0 111.105 177.578 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 2.4 tm-20 -62.4 -43.33 99.08 Favored 'General case' 0 CA--C 1.531 0.215 0 N-CA-C 108.414 -0.958 . . . . 0.0 108.414 -179.483 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 31.7 mt -59.99 -39.85 87.15 Favored 'General case' 0 N--CA 1.45 -0.475 0 C-N-CA 124.245 1.018 . . . . 0.0 111.732 176.827 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 54.8 tptt -59.35 -50.46 73.87 Favored 'General case' 0 C--N 1.333 -0.14 0 CA-C-N 118.986 0.812 . . . . 0.0 110.157 170.575 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . -49.22 -53.65 18.57 Favored Glycine 0 CA--C 1.532 1.127 0 N-CA-C 111.246 -0.742 . . . . 0.0 111.246 177.346 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 9' ' ' ILE . . . . . . . . . . . . . 1.6 mm -56.52 -54.49 27.93 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.226 0 C-N-CA 125.81 1.644 . . . . 0.0 109.209 176.565 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 10' ' ' PHE . . . . . . . . . . . . . 19.6 t80 -48.03 -51.35 24.47 Favored 'General case' 0 N--CA 1.447 -0.607 0 C-N-CA 123.304 0.642 . . . . 0.0 109.562 179.574 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 52.8 mt-10 -62.41 -49.89 73.67 Favored 'General case' 0 N--CA 1.455 -0.196 0 C-N-CA 123.374 0.67 . . . . 0.0 110.727 -179.749 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 45.4 tttp -43.78 -50.9 7.63 Favored 'General case' 0 CA--C 1.528 0.098 0 C-N-CA 124.094 0.958 . . . . 0.0 110.87 177.606 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 75.4 m-85 -79.56 -47.92 14.7 Favored 'General case' 0 CA--C 1.528 0.13 0 N-CA-C 111.836 0.31 . . . . 0.0 111.836 -177.937 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -57.07 -31.21 64.98 Favored 'General case' 0 N--CA 1.466 0.354 0 C-N-CA 124.902 1.281 . . . . 0.0 112.859 -178.628 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -58.77 -30.38 67.51 Favored 'General case' 0 N--CA 1.451 -0.421 0 O-C-N 121.872 -0.517 . . . . 0.0 111.472 174.767 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 57.6 mttm -79.1 44.9 0.59 Allowed 'General case' 0 CA--C 1.537 0.46 0 C-N-CA 123.87 0.868 . . . . 0.0 111.929 -172.517 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 33.2 tt0 -170.72 -51.17 0.02 OUTLIER 'General case' 0 N--CA 1.456 -0.171 0 C-N-CA 125.759 1.624 . . . . 0.0 108.076 178.001 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 176.24 -90.49 0.08 OUTLIER Glycine 0 CA--C 1.523 0.535 0 N-CA-C 111.451 -0.659 . . . . 0.0 111.451 173.722 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 26.5 t0 -66.13 112.72 9.78 Favored Pre-proline 0 CA--C 1.535 0.403 0 CA-C-O 118.485 -0.769 . . . . 0.0 110.71 -170.33 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 20' ' ' PRO . . . . . . . . . . . . . 22.9 Cg_endo -58.83 -16.49 31.81 Favored 'Trans proline' 0 CA--C 1.536 0.593 0 C-N-CA 122.472 2.115 . . . . 0.0 113.35 179.869 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 41.9 m-80 -94.05 3.28 55.55 Favored 'General case' 0 CA--C 1.533 0.315 0 C-N-CA 125.303 1.441 . . . . 0.0 113.205 -178.487 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 51.0 tt0 -139.59 124.12 18.25 Favored 'General case' 0 CA--C 1.539 0.555 0 CA-C-N 119.109 0.868 . . . . 0.0 112.134 -176.891 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 60.4 mt -100.16 136.55 39.89 Favored 'General case' 0 C--N 1.343 0.311 0 C-N-CA 123.908 0.883 . . . . 0.0 110.667 175.768 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 99.0 p -88.07 175.44 7.74 Favored 'General case' 0 CA--C 1.535 0.371 0 C-N-CA 123.75 0.82 . . . . 0.0 108.956 167.107 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 98.7 mttt -56.28 -46.17 79.85 Favored 'General case' 0 C--O 1.226 -0.148 0 O-C-N 121.968 -0.457 . . . . 0.0 111.288 179.556 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 29.0 tp10 -64.74 -45.14 87.76 Favored 'General case' 0 N--CA 1.455 -0.177 0 CA-C-O 121.034 0.445 . . . . 0.0 110.719 -177.312 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 58.8 mt-10 -56.88 -47.59 80.12 Favored 'General case' 0 N--CA 1.451 -0.42 0 N-CA-C 109.725 -0.472 . . . . 0.0 109.725 176.069 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 16.1 mt -55.86 -43.85 77.51 Favored 'General case' 0 CA--C 1.513 -0.474 0 N-CA-C 112.783 0.66 . . . . 0.0 112.783 170.994 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 63.3 tttp -59.09 -52.27 66.45 Favored 'General case' 0 C--N 1.323 -0.563 0 CA-C-N 118.839 0.745 . . . . 0.0 109.624 -177.145 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 81.2 mt -58.72 -48.97 79.32 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 115.816 -0.629 . . . . 0.0 110.748 178.866 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 9.6 tt -50.64 -55.12 17.86 Favored 'General case' 0 C--O 1.233 0.216 0 C-N-CA 124.007 0.923 . . . . 0.0 110.17 175.914 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 38.3 mt -56.81 -56.85 16.3 Favored 'General case' 0 N--CA 1.456 -0.174 0 C-N-CA 124.061 0.944 . . . . 0.0 110.086 -178.601 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -57.93 -50.37 73.59 Favored 'General case' 0 N--CA 1.455 -0.217 0 C-N-CA 122.552 0.341 . . . . 0.0 110.635 -175.568 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 9.1 m -65.11 -52.49 55.09 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.477 -0.329 . . . . 0.0 111.232 -175.036 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 76.1 mm-40 -103.58 -24.44 13.4 Favored 'General case' 0 N--CA 1.452 -0.348 0 N-CA-C 114.906 1.447 . . . . 0.0 114.906 -165.361 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 46.5 m-85 -135.77 67.29 64.49 Favored Pre-proline 0 C--O 1.235 0.332 0 CA-C-N 119.263 0.938 . . . . 0.0 112.624 -171.795 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 65.5 Cg_endo -62.67 -21.41 72.92 Favored 'Trans proline' 0 N--CA 1.453 -0.866 0 C-N-CA 122.174 1.916 . . . . 0.0 110.243 169.123 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 4.5 p -55.79 -67.74 0.26 Allowed 'General case' 0 N--CA 1.447 -0.587 0 C-N-CA 125.371 1.468 . . . . 0.0 109.134 169.908 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 65.3 mt -47.59 -45.69 27.57 Favored 'General case' 0 C--O 1.231 0.131 0 C-N-CA 123.512 0.725 . . . . 0.0 110.939 176.579 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 23.7 tp -53.48 -26.28 19.87 Favored 'General case' 0 CA--C 1.536 0.423 0 N-CA-C 113.142 0.793 . . . . 0.0 113.142 -177.409 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 62.8 mtpt -49.33 -36.58 21.67 Favored 'General case' 0 CA--C 1.531 0.228 0 CA-C-N 119.004 0.82 . . . . 0.0 112.299 173.129 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . -48.57 -31.73 9.85 Favored Glycine 0 CA--C 1.533 1.157 0 C-N-CA 124.347 0.975 . . . . 0.0 112.73 175.033 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 43' ' ' GLY . . . . . . . . . . . . . . . 61.3 -91.41 0.06 OUTLIER Glycine 0 CA--C 1.525 0.666 0 C-N-CA 124.376 0.988 . . . . 0.0 111.552 172.479 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 44' ' ' SER . . . . . . . . . . . . . 23.5 m 35.51 -111.22 0.06 Allowed 'General case' 0 N--CA 1.45 -0.446 0 C-N-CA 126.632 1.973 . . . . 0.0 110.51 -179.801 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 69.5 p -145.98 152.16 38.94 Favored 'General case' 0 N--CA 1.45 -0.456 0 N-CA-C 106.051 -1.833 . . . . 0.0 106.051 166.381 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 18.5 mt -55.62 -41.16 73.08 Favored 'General case' 0 N--CA 1.451 -0.394 0 N-CA-C 108.152 -1.055 . . . . 0.0 108.152 171.141 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 5.5 m-20 -54.99 -56.38 20.4 Favored 'General case' 0 N--CA 1.451 -0.424 0 C-N-CA 124.527 1.131 . . . . 0.0 111.633 177.425 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 32.5 mt-10 -55.15 -48.1 74.2 Favored 'General case' 0 C--N 1.334 -0.089 0 C-N-CA 122.097 0.159 . . . . 0.0 110.706 176.377 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 55.9 tp -57.66 -47.6 81.83 Favored 'General case' 0 CA--C 1.532 0.263 0 CA-C-O 121.385 0.612 . . . . 0.0 110.47 179.649 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 50' ' ' PHE . . . . . . . . . . . . . 50.0 t80 -57.04 -48.93 77.34 Favored 'General case' 0 N--CA 1.452 -0.368 0 C-N-CA 124.467 1.107 . . . . 0.0 109.864 -179.874 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 33.9 tt0 -61.76 -40.44 95.17 Favored 'General case' 0 N--CA 1.453 -0.284 0 C-N-CA 122.788 0.435 . . . . 0.0 111.16 177.93 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 70.2 tt0 -59.0 -46.51 87.98 Favored 'General case' 0 C--N 1.331 -0.203 0 C-N-CA 123.092 0.557 . . . . 0.0 110.422 176.384 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 84.4 mt -66.38 -56.29 11.77 Favored 'General case' 0 N--CA 1.452 -0.345 0 C-N-CA 123.465 0.706 . . . . 0.0 111.133 -179.52 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 14.2 t0 -103.68 101.25 11.09 Favored 'General case' 0 N--CA 1.453 -0.307 0 C-N-CA 124.376 1.07 . . . . 0.0 108.985 -176.367 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 25.2 mmmt -74.52 75.24 1.96 Allowed 'General case' 0 N--CA 1.453 -0.325 0 CA-C-O 122.38 1.086 . . . . 0.0 111.26 178.643 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 56' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER 37.91 41.19 0.33 Allowed 'General case' 0 C--N 1.323 -0.585 0 C-N-CA 129.56 3.144 . . . . 0.0 114.109 -176.622 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . -79.48 -80.63 0.77 Allowed Glycine 0 CA--C 1.526 0.719 0 N-CA-C 110.418 -1.073 . . . . 0.0 110.418 -177.003 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 35.2 p-10 -97.22 -30.57 12.91 Favored 'General case' 0 CA--C 1.533 0.326 0 C-N-CA 124.688 1.195 . . . . 0.0 111.448 -178.757 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . 93.94 25.29 17.71 Favored Glycine 0 CA--C 1.53 0.977 0 C-N-CA 124.146 0.879 . . . . 0.0 111.242 -174.267 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 42.6 mp0 -149.83 179.18 8.24 Favored 'General case' 0 N--CA 1.457 -0.098 0 C-N-CA 127.024 2.13 . . . . 0.0 105.94 175.569 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 61' ' ' VAL . . . . . . . . . . . . . 39.9 t -118.28 103.79 15.19 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.241 0 N-CA-C 109.136 -0.69 . . . . 0.0 109.136 176.678 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 18.6 t -79.2 167.37 21.07 Favored 'General case' 0 CA--C 1.532 0.282 0 C-N-CA 123.01 0.524 . . . . 0.0 111.345 172.335 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 63' ' ' PHE . . . . . . . . . . . . . 63.1 t80 -60.41 -34.8 74.47 Favored 'General case' 0 CA--C 1.53 0.211 0 C-N-CA 123.204 0.602 . . . . 0.0 112.518 -172.733 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 7.6 tm-20 -64.17 -61.77 2.05 Favored 'General case' 0 CA--C 1.533 0.327 0 N-CA-C 109.476 -0.565 . . . . 0.0 109.476 178.11 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 14.7 pt-20 -59.86 -33.44 71.81 Favored 'General case' 0 CA--C 1.537 0.463 0 O-C-N 121.62 -0.675 . . . . 0.0 111.741 -179.472 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 19.6 t80 -53.03 -25.76 13.48 Favored 'General case' 0 CA--C 1.536 0.415 0 C-N-CA 123.902 0.881 . . . . 0.0 112.897 169.668 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 67' ' ' GLN . . . . . . . . . . . . . 73.2 mm-40 -55.81 -24.75 37.92 Favored 'General case' 0 CA--C 1.538 0.492 0 O-C-N 120.785 -1.197 . . . . 0.0 112.435 171.795 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 74.0 t -61.01 -33.98 58.02 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.547 0 O-C-N 121.086 -1.009 . . . . 0.0 110.339 170.467 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 14.1 tp -73.07 -39.82 65.55 Favored 'General case' 0 C--O 1.225 -0.223 0 O-C-N 120.885 -1.134 . . . . 0.0 108.15 176.494 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 70' ' ' VAL . . . . . . . . . . . . . 40.9 t -58.15 -39.6 73.75 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.544 0 O-C-N 121.939 -0.475 . . . . 0.0 110.54 173.159 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 75.1 tttt -55.75 -51.09 68.57 Favored 'General case' 0 N--CA 1.455 -0.184 0 O-C-N 121.601 -0.687 . . . . 0.0 110.67 170.734 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 4.8 mptp? -52.65 -48.29 66.54 Favored 'General case' 0 CA--C 1.536 0.436 0 CA-C-N 118.281 0.491 . . . . 0.0 112.141 173.316 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 73' ' ' ILE . . . . . . . . . . . . . 95.9 mt -53.74 -40.99 45.66 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.563 0 N-CA-C 109.271 -0.64 . . . . 0.0 109.271 175.852 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 74' ' ' SER . . . . . 0.646 ' O ' ' OXT' ' A' ' 75' ' ' GLN . 4.9 m -86.97 20.35 2.68 Favored 'General case' 0 CA--C 1.537 0.468 0 C-N-CA 124.741 1.216 . . . . 0.0 112.184 177.613 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 75' ' ' GLN . . . . . 0.646 ' OXT' ' O ' ' A' ' 74' ' ' SER . 3.5 mp0 . . . . . 0 C--O 1.27 2.158 0 C-N-CA 125.637 1.575 . . . . 0.0 110.861 -175.598 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 1' ' ' LYS . . . . . . . . . . . . . 74.5 mmtt . . . . . 0 N--CA 1.454 -0.251 0 N-CA-C 108.986 -0.746 . . . . 0.0 108.986 . . . . . . . . . 0 0 . 1 . 013 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 81.2 p -67.51 153.9 94.1 Favored Pre-proline 0 N--CA 1.452 -0.33 0 O-C-N 121.849 -0.532 . . . . 0.0 109.754 -177.261 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 82.2 Cg_exo -46.39 -41.81 22.77 Favored 'Trans proline' 0 N--CA 1.456 -0.726 0 C-N-CA 122.665 2.244 . . . . 0.0 111.621 169.146 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 3.1 mp0 -59.39 -50.83 72.43 Favored 'General case' 0 N--CA 1.454 -0.229 0 C-N-CA 123.817 0.847 . . . . 0.0 112.154 176.236 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 15.3 tp10 -57.96 -46.89 84.4 Favored 'General case' 0 N--CA 1.454 -0.239 0 N-CA-C 108.211 -1.033 . . . . 0.0 108.211 178.502 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 25.8 mt -59.59 -37.83 79.6 Favored 'General case' 0 N--CA 1.445 -0.712 0 C-N-CA 124.216 1.007 . . . . 0.0 111.831 179.266 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 1.2 tmtm? -61.86 -48.0 82.51 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 118.843 0.747 . . . . 0.0 109.949 171.94 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . -54.77 -54.67 31.76 Favored Glycine 0 CA--C 1.528 0.867 0 N-CA-C 110.49 -1.044 . . . . 0.0 110.49 178.758 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 9' ' ' ILE . . . . . . . . . . . . . 72.9 mt -50.98 -54.26 11.1 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.184 0 C-N-CA 125.278 1.431 . . . . 0.0 109.967 172.781 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 10' ' ' PHE . . . . . . . . . . . . . 29.5 t80 -51.97 -49.79 62.54 Favored 'General case' 0 N--CA 1.447 -0.609 0 O-C-N 121.715 -0.616 . . . . 0.0 109.719 -176.863 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 54.8 mt-10 -61.85 -53.05 61.18 Favored 'General case' 0 N--CA 1.457 -0.082 0 N-CA-C 110.292 -0.262 . . . . 0.0 110.292 178.847 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 48.9 tttp -44.24 -53.71 6.36 Favored 'General case' 0 C--O 1.227 -0.124 0 C-N-CA 124.52 1.128 . . . . 0.0 110.586 178.064 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 41.8 m-85 -77.4 -41.28 40.63 Favored 'General case' 0 N--CA 1.454 -0.273 0 CA-C-O 119.629 -0.224 . . . . 0.0 111.491 -173.909 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -58.7 -58.73 7.29 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-O 120.848 0.356 . . . . 0.0 110.847 179.036 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -51.06 -32.1 20.92 Favored 'General case' 0 CA--C 1.531 0.222 0 C-N-CA 125.121 1.368 . . . . 0.0 113.111 -169.941 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 94.1 mttt -56.85 -31.69 65.04 Favored 'General case' 0 CA--C 1.533 0.312 0 C-N-CA 123.218 0.607 . . . . 0.0 112.6 -179.604 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 31.0 tt0 -139.94 -42.44 0.43 Allowed 'General case' 0 CA--C 1.532 0.271 0 N-CA-C 112.453 0.538 . . . . 0.0 112.453 -168.68 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . -111.32 179.32 19.83 Favored Glycine 0 CA--C 1.523 0.593 0 C-N-CA 124.585 1.088 . . . . 0.0 111.131 -173.027 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 9.8 t70 -61.03 134.03 92.77 Favored Pre-proline 0 CA--C 1.533 0.324 0 N-CA-C 108.09 -1.078 . . . . 0.0 108.09 173.506 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 20' ' ' PRO . . . . . . . . . . . . . 12.9 Cg_endo -52.77 -24.61 24.09 Favored 'Trans proline' 0 CA--C 1.537 0.657 0 C-N-CA 122.931 2.421 . . . . 0.0 114.145 -175.809 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 44.1 m-80 -88.38 -5.67 58.16 Favored 'General case' 0 CA--C 1.535 0.381 0 C-N-CA 124.912 1.285 . . . . 0.0 113.186 -177.214 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 37.4 tt0 -148.64 119.57 7.64 Favored 'General case' 0 CA--C 1.539 0.556 0 CA-C-N 118.797 0.726 . . . . 0.0 112.82 -169.446 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 69.5 mt -88.98 133.91 34.16 Favored 'General case' 0 C--N 1.343 0.312 0 C-N-CA 124.139 0.976 . . . . 0.0 112.544 -175.529 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 27.9 p -77.83 171.71 14.56 Favored 'General case' 0 C--O 1.235 0.29 0 C-N-CA 123.626 0.77 . . . . 0.0 109.457 168.268 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 97.8 mttt -57.99 -46.76 84.67 Favored 'General case' 0 N--CA 1.454 -0.237 0 N-CA-C 110.156 -0.313 . . . . 0.0 110.156 174.245 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 27.4 tp10 -65.08 -44.45 88.86 Favored 'General case' 0 N--CA 1.453 -0.283 0 CA-C-O 120.89 0.376 . . . . 0.0 110.34 -176.895 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 21.1 mt-10 -56.1 -49.51 73.64 Favored 'General case' 0 CA--C 1.536 0.433 0 N-CA-C 109.443 -0.577 . . . . 0.0 109.443 175.289 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 10.2 mt -55.75 -41.88 74.62 Favored 'General case' 0 CA--C 1.514 -0.405 0 N-CA-C 113.324 0.861 . . . . 0.0 113.324 171.661 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 89.1 tttt -59.81 -53.29 59.65 Favored 'General case' 0 C--N 1.323 -0.566 0 CA-C-N 118.737 0.699 . . . . 0.0 109.8 -178.637 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 82.9 mt -58.27 -46.78 85.39 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.968 178.875 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 6.4 tt -51.15 -57.65 8.19 Favored 'General case' 0 C--N 1.332 -0.156 0 C-N-CA 123.836 0.854 . . . . 0.0 109.9 175.415 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 40.0 mt -54.73 -55.13 33.21 Favored 'General case' 0 C--N 1.331 -0.196 0 C-N-CA 124.27 1.028 . . . . 0.0 109.724 -178.433 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 24.2 mt-30 -53.13 -50.95 63.46 Favored 'General case' 0 N--CA 1.454 -0.245 0 C-N-CA 123.484 0.714 . . . . 0.0 111.343 -177.556 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 1.6 m -73.54 -51.15 17.99 Favored 'General case' 0 CA--C 1.532 0.264 0 C-N-CA 120.174 -0.61 . . . . 0.0 111.322 -173.898 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 45.0 mm-40 -94.4 -29.62 14.89 Favored 'General case' 0 N--CA 1.449 -0.5 0 N-CA-C 113.622 0.971 . . . . 0.0 113.622 -166.123 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 75.4 m-85 -136.84 66.51 55.69 Favored Pre-proline 0 CA--C 1.534 0.365 0 N-CA-C 113.053 0.76 . . . . 0.0 113.053 -173.249 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 87.7 Cg_exo -49.19 -31.39 21.72 Favored 'Trans proline' 0 N--CA 1.458 -0.582 0 C-N-CA 122.955 2.437 . . . . 0.0 112.492 168.238 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 3.3 p -56.0 -60.54 3.33 Favored 'General case' 0 N--CA 1.45 -0.434 0 C-N-CA 125.166 1.386 . . . . 0.0 109.457 175.836 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 85.4 mt -57.34 -41.19 79.56 Favored 'General case' 0 N--CA 1.453 -0.323 0 CA-C-N 115.477 -0.783 . . . . 0.0 110.914 176.391 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 11.8 tp -57.07 -47.2 81.59 Favored 'General case' 0 CA--C 1.533 0.308 0 CA-C-O 120.825 0.345 . . . . 0.0 111.199 178.769 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 93.7 mttt -66.76 -38.68 87.08 Favored 'General case' 0 N--CA 1.455 -0.196 0 C-N-CA 124.052 0.941 . . . . 0.0 110.983 176.426 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . -36.79 118.4 0.49 Allowed Glycine 0 CA--C 1.53 0.986 0 C-N-CA 125.789 1.661 . . . . 0.0 111.998 175.324 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 43' ' ' GLY . . . . . . . . . . . . . . . -68.03 73.91 0.27 Allowed Glycine 0 CA--C 1.529 0.952 0 C-N-CA 124.274 0.94 . . . . 0.0 113.46 -170.718 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 44' ' ' SER . . . . . . . . . . . . . 17.2 m -158.64 142.57 15.41 Favored 'General case' 0 N--CA 1.443 -0.799 0 C-N-CA 126.654 1.982 . . . . 0.0 106.063 169.954 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 47.5 p -70.44 160.89 31.53 Favored 'General case' 0 N--CA 1.453 -0.282 0 CA-C-O 121.436 0.636 . . . . 0.0 109.7 -179.553 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 46' ' ' LEU . . . . . 0.408 ' HG ' ' H ' ' A' ' 46' ' ' LEU . 18.8 mt -55.35 -43.97 75.52 Favored 'General case' 0 N--CA 1.451 -0.375 0 N-CA-C 108.275 -1.009 . . . . 0.0 108.275 172.72 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 5.7 m-20 -58.38 -49.07 78.57 Favored 'General case' 0 N--CA 1.447 -0.595 0 CA-C-N 115.006 -0.997 . . . . 0.0 111.39 178.503 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 51.0 mt-10 -57.9 -50.64 72.65 Favored 'General case' 0 C--N 1.333 -0.125 0 CA-C-N 117.379 0.081 . . . . 0.0 110.931 175.962 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 81.6 mt -57.64 -48.34 79.73 Favored 'General case' 0 CA--C 1.531 0.22 0 CA-C-O 121.376 0.608 . . . . 0.0 109.926 -179.936 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 50' ' ' PHE . . . . . . . . . . . . . 54.6 t80 -55.03 -53.29 57.75 Favored 'General case' 0 N--CA 1.45 -0.466 0 C-N-CA 123.882 0.873 . . . . 0.0 109.879 178.965 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 42.8 tt0 -57.51 -45.74 84.62 Favored 'General case' 0 N--CA 1.454 -0.264 0 C-N-CA 122.895 0.478 . . . . 0.0 110.771 179.503 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 8.5 tm-20 -55.99 -45.97 78.83 Favored 'General case' 0 N--CA 1.454 -0.264 0 C-N-CA 122.998 0.519 . . . . 0.0 110.308 179.433 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 95.8 mt -78.25 -38.21 43.38 Favored 'General case' 0 CA--C 1.533 0.299 0 N-CA-C 112.592 0.59 . . . . 0.0 112.592 -175.364 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 27.5 t0 -67.41 72.83 0.13 Allowed 'General case' 0 C--N 1.33 -0.274 0 C-N-CA 126.876 2.07 . . . . 0.0 109.674 177.607 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 28.4 mmmt -57.3 99.77 0.04 OUTLIER 'General case' 0 N--CA 1.454 -0.268 0 CA-C-O 121.282 0.563 . . . . 0.0 112.292 -169.072 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 56' ' ' ASN . . . . . . . . . . . . 0.25 0.0 OUTLIER 95.75 5.32 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.304 0 C-N-CA 128.83 2.852 . . . . 0.0 112.609 171.556 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . 79.09 53.08 4.61 Favored Glycine 0 CA--C 1.525 0.705 0 N-CA-C 110.94 -0.864 . . . . 0.0 110.94 177.706 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 3.2 p30 -77.16 -48.28 18.08 Favored 'General case' 0 N--CA 1.451 -0.385 0 N-CA-C 108.139 -1.059 . . . . 0.0 108.139 170.947 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . 159.35 -86.65 0.12 Allowed Glycine 0 C--O 1.223 -0.591 0 N-CA-C 108.57 -1.812 . . . . 0.0 108.57 168.061 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 62.4 mt-10 -97.8 150.03 21.7 Favored 'General case' 0 C--N 1.326 -0.45 0 C-N-CA 123.767 0.827 . . . . 0.0 108.906 -172.022 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 61' ' ' VAL . . . . . . . . . . . . . 2.8 t -83.87 109.77 17.76 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.203 0 O-C-N 122.221 -0.3 . . . . 0.0 111.585 -165.814 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 1.7 m -77.78 153.47 32.82 Favored 'General case' 0 CA--C 1.534 0.352 0 C-N-CA 124.123 0.969 . . . . 0.0 110.741 -177.586 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 63' ' ' PHE . . . . . . . . . . . . . 69.1 t80 -55.31 -38.69 69.0 Favored 'General case' 0 N--CA 1.468 0.472 0 N-CA-C 113.072 0.767 . . . . 0.0 113.072 -174.336 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 12.5 tp10 -61.92 -59.92 4.4 Favored 'General case' 0 CA--C 1.534 0.33 0 O-C-N 121.994 -0.441 . . . . 0.0 110.012 179.865 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 16.6 pt-20 -59.35 -36.19 75.25 Favored 'General case' 0 CA--C 1.535 0.388 0 O-C-N 121.394 -0.816 . . . . 0.0 111.798 179.739 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 23.7 t80 -51.94 -26.24 9.97 Favored 'General case' 0 CA--C 1.54 0.578 0 C-N-CA 123.788 0.835 . . . . 0.0 112.408 171.682 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 67' ' ' GLN . . . . . . . . . . . . . 36.2 mm-40 -53.23 -27.84 24.12 Favored 'General case' 0 CA--C 1.54 0.567 0 O-C-N 120.985 -1.072 . . . . 0.0 113.117 172.625 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 85.8 t -56.22 -30.58 30.21 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.436 0 C-N-CA 122.966 0.506 . . . . 0.0 110.967 173.206 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 16.8 tp -78.17 -51.32 10.4 Favored 'General case' 0 N--CA 1.455 -0.178 0 N-CA-C 109.221 -0.659 . . . . 0.0 109.221 170.664 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 70' ' ' VAL . . . . . . . . . . . . . 84.4 t -47.91 -43.92 10.91 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.22 0 C-N-CA 122.88 0.472 . . . . 0.0 111.591 -175.695 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 54.0 pttt -59.91 -41.35 91.51 Favored 'General case' 0 CA--C 1.533 0.317 0 C-N-CA 120.281 -0.567 . . . . 0.0 112.388 179.732 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 5.6 mptp? -60.55 -45.42 93.95 Favored 'General case' 0 CA--C 1.529 0.172 0 N-CA-C 110.309 -0.256 . . . . 0.0 110.309 172.56 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 73' ' ' ILE . . . . . . . . . . . . . 55.4 mt -61.04 -54.2 38.63 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.216 0 CA-C-O 120.751 0.31 . . . . 0.0 110.889 -177.781 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 55.5 m -160.76 57.05 0.32 Allowed 'General case' 0 CA--C 1.532 0.269 0 C-N-CA 123.758 0.823 . . . . 0.0 110.898 -172.431 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 75' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.27 2.141 0 C-N-CA 125.977 1.711 . . . . 0.0 113.82 170.999 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 1' ' ' LYS . . . . . . . . . . . . . 72.3 mmtt . . . . . 0 N--CA 1.45 -0.457 0 N-CA-C 108.44 -0.948 . . . . 0.0 108.44 . . . . . . . . . 0 0 . 1 . 014 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 90.5 p -80.24 152.64 73.81 Favored Pre-proline 0 N--CA 1.453 -0.3 0 N-CA-C 108.821 -0.807 . . . . 0.0 108.821 174.283 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 83.9 Cg_exo -47.14 -38.01 24.33 Favored 'Trans proline' 0 N--CA 1.456 -0.692 0 C-N-CA 122.72 2.28 . . . . 0.0 112.322 169.782 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 3.1 mp0 -62.54 -48.66 78.52 Favored 'General case' 0 CA--C 1.53 0.202 0 C-N-CA 123.793 0.837 . . . . 0.0 111.917 175.966 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 9.6 tm-20 -60.33 -44.47 95.46 Favored 'General case' 0 CA--C 1.53 0.206 0 N-CA-C 108.739 -0.837 . . . . 0.0 108.739 178.074 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 6' ' ' LEU . . . . . 0.421 HD13 HG22 ' A' ' 70' ' ' VAL . 14.5 mt -60.98 -37.18 81.56 Favored 'General case' 0 N--CA 1.447 -0.6 0 C-N-CA 123.614 0.766 . . . . 0.0 112.568 175.803 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 54.5 tptt -59.24 -47.45 85.29 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 119.232 0.924 . . . . 0.0 109.724 169.752 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . -51.18 -54.21 24.27 Favored Glycine 0 CA--C 1.531 1.072 0 N-CA-C 110.696 -0.962 . . . . 0.0 110.696 176.793 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 9' ' ' ILE . . . . . . . . . . . . . 4.2 mm -54.56 -56.12 11.85 Favored 'Isoleucine or valine' 0 CA--C 1.529 0.166 0 C-N-CA 125.063 1.345 . . . . 0.0 109.321 175.99 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 10' ' ' PHE . . . . . . . . . . . . . 23.2 t80 -49.56 -49.33 46.75 Favored 'General case' 0 N--CA 1.444 -0.753 0 C-N-CA 123.612 0.765 . . . . 0.0 109.772 -178.65 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 52.1 mt-10 -63.35 -48.77 76.55 Favored 'General case' 0 N--CA 1.453 -0.288 0 C-N-CA 123.504 0.722 . . . . 0.0 110.613 179.638 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 64.6 tttt -44.39 -51.84 8.25 Favored 'General case' 0 CA--C 1.53 0.21 0 C-N-CA 123.893 0.877 . . . . 0.0 110.756 176.592 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 83.0 m-85 -80.68 -38.54 28.81 Favored 'General case' 0 CA--C 1.533 0.295 0 N-CA-C 112.379 0.511 . . . . 0.0 112.379 -176.723 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -69.05 -52.63 26.52 Favored 'General case' 0 C--N 1.333 -0.147 0 C-N-CA 123.552 0.741 . . . . 0.0 111.757 -176.908 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -55.46 -20.52 12.86 Favored 'General case' 0 C--N 1.332 -0.188 0 C-N-CA 124.124 0.97 . . . . 0.0 112.255 -178.57 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 38.8 ttmt -56.57 -30.29 62.98 Favored 'General case' 0 N--CA 1.449 -0.52 0 C-N-CA 123.713 0.805 . . . . 0.0 111.372 179.349 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 9.8 tp10 -155.29 -45.76 0.08 Allowed 'General case' 0 C--N 1.341 0.229 0 CA-C-N 118.201 0.455 . . . . 0.0 111.501 177.575 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . -74.35 175.88 48.29 Favored Glycine 0 CA--C 1.527 0.84 0 CA-C-O 121.787 0.66 . . . . 0.0 111.522 179.315 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 10.1 t70 -63.31 139.92 97.64 Favored Pre-proline 0 CA--C 1.533 0.299 0 N-CA-C 107.289 -1.375 . . . . 0.0 107.289 169.519 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 20' ' ' PRO . . . . . . . . . . . . . 11.1 Cg_endo -50.68 -23.67 11.6 Favored 'Trans proline' 0 CA--C 1.537 0.649 0 C-N-CA 122.859 2.373 . . . . 0.0 114.538 -179.143 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 49.2 m-80 -96.56 -1.17 47.6 Favored 'General case' 0 CA--C 1.533 0.3 0 C-N-CA 124.956 1.302 . . . . 0.0 113.314 -177.743 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 30.7 tt0 -141.51 116.98 10.21 Favored 'General case' 0 CA--C 1.538 0.514 0 C-N-CA 123.869 0.868 . . . . 0.0 112.579 -176.712 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 46.9 mt -90.56 136.74 32.87 Favored 'General case' 0 C--N 1.342 0.26 0 C-N-CA 124.564 1.145 . . . . 0.0 110.857 179.875 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 98.0 p -78.5 168.05 20.37 Favored 'General case' 0 CA--C 1.532 0.273 0 N-CA-C 108.572 -0.899 . . . . 0.0 108.572 167.133 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 1.1 ttmp? -59.11 -38.12 78.8 Favored 'General case' 0 CA--C 1.535 0.395 0 O-C-N 122.017 -0.427 . . . . 0.0 110.739 177.985 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 26.9 mt-10 -68.24 -47.49 67.64 Favored 'General case' 0 N--CA 1.454 -0.23 0 CA-C-O 121.162 0.506 . . . . 0.0 110.516 -179.576 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 60.2 mt-10 -58.06 -43.94 87.22 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.027 -0.533 . . . . 0.0 109.814 176.183 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 12.3 mt -54.59 -47.37 73.42 Favored 'General case' 0 CA--C 1.507 -0.676 0 CA-C-N 118.387 0.54 . . . . 0.0 112.233 169.608 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 61.9 tttp -58.83 -47.59 84.31 Favored 'General case' 0 C--N 1.324 -0.531 0 CA-C-N 118.706 0.684 . . . . 0.0 109.876 -177.353 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 90.5 mt -59.75 -49.06 79.21 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.532 -0.304 . . . . 0.0 111.686 177.286 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 6.9 tt -50.62 -58.28 6.21 Favored 'General case' 0 N--CA 1.456 -0.148 0 C-N-CA 124.204 1.002 . . . . 0.0 109.327 175.545 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 42.8 mt -57.98 -52.35 65.87 Favored 'General case' 0 N--CA 1.451 -0.39 0 C-N-CA 123.86 0.864 . . . . 0.0 109.079 -176.291 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 23.6 tt0 -53.85 -51.03 64.92 Favored 'General case' 0 N--CA 1.453 -0.287 0 C-N-CA 123.639 0.776 . . . . 0.0 111.075 -178.204 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 11.4 m -75.65 -45.36 37.6 Favored 'General case' 0 N--CA 1.451 -0.381 0 CA-C-N 115.992 -0.549 . . . . 0.0 110.958 -171.583 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 74.0 mm-40 -94.57 -34.97 12.44 Favored 'General case' 0 N--CA 1.452 -0.357 0 C-N-CA 123.797 0.839 . . . . 0.0 112.406 -169.355 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 73.9 m-85 -144.88 68.27 14.14 Favored Pre-proline 0 CA--C 1.541 0.606 0 C-N-CA 123.832 0.853 . . . . 0.0 113.108 -169.875 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 85.6 Cg_exo -44.7 -36.48 10.5 Favored 'Trans proline' 0 CA--C 1.536 0.618 0 C-N-CA 123.431 2.754 . . . . 0.0 113.359 172.143 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -55.52 -43.1 75.4 Favored 'General case' 0 N--CA 1.45 -0.463 0 C-N-CA 125.568 1.547 . . . . 0.0 109.83 179.813 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 96.2 mt -84.72 -32.28 23.6 Favored 'General case' 0 N--CA 1.446 -0.671 0 C-N-CA 125.053 1.341 . . . . 0.0 110.498 -177.074 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 15.9 tp -54.04 -50.09 67.49 Favored 'General case' 0 N--CA 1.462 0.162 0 N-CA-C 109.387 -0.598 . . . . 0.0 109.387 171.364 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 8.2 mtmp? -64.68 -61.22 2.33 Favored 'General case' 0 N--CA 1.449 -0.499 0 N-CA-C 109.348 -0.612 . . . . 0.0 109.348 172.697 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . 70.51 -67.47 0.75 Allowed Glycine 0 CA--C 1.529 0.914 0 C-N-CA 125.02 1.295 . . . . 0.0 113.762 169.406 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 43' ' ' GLY . . . . . . . . . . . . . . . 135.29 -66.39 0.56 Allowed Glycine 0 CA--C 1.522 0.503 0 N-CA-C 106.164 -2.775 . . . . 0.0 106.164 -169.656 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 44' ' ' SER . . . . . . . . . . . . . 19.7 m -59.66 145.58 44.25 Favored 'General case' 0 N--CA 1.45 -0.442 0 N-CA-C 108.716 -0.846 . . . . 0.0 108.716 167.884 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 75.3 p -60.13 161.26 7.12 Favored 'General case' 0 CA--C 1.531 0.236 0 N-CA-C 109.209 -0.663 . . . . 0.0 109.209 169.406 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 57.4 tp -51.01 -44.39 60.97 Favored 'General case' 0 CA--C 1.528 0.118 0 CA-C-O 120.984 0.421 . . . . 0.0 110.709 172.08 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 4.8 m-20 -59.59 -54.04 51.15 Favored 'General case' 0 N--CA 1.45 -0.459 0 C-N-CA 123.905 0.882 . . . . 0.0 110.932 179.252 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 37.0 mt-10 -55.13 -48.52 73.55 Favored 'General case' 0 C--N 1.332 -0.191 0 CA-C-N 116.492 -0.322 . . . . 0.0 110.547 176.262 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 54.9 tp -56.39 -49.79 73.47 Favored 'General case' 0 C--N 1.331 -0.206 0 C-N-CA 123.035 0.534 . . . . 0.0 109.863 -179.904 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 50' ' ' PHE . . . . . . . . . . . . . 59.9 t80 -51.8 -50.42 60.82 Favored 'General case' 0 N--CA 1.453 -0.305 0 C-N-CA 124.041 0.936 . . . . 0.0 110.3 177.69 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 56.9 mm-40 -59.3 -47.5 85.14 Favored 'General case' 0 CA--C 1.534 0.364 0 CA-C-N 117.923 0.329 . . . . 0.0 111.627 175.373 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 39.8 mt-10 -54.81 -36.92 65.47 Favored 'General case' 0 CA--C 1.529 0.137 0 C-N-CA 123.375 0.67 . . . . 0.0 111.688 178.689 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 53.2 mt -75.21 -57.37 3.94 Favored 'General case' 0 N--CA 1.447 -0.611 0 CA-C-N 117.905 0.32 . . . . 0.0 110.626 174.808 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 33.2 t0 -75.55 59.32 1.11 Allowed 'General case' 0 CA--C 1.536 0.436 0 C-N-CA 124.612 1.165 . . . . 0.0 110.89 -178.947 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 13.5 mmmm -57.57 -37.83 73.82 Favored 'General case' 0 CA--C 1.53 0.199 0 C-N-CA 123.841 0.856 . . . . 0.0 111.465 178.643 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 56' ' ' ASN . . . . . . . . . . . . . 16.4 p-10 -66.12 -16.27 63.81 Favored 'General case' 0 CA--C 1.534 0.329 0 C-N-CA 125.383 1.473 . . . . 0.0 112.565 175.096 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . 64.16 40.86 98.43 Favored Glycine 0 CA--C 1.528 0.876 0 CA-C-N 118.704 0.684 . . . . 0.0 113.138 173.232 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 1.6 p30 -78.41 -15.88 58.2 Favored 'General case' 0 CA--C 1.534 0.363 0 CA-C-N 118.422 1.111 . . . . 0.0 112.249 177.629 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . 99.01 7.45 55.19 Favored Glycine 0 CA--C 1.53 0.994 0 C-N-CA 123.717 0.675 . . . . 0.0 112.805 177.645 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 33.4 mt-10 -154.65 173.99 15.6 Favored 'General case' 0 N--CA 1.454 -0.231 0 C-N-CA 128.311 2.644 . . . . 0.0 105.731 172.264 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 61' ' ' VAL . . . . . . . . . . . . . 25.4 t -109.94 114.63 47.53 Favored 'Isoleucine or valine' 0 N--CA 1.461 0.092 0 N-CA-C 109.419 -0.585 . . . . 0.0 109.419 -179.91 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 2.8 m -78.83 159.21 27.94 Favored 'General case' 0 CA--C 1.535 0.387 0 C-N-CA 123.519 0.728 . . . . 0.0 110.85 176.548 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 63' ' ' PHE . . . . . . . . . . . . . 73.8 t80 -59.17 -31.39 68.95 Favored 'General case' 0 CA--C 1.534 0.329 0 O-C-N 121.036 -1.04 . . . . 0.0 113.341 -176.996 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 29.3 mp0 -68.86 -62.95 1.16 Allowed 'General case' 0 N--CA 1.451 -0.403 0 N-CA-C 108.958 -0.756 . . . . 0.0 108.958 -177.595 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 1.5 pt-20 -59.68 -32.86 70.89 Favored 'General case' 0 CA--C 1.538 0.512 0 O-C-N 121.623 -0.673 . . . . 0.0 112.037 178.0 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 18.5 t80 -48.69 -29.84 4.86 Favored 'General case' 0 CA--C 1.537 0.467 0 O-C-N 121.429 -0.795 . . . . 0.0 112.741 169.194 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 67' ' ' GLN . . . . . . . . . . . . . 69.5 mm-40 -54.63 -22.29 13.09 Favored 'General case' 0 CA--C 1.539 0.543 0 CA-C-N 119.557 1.071 . . . . 0.0 112.872 174.685 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 76.2 t -55.49 -35.54 38.22 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.516 0 CA-C-N 119.751 1.159 . . . . 0.0 110.655 171.166 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 24.6 tp -71.95 -45.47 60.97 Favored 'General case' 0 N--CA 1.454 -0.26 0 N-CA-C 107.286 -1.376 . . . . 0.0 107.286 179.129 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 70' ' ' VAL . . . . . 0.421 HG22 HD13 ' A' ' 6' ' ' LEU . 23.4 t -57.02 -40.59 73.85 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.341 0 C-N-CA 123.036 0.535 . . . . 0.0 110.37 178.708 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 37.4 ttmt -56.63 -56.38 22.11 Favored 'General case' 0 N--CA 1.454 -0.243 0 C-N-CA 124.315 1.046 . . . . 0.0 110.273 171.385 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 6.1 mptp? -49.48 -40.19 36.43 Favored 'General case' 0 CA--C 1.536 0.416 0 N-CA-C 112.341 0.497 . . . . 0.0 112.341 174.934 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 73' ' ' ILE . . . . . . . . . . . . . 71.3 mt -62.4 -62.09 1.33 Allowed 'Isoleucine or valine' 0 CA--C 1.531 0.229 0 CA-C-N 118.412 0.551 . . . . 0.0 109.524 173.284 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 74' ' ' SER . . . . . 0.534 ' C ' ' OXT' ' A' ' 75' ' ' GLN . 4.1 m -173.85 -47.82 0.01 OUTLIER 'General case' 0 CA--C 1.533 0.297 0 C-N-CA 125.822 1.649 . . . . 0.0 111.842 -178.232 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 75' ' ' GLN . . . . . 0.534 ' OXT' ' C ' ' A' ' 74' ' ' SER . 19.5 tt0 . . . . . 0 C--O 1.27 2.151 0 C-N-CA 124.739 1.216 . . . . 0.0 111.016 -168.661 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 1' ' ' LYS . . . . . . . . . . . . . 73.7 mmtt . . . . . 0 N--CA 1.452 -0.371 0 N-CA-C 109.647 -0.501 . . . . 0.0 109.647 . . . . . . . . . 0 0 . 1 . 015 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 92.2 p -69.68 157.74 88.81 Favored Pre-proline 0 CA--C 1.532 0.267 0 N-CA-C 108.835 -0.802 . . . . 0.0 108.835 174.131 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 86.7 Cg_exo -48.43 -38.33 34.7 Favored 'Trans proline' 0 N--CA 1.456 -0.68 0 C-N-CA 122.379 2.053 . . . . 0.0 111.982 169.733 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 48.0 mt-10 -61.5 -49.54 76.34 Favored 'General case' 0 N--CA 1.456 -0.149 0 C-N-CA 123.587 0.755 . . . . 0.0 111.114 176.501 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 37.8 mm-40 -59.59 -47.18 86.59 Favored 'General case' 0 C--O 1.225 -0.204 0 N-CA-C 109.044 -0.724 . . . . 0.0 109.044 177.638 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 47.5 mt -58.29 -39.66 79.88 Favored 'General case' 0 N--CA 1.447 -0.589 0 C-N-CA 123.462 0.705 . . . . 0.0 111.802 178.857 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 21.8 tptm -61.62 -49.26 77.3 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 118.626 0.648 . . . . 0.0 110.744 171.673 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . -53.61 -52.17 43.57 Favored Glycine 0 CA--C 1.529 0.932 0 N-CA-C 110.272 -1.131 . . . . 0.0 110.272 -179.666 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 9' ' ' ILE . . . . . . . . . . . . . 80.3 mt -53.37 -56.41 8.49 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.245 0 C-N-CA 126.464 1.906 . . . . 0.0 109.704 172.442 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 10' ' ' PHE . . . . . . . . . . . . . 42.1 t80 -49.34 -49.66 43.24 Favored 'General case' 0 N--CA 1.447 -0.586 0 O-C-N 121.82 -0.55 . . . . 0.0 109.618 -178.144 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 52.4 mt-10 -63.65 -51.45 65.12 Favored 'General case' 0 CA--C 1.532 0.25 0 C-N-CA 123.165 0.586 . . . . 0.0 110.801 179.3 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 43.9 tttp -44.79 -51.23 9.64 Favored 'General case' 0 N--CA 1.461 0.113 0 C-N-CA 125.026 1.33 . . . . 0.0 110.909 177.163 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 57.2 m-85 -78.39 -47.37 17.74 Favored 'General case' 0 N--CA 1.448 -0.525 0 CA-C-N 116.362 -0.381 . . . . 0.0 110.355 -175.664 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -54.89 -38.14 67.19 Favored 'General case' 0 C--N 1.331 -0.204 0 C-N-CA 124.21 1.004 . . . . 0.0 112.418 179.218 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -49.65 -33.7 16.28 Favored 'General case' 0 CA--C 1.533 0.289 0 O-C-N 121.737 -0.602 . . . . 0.0 111.835 174.157 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 89.0 mttt -72.18 -29.62 64.17 Favored 'General case' 0 CA--C 1.535 0.389 0 C-N-CA 122.67 0.388 . . . . 0.0 110.97 -179.881 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 24.8 tt0 -65.4 -47.49 76.12 Favored 'General case' 0 C--N 1.341 0.236 0 N-CA-C 107.234 -1.395 . . . . 0.0 107.234 168.978 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 137.43 -56.21 0.68 Allowed Glycine 0 C--N 1.333 0.385 0 N-CA-C 108.422 -1.871 . . . . 0.0 108.422 178.478 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 35.3 t0 -74.3 110.6 9.87 Favored Pre-proline 0 CA--C 1.534 0.345 0 CA-C-O 118.39 -0.814 . . . . 0.0 108.906 176.079 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 20' ' ' PRO . . . . . . . . . . . . . 32.5 Cg_endo -58.49 -21.11 52.56 Favored 'Trans proline' 0 N--CA 1.458 -0.578 0 C-N-CA 122.279 1.986 . . . . 0.0 112.735 -179.516 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 43.2 m-80 -83.13 -4.51 58.45 Favored 'General case' 0 N--CA 1.451 -0.39 0 C-N-CA 124.35 1.06 . . . . 0.0 112.884 -177.268 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 26.3 tt0 -145.58 132.4 20.09 Favored 'General case' 0 CA--C 1.54 0.561 0 CA-C-N 119.699 1.136 . . . . 0.0 113.182 -168.771 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 84.7 mt -104.06 133.86 48.29 Favored 'General case' 0 C--N 1.342 0.257 0 C-N-CA 125.591 1.557 . . . . 0.0 110.804 176.941 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 82.4 p -79.77 175.63 10.45 Favored 'General case' 0 N--CA 1.452 -0.356 0 C-N-CA 123.76 0.824 . . . . 0.0 109.017 168.481 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 97.8 mttt -55.46 -46.3 76.82 Favored 'General case' 0 N--CA 1.455 -0.189 0 O-C-N 122.059 -0.401 . . . . 0.0 110.023 170.168 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 19.3 tp10 -64.96 -46.79 80.09 Favored 'General case' 0 N--CA 1.451 -0.422 0 CA-C-O 120.7 0.286 . . . . 0.0 110.353 -175.961 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -58.6 -44.08 89.78 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-O 118.806 -0.616 . . . . 0.0 110.45 175.822 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 14.2 mt -56.27 -44.58 79.88 Favored 'General case' 0 CA--C 1.509 -0.6 0 CA-C-N 119.273 0.942 . . . . 0.0 112.539 170.484 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 61.7 tttm -59.96 -49.66 76.81 Favored 'General case' 0 N--CA 1.449 -0.525 0 CA-C-N 118.572 0.624 . . . . 0.0 109.555 -177.849 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 9.2 mp -57.83 -49.64 75.98 Favored 'General case' 0 C--N 1.329 -0.292 0 C-N-CA 122.312 0.245 . . . . 0.0 111.376 177.591 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 7.3 tt -50.23 -57.79 7.04 Favored 'General case' 0 C--N 1.332 -0.166 0 C-N-CA 123.957 0.903 . . . . 0.0 109.552 176.051 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 38.0 mt -59.35 -49.15 78.92 Favored 'General case' 0 C--O 1.222 -0.376 0 C-N-CA 123.513 0.725 . . . . 0.0 109.622 -176.747 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 24.6 tt0 -56.96 -45.84 82.57 Favored 'General case' 0 N--CA 1.452 -0.349 0 C-N-CA 124.222 1.009 . . . . 0.0 110.885 -176.911 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 2.6 m -75.77 -52.34 10.65 Favored 'General case' 0 CA--C 1.533 0.318 0 C-N-CA 120.961 -0.296 . . . . 0.0 110.879 -177.107 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 58.4 mm-40 -90.15 -28.18 19.1 Favored 'General case' 0 N--CA 1.449 -0.483 0 N-CA-C 113.093 0.775 . . . . 0.0 113.093 -166.687 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 76.9 m-85 -145.34 56.91 3.86 Favored Pre-proline 0 CA--C 1.538 0.518 0 C-N-CA 123.965 0.906 . . . . 0.0 112.949 -173.252 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 38.3 Cg_endo -61.08 -34.33 90.04 Favored 'Trans proline' 0 N--CA 1.455 -0.789 0 C-N-CA 122.69 2.26 . . . . 0.0 111.052 -176.891 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 1.4 m -58.76 -39.25 80.44 Favored 'General case' 0 N--CA 1.45 -0.448 0 C-N-CA 124.277 1.031 . . . . 0.0 110.048 -179.142 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 76.9 mt -80.77 -37.96 29.41 Favored 'General case' 0 N--CA 1.451 -0.402 0 C-N-CA 123.95 0.9 . . . . 0.0 110.542 179.437 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 45.6 tp -53.58 -44.3 69.25 Favored 'General case' 0 N--CA 1.461 0.112 0 N-CA-C 110.134 -0.321 . . . . 0.0 110.134 174.474 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 68.9 mttm -70.13 -67.35 0.5 Allowed 'General case' 0 N--CA 1.45 -0.472 0 CA-C-O 121.722 0.773 . . . . 0.0 110.047 172.73 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . -79.74 67.57 3.36 Favored Glycine 0 CA--C 1.524 0.615 0 C-N-CA 124.267 0.937 . . . . 0.0 111.144 -175.456 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 43' ' ' GLY . . . . . . . . . . . . . . . -168.41 175.14 43.14 Favored Glycine 0 CA--C 1.524 0.637 0 N-CA-C 110.815 -0.914 . . . . 0.0 110.815 177.949 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 44' ' ' SER . . . . . . . . . . . . . 1.2 m -57.36 162.27 2.89 Favored 'General case' 0 N--CA 1.453 -0.308 0 C-N-CA 124.477 1.111 . . . . 0.0 110.659 174.062 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 67.0 p -59.79 155.49 16.01 Favored 'General case' 0 CA--C 1.53 0.209 0 C-N-CA 120.023 -0.671 . . . . 0.0 109.798 175.041 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 62.9 tp -49.72 -46.21 50.01 Favored 'General case' 0 N--CA 1.454 -0.247 0 C-N-CA 123.286 0.635 . . . . 0.0 111.078 177.939 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 6.0 m-20 -57.81 -54.75 43.41 Favored 'General case' 0 N--CA 1.451 -0.416 0 C-N-CA 123.792 0.837 . . . . 0.0 111.008 178.279 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 46.0 mt-10 -54.31 -47.77 72.07 Favored 'General case' 0 C--N 1.332 -0.158 0 CA-C-N 116.802 -0.181 . . . . 0.0 110.868 177.739 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 48.7 tp -60.4 -48.26 82.51 Favored 'General case' 0 N--CA 1.453 -0.315 0 CA-C-O 121.348 0.594 . . . . 0.0 109.632 -179.411 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 50' ' ' PHE . . . . . . . . . . . . . 59.2 t80 -53.98 -49.31 69.1 Favored 'General case' 0 N--CA 1.449 -0.483 0 C-N-CA 123.331 0.653 . . . . 0.0 110.266 178.848 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 34.7 mt-10 -60.9 -43.34 98.67 Favored 'General case' 0 N--CA 1.455 -0.209 0 C-N-CA 122.719 0.408 . . . . 0.0 110.996 177.648 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 32.7 tt0 -52.74 -42.31 64.79 Favored 'General case' 0 CA--C 1.529 0.172 0 C-N-CA 122.933 0.493 . . . . 0.0 110.708 176.456 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 82.1 mt -75.36 -63.12 1.35 Allowed 'General case' 0 N--CA 1.45 -0.471 0 C-N-CA 123.062 0.545 . . . . 0.0 111.229 179.046 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 29.4 t70 -110.24 96.61 6.32 Favored 'General case' 0 C--N 1.332 -0.181 0 C-N-CA 125.406 1.482 . . . . 0.0 108.711 -179.207 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 2.6 mptp? -63.44 -59.85 4.13 Favored 'General case' 0 N--CA 1.454 -0.26 0 CA-C-O 122.234 1.016 . . . . 0.0 110.047 -175.118 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 56' ' ' ASN . . . . . . . . . . . . . 37.1 p-10 -154.28 32.12 0.43 Allowed 'General case' 0 C--N 1.327 -0.409 0 C-N-CA 125.671 1.588 . . . . 0.0 107.517 172.777 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . -67.47 -70.43 1.13 Allowed Glycine 0 C--N 1.34 0.761 0 N-CA-C 110.002 -1.239 . . . . 0.0 110.002 -169.911 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 2.4 p30 -129.54 -0.99 4.95 Favored 'General case' 0 N--CA 1.447 -0.601 0 C-N-CA 124.354 1.062 . . . . 0.0 112.752 177.531 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . 85.41 1.45 87.95 Favored Glycine 0 CA--C 1.53 1.017 0 CA-C-O 119.216 -0.769 . . . . 0.0 113.08 178.727 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 45.7 mt-10 -146.13 175.78 10.22 Favored 'General case' 0 N--CA 1.454 -0.24 0 C-N-CA 127.804 2.442 . . . . 0.0 106.637 173.707 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 61' ' ' VAL . . . . . . . . . . . . . 73.0 t -111.59 106.56 21.0 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.236 0 C-N-CA 122.742 0.417 . . . . 0.0 110.161 -169.541 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 53.8 p -82.56 160.73 22.49 Favored 'General case' 0 CA--C 1.539 0.544 0 C-N-CA 123.875 0.87 . . . . 0.0 111.343 173.557 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 63' ' ' PHE . . . . . . . . . . . . . 49.7 t80 -51.16 -49.93 59.93 Favored 'General case' 0 N--CA 1.468 0.426 0 O-C-N 121.422 -0.799 . . . . 0.0 111.417 -173.921 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 12.5 pt-20 -53.26 -28.57 28.28 Favored 'General case' 0 CA--C 1.534 0.342 0 C-N-CA 124.654 1.181 . . . . 0.0 114.145 -178.373 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 14.3 pt-20 -100.15 -30.25 12.04 Favored 'General case' 0 CA--C 1.529 0.167 0 C-N-CA 123.593 0.757 . . . . 0.0 110.432 177.88 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 5.3 t80 -52.62 -32.42 41.6 Favored 'General case' 0 CA--C 1.535 0.372 0 O-C-N 121.412 -0.805 . . . . 0.0 110.121 167.687 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 67' ' ' GLN . . . . . . . . . . . . . 0.8 OUTLIER -46.44 -34.66 4.9 Favored 'General case' 0 CA--C 1.538 0.507 0 N-CA-C 113.747 1.018 . . . . 0.0 113.747 169.15 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 77.1 t -61.23 -29.54 46.04 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.541 0 CA-C-N 119.104 0.865 . . . . 0.0 110.667 175.945 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 1.4 tt -71.98 -50.69 26.65 Favored 'General case' 0 N--CA 1.455 -0.188 0 N-CA-C 106.447 -1.686 . . . . 0.0 106.447 178.14 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 70' ' ' VAL . . . . . . . . . . . . . 18.3 t -54.38 -44.62 67.38 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.389 0 C-N-CA 122.819 0.448 . . . . 0.0 110.175 177.701 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 21.2 ttmm -52.54 -57.99 8.2 Favored 'General case' 0 N--CA 1.453 -0.302 0 C-N-CA 123.616 0.766 . . . . 0.0 109.97 172.334 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 12.5 mptt -49.53 -42.51 44.09 Favored 'General case' 0 CA--C 1.535 0.394 0 N-CA-C 112.825 0.676 . . . . 0.0 112.825 176.6 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 73' ' ' ILE . . . . . . . . . . . . . 46.0 mt -59.1 -34.34 53.02 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.485 0 CA-C-N 118.399 0.545 . . . . 0.0 110.966 176.116 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 21.4 m 50.08 51.69 16.17 Favored 'General case' 0 CA--C 1.532 0.263 0 C-N-CA 124.694 1.198 . . . . 0.0 111.306 178.745 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 75' ' ' GLN . . . . . . . . . . . . . 32.7 mt-30 . . . . . 0 C--O 1.27 2.161 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.193 178.385 . . . . . . . . 0 0 . 1 . 016 nuclear nobuild full ' A' A ' 1' ' ' LYS . . . . . . . . . . . . . 74.2 mmtt . . . . . 0 N--CA 1.45 -0.442 0 N-CA-C 108.528 -0.915 . . . . 0.0 108.528 . . . . . . . . . 0 0 . 1 . 016 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 86.3 p -69.09 154.54 94.91 Favored Pre-proline 0 CA--C 1.534 0.356 0 N-CA-C 109.758 -0.46 . . . . 0.0 109.758 175.996 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 80.0 Cg_exo -46.54 -39.58 22.77 Favored 'Trans proline' 0 N--CA 1.456 -0.702 0 C-N-CA 122.885 2.39 . . . . 0.0 112.378 169.548 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 2.8 mp0 -59.82 -49.35 78.07 Favored 'General case' 0 N--CA 1.456 -0.136 0 C-N-CA 123.956 0.902 . . . . 0.0 111.981 176.055 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 30.1 mt-10 -60.16 -45.44 93.06 Favored 'General case' 0 C--N 1.332 -0.188 0 N-CA-C 109.109 -0.7 . . . . 0.0 109.109 176.886 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 16.1 mt -61.52 -36.19 79.85 Favored 'General case' 0 N--CA 1.447 -0.579 0 C-N-CA 123.014 0.526 . . . . 0.0 112.28 179.17 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 55.8 tptt -61.31 -49.47 76.89 Favored 'General case' 0 C--N 1.329 -0.286 0 O-C-N 121.737 -0.602 . . . . 0.0 110.074 169.942 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . -50.65 -51.43 33.14 Favored Glycine 0 CA--C 1.531 1.067 0 N-CA-C 110.724 -0.95 . . . . 0.0 110.724 176.639 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 9' ' ' ILE . . . . . . . . . . . . . 3.4 mm -57.11 -55.53 20.0 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.197 0 C-N-CA 125.859 1.663 . . . . 0.0 109.417 176.628 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 10' ' ' PHE . . . . . . . . . . . . . 56.1 t80 -46.48 -52.22 13.66 Favored 'General case' 0 N--CA 1.45 -0.45 0 C-N-CA 123.49 0.716 . . . . 0.0 109.763 178.436 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 51.9 mt-10 -62.43 -50.87 69.78 Favored 'General case' 0 N--CA 1.454 -0.256 0 C-N-CA 123.214 0.606 . . . . 0.0 110.772 -179.614 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 18.1 ttmm -43.81 -53.76 5.73 Favored 'General case' 0 C--N 1.339 0.146 0 C-N-CA 124.657 1.183 . . . . 0.0 110.686 177.446 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 66.0 m-85 -78.24 -47.55 17.69 Favored 'General case' 0 N--CA 1.453 -0.32 0 C-N-CA 120.814 -0.355 . . . . 0.0 110.753 -175.922 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -52.84 -42.55 65.28 Favored 'General case' 0 C--N 1.329 -0.309 0 C-N-CA 123.493 0.717 . . . . 0.0 111.976 -179.116 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -66.05 -16.61 64.07 Favored 'General case' 0 C--N 1.332 -0.169 0 N-CA-C 113.367 0.877 . . . . 0.0 113.367 178.616 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 18.0 ttmm -71.05 83.82 0.7 Allowed 'General case' 0 N--CA 1.45 -0.432 0 N-CA-C 107.839 -1.171 . . . . 0.0 107.839 -179.011 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 38.2 mt-10 73.2 -37.21 0.38 Allowed 'General case' 0 CA--C 1.532 0.285 0 C-N-CA 126.96 2.104 . . . . 0.0 112.759 -178.134 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . -67.27 176.09 23.59 Favored Glycine 0 CA--C 1.532 1.131 0 N-CA-C 111.008 -0.837 . . . . 0.0 111.008 170.223 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 10.3 t70 -80.33 135.78 53.59 Favored Pre-proline 0 CA--C 1.533 0.305 0 N-CA-C 107.869 -1.16 . . . . 0.0 107.869 174.058 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 20' ' ' PRO . . . . . . . . . . . . . 19.5 Cg_endo -52.49 -25.8 26.37 Favored 'Trans proline' 0 CA--C 1.535 0.555 0 C-N-CA 123.205 2.603 . . . . 0.0 114.315 -178.973 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 50.7 m-80 -84.9 -6.35 59.34 Favored 'General case' 0 CA--C 1.533 0.321 0 CA-C-O 118.321 -0.847 . . . . 0.0 112.833 -178.654 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 17.6 tt0 -152.11 118.69 5.68 Favored 'General case' 0 CA--C 1.537 0.444 0 CA-C-N 119.66 1.118 . . . . 0.0 113.664 -167.929 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 52.0 mt -83.72 131.34 34.93 Favored 'General case' 0 N--CA 1.453 -0.292 0 C-N-CA 123.935 0.894 . . . . 0.0 111.186 177.764 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 92.2 p -79.71 175.63 10.45 Favored 'General case' 0 CA--C 1.536 0.431 0 N-CA-C 108.339 -0.986 . . . . 0.0 108.339 167.06 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 63.4 mttp -57.14 -41.92 79.98 Favored 'General case' 0 C--N 1.34 0.161 0 O-C-N 121.772 -0.58 . . . . 0.0 110.017 170.932 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 1.7 mp0 -63.67 -52.19 61.8 Favored 'General case' 0 N--CA 1.452 -0.366 0 C-N-CA 123.142 0.577 . . . . 0.0 110.214 -177.317 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -58.44 -41.59 85.44 Favored 'General case' 0 CA--C 1.536 0.406 0 CA-C-N 115.8 -0.636 . . . . 0.0 109.642 177.881 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 12.1 mt -56.2 -43.7 78.75 Favored 'General case' 0 C--O 1.219 -0.515 0 CA-C-N 119.174 0.897 . . . . 0.0 112.859 169.286 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 59.2 tttp -61.99 -45.93 91.47 Favored 'General case' 0 C--N 1.322 -0.593 0 CA-C-N 119.075 0.852 . . . . 0.0 110.19 -177.192 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 4.4 mm? -60.17 -50.92 71.79 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.148 -0.478 . . . . 0.0 111.159 175.556 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 7.7 tt -51.17 -55.21 19.08 Favored 'General case' 0 C--N 1.333 -0.111 0 C-N-CA 123.575 0.75 . . . . 0.0 109.711 176.876 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 47.2 mt -55.7 -56.29 22.15 Favored 'General case' 0 N--CA 1.451 -0.385 0 C-N-CA 124.346 1.058 . . . . 0.0 109.67 -177.647 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 27.5 mt-30 -55.28 -51.54 66.34 Favored 'General case' 0 N--CA 1.457 -0.086 0 CA-C-N 117.943 0.338 . . . . 0.0 111.232 -177.868 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 5.7 m -72.81 -45.8 56.52 Favored 'General case' 0 N--CA 1.451 -0.402 0 CA-C-N 116.15 -0.477 . . . . 0.0 111.077 -170.016 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 69.6 mm-40 -98.99 -39.05 8.74 Favored 'General case' 0 N--CA 1.451 -0.423 0 C-N-CA 123.757 0.823 . . . . 0.0 112.886 -169.365 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 16.8 m-85 -126.68 56.55 17.7 Favored Pre-proline 0 CA--C 1.531 0.235 0 C-N-CA 123.167 0.587 . . . . 0.0 111.505 -170.867 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 51.0 Cg_endo -61.57 -28.66 83.29 Favored 'Trans proline' 0 N--CA 1.453 -0.856 0 C-N-CA 122.294 1.996 . . . . 0.0 111.266 -175.789 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 9.0 t -57.21 -39.46 75.5 Favored 'General case' 0 CA--C 1.53 0.189 0 C-N-CA 123.354 0.661 . . . . 0.0 109.956 -179.006 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 26.3 mt -56.71 -31.79 64.85 Favored 'General case' 0 CA--C 1.533 0.293 0 O-C-N 121.617 -0.677 . . . . 0.0 111.603 177.909 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 68.2 mt -71.43 -5.56 33.74 Favored 'General case' 0 CA--C 1.533 0.302 0 O-C-N 121.606 -0.684 . . . . 0.0 112.519 -179.074 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 85.2 mttt -57.06 -41.29 78.45 Favored 'General case' 0 CA--C 1.53 0.182 0 CA-C-N 119.2 0.909 . . . . 0.0 110.198 169.234 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . 164.93 47.23 0.02 OUTLIER Glycine 0 CA--C 1.526 0.751 0 CA-C-N 116.537 -0.302 . . . . 0.0 112.882 174.27 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 43' ' ' GLY . . . . . . . . . . . . . . . -74.81 62.0 2.46 Favored Glycine 0 CA--C 1.528 0.885 0 N-CA-C 109.952 -1.259 . . . . 0.0 109.952 172.309 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 44' ' ' SER . . . . . . . . . . . . . 8.7 t 57.0 -162.21 0.2 Allowed 'General case' 0 CA--C 1.536 0.427 0 C-N-CA 125.03 1.332 . . . . 0.0 110.66 -169.432 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 20.1 p -86.9 160.77 18.6 Favored 'General case' 0 CA--C 1.527 0.092 0 N-CA-C 108.177 -1.046 . . . . 0.0 108.177 169.851 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 19.8 mt -61.96 -45.46 93.58 Favored 'General case' 0 N--CA 1.453 -0.307 0 N-CA-C 108.773 -0.825 . . . . 0.0 108.773 177.892 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 5.9 m-20 -60.25 -48.88 79.87 Favored 'General case' 0 N--CA 1.449 -0.523 0 CA-C-N 115.081 -0.963 . . . . 0.0 111.014 -179.448 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 7.9 tm-20 -64.79 -43.26 93.77 Favored 'General case' 0 N--CA 1.453 -0.317 0 N-CA-C 109.839 -0.43 . . . . 0.0 109.839 179.328 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 59.8 tp -57.34 -49.73 75.19 Favored 'General case' 0 C--N 1.333 -0.141 0 N-CA-C 109.657 -0.497 . . . . 0.0 109.657 176.829 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 50' ' ' PHE . . . . . . . . . . . . . 57.3 t80 -52.2 -46.24 65.54 Favored 'General case' 0 N--CA 1.452 -0.367 0 C-N-CA 124.043 0.937 . . . . 0.0 109.595 176.223 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 26.6 tt0 -56.66 -49.34 75.35 Favored 'General case' 0 N--CA 1.453 -0.299 0 CA-C-O 119.735 -0.174 . . . . 0.0 111.383 174.739 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 50.4 mt-10 -51.99 -47.92 64.65 Favored 'General case' 0 N--CA 1.465 0.3 0 CA-C-N 118.159 0.436 . . . . 0.0 111.353 177.582 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 80.8 mt -64.6 -55.51 19.86 Favored 'General case' 0 N--CA 1.452 -0.365 0 CA-C-O 121.269 0.557 . . . . 0.0 110.631 179.777 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 13.0 t70 -116.42 73.89 0.88 Allowed 'General case' 0 N--CA 1.452 -0.333 0 C-N-CA 126.954 2.102 . . . . 0.0 108.992 -171.093 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 17.1 mmtp -60.82 -57.29 13.28 Favored 'General case' 0 CA--C 1.523 -0.066 0 CA-C-O 121.9 0.857 . . . . 0.0 110.335 179.448 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 56' ' ' ASN . . . . . . . . . . . . . 34.3 p-10 -148.2 32.32 0.82 Allowed 'General case' 0 C--N 1.327 -0.39 0 C-N-CA 125.368 1.467 . . . . 0.0 108.099 175.217 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . -65.35 -69.43 1.35 Allowed Glycine 0 CA--C 1.525 0.69 0 N-CA-C 109.984 -1.246 . . . . 0.0 109.984 -174.693 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -145.92 -18.79 0.46 Allowed 'General case' 0 CA--C 1.54 0.584 0 C-N-CA 123.677 0.791 . . . . 0.0 112.259 -178.602 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . 106.55 -5.58 37.86 Favored Glycine 0 CA--C 1.531 1.083 0 CA-C-N 118.976 0.807 . . . . 0.0 112.575 -175.692 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 53.6 mt-10 -143.81 178.44 7.82 Favored 'General case' 0 N--CA 1.453 -0.325 0 C-N-CA 128.25 2.62 . . . . 0.0 106.764 171.823 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 61' ' ' VAL . . . . . . . . . . . . . 90.1 t -109.54 102.12 13.55 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.273 0 N-CA-C 109.794 -0.447 . . . . 0.0 109.794 -170.634 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 98.7 p -77.99 170.73 16.11 Favored 'General case' 0 CA--C 1.539 0.556 0 C-N-CA 123.196 0.598 . . . . 0.0 110.609 173.193 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 63' ' ' PHE . . . . . . . . . . . . . 54.9 t80 -59.61 -41.56 90.64 Favored 'General case' 0 CA--C 1.531 0.227 0 O-C-N 121.661 -0.65 . . . . 0.0 112.572 -172.313 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 1.9 pp20? -59.08 -57.65 12.13 Favored 'General case' 0 CA--C 1.534 0.362 0 O-C-N 121.942 -0.474 . . . . 0.0 110.918 179.782 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 10.8 pt-20 -62.42 -35.13 78.26 Favored 'General case' 0 CA--C 1.535 0.372 0 O-C-N 121.694 -0.629 . . . . 0.0 111.599 179.296 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 14.2 t80 -49.81 -34.02 18.34 Favored 'General case' 0 CA--C 1.536 0.442 0 O-C-N 121.343 -0.848 . . . . 0.0 112.47 169.53 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 67' ' ' GLN . . . . . . . . . . . . . 98.9 mm-40 -60.39 -23.26 64.19 Favored 'General case' 0 CA--C 1.537 0.459 0 O-C-N 120.697 -1.252 . . . . 0.0 112.68 176.311 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 58.5 t -62.77 -29.43 47.03 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.502 0 O-C-N 120.918 -1.114 . . . . 0.0 110.215 170.69 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 1.8 tt -72.38 -46.3 55.92 Favored 'General case' 0 N--CA 1.457 -0.095 0 N-CA-C 106.769 -1.567 . . . . 0.0 106.769 177.571 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 70' ' ' VAL . . . . . . . . . . . . . 36.3 t -57.64 -39.37 69.57 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.502 0 O-C-N 121.952 -0.468 . . . . 0.0 110.525 175.499 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 71' ' ' LYS . . . . . 0.774 ' O ' ' OXT' ' A' ' 75' ' ' GLN . 35.0 ttpt -58.5 -52.38 65.91 Favored 'General case' 0 CA--C 1.53 0.203 0 O-C-N 121.822 -0.548 . . . . 0.0 110.926 171.76 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 5.3 mptp? -47.14 -50.43 20.38 Favored 'General case' 0 CA--C 1.534 0.363 0 C-N-CA 123.062 0.545 . . . . 0.0 111.592 173.179 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 73' ' ' ILE . . . . . . . . . . . . . 61.9 mt -55.92 -52.97 43.47 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.33 0 N-CA-C 109.069 -0.715 . . . . 0.0 109.069 175.751 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 74' ' ' SER . . . . . 0.427 ' C ' ' OXT' ' A' ' 75' ' ' GLN . 4.7 m -77.71 47.25 0.6 Allowed 'General case' 0 CA--C 1.534 0.36 0 C-N-CA 124.629 1.171 . . . . 0.0 110.498 178.557 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 75' ' ' GLN . . . . . 0.774 ' OXT' ' O ' ' A' ' 71' ' ' LYS . 0.4 OUTLIER . . . . . 0 C--O 1.269 2.126 0 C-N-CA 125.591 1.557 . . . . 0.0 112.436 -169.592 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 1' ' ' LYS . . . . . . . . . . . . . 7.7 mptt . . . . . 0 N--CA 1.449 -0.504 0 N-CA-C 107.179 -1.415 . . . . 0.0 107.179 . . . . . . . . . 0 0 . 1 . 017 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 84.2 p -64.13 155.61 78.26 Favored Pre-proline 0 CA--C 1.537 0.48 0 CA-C-O 118.792 -0.623 . . . . 0.0 110.179 -179.749 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 83.4 Cg_exo -43.15 -42.7 9.87 Favored 'Trans proline' 0 N--CA 1.458 -0.572 0 C-N-CA 123.314 2.676 . . . . 0.0 113.001 172.077 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 3.0 mp0 -59.35 -47.87 83.78 Favored 'General case' 0 N--CA 1.455 -0.216 0 C-N-CA 123.934 0.894 . . . . 0.0 111.93 176.164 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 36.9 mt-10 -62.95 -43.97 97.35 Favored 'General case' 0 N--CA 1.453 -0.304 0 N-CA-C 109.349 -0.611 . . . . 0.0 109.349 178.41 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 47.7 mt -60.88 -39.7 90.22 Favored 'General case' 0 N--CA 1.45 -0.466 0 C-N-CA 123.386 0.674 . . . . 0.0 111.528 177.921 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 27.5 tptp -59.38 -46.17 89.43 Favored 'General case' 0 C--N 1.331 -0.215 0 O-C-N 121.806 -0.559 . . . . 0.0 110.348 170.05 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . -54.66 -53.51 38.61 Favored Glycine 0 CA--C 1.529 0.933 0 N-CA-C 110.338 -1.105 . . . . 0.0 110.338 179.129 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 9' ' ' ILE . . . . . . . . . . . . . 46.5 mt -51.33 -56.51 4.99 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.145 0 C-N-CA 125.641 1.576 . . . . 0.0 109.88 172.206 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 10' ' ' PHE . . . . . . . . . . . . . 49.1 t80 -49.24 -50.71 37.38 Favored 'General case' 0 N--CA 1.446 -0.673 0 N-CA-C 109.925 -0.398 . . . . 0.0 109.925 -178.438 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 57.3 mt-10 -61.99 -52.94 61.98 Favored 'General case' 0 CA--C 1.531 0.219 0 C-N-CA 122.444 0.298 . . . . 0.0 110.712 179.249 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 24.7 ttpt -43.32 -53.82 5.02 Favored 'General case' 0 C--N 1.339 0.126 0 C-N-CA 124.92 1.288 . . . . 0.0 110.736 178.645 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 66.6 m-85 -77.78 -47.63 18.5 Favored 'General case' 0 N--CA 1.45 -0.443 0 CA-C-N 116.578 -0.283 . . . . 0.0 110.408 -175.839 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -58.87 -37.18 75.95 Favored 'General case' 0 C--N 1.33 -0.275 0 O-C-N 121.417 -0.802 . . . . 0.0 112.743 -175.857 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -71.23 -22.81 61.94 Favored 'General case' 0 N--CA 1.454 -0.269 0 N-CA-C 112.211 0.448 . . . . 0.0 112.211 176.464 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 38.5 ttpt -77.01 70.37 3.41 Favored 'General case' 0 CA--C 1.534 0.336 0 N-CA-C 107.971 -1.122 . . . . 0.0 107.971 -178.89 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . 0.346 10.3 pt-20 54.85 109.71 0.01 OUTLIER 'General case' 0 N--CA 1.453 -0.304 0 C-N-CA 127.941 2.496 . . . . 0.0 113.776 -167.654 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 152.41 -159.0 28.16 Favored Glycine 0 CA--C 1.524 0.606 0 N-CA-C 104.734 -3.347 . . . . 0.0 104.734 -169.442 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 10.4 t70 -109.06 137.87 20.25 Favored Pre-proline 0 C--O 1.225 -0.235 0 N-CA-C 105.947 -1.872 . . . . 0.0 105.947 169.215 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 20' ' ' PRO . . . . . . . . . . . . . 16.5 Cg_endo -53.13 -26.4 32.93 Favored 'Trans proline' 0 CA--C 1.539 0.726 0 C-N-CA 121.896 1.731 . . . . 0.0 113.519 179.81 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 37.0 m-80 -92.01 -4.1 54.95 Favored 'General case' 0 N--CA 1.454 -0.275 0 C-N-CA 124.694 1.197 . . . . 0.0 111.937 -178.025 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 7.4 tt0 -155.13 116.66 4.05 Favored 'General case' 0 CA--C 1.539 0.533 0 CA-C-N 118.838 0.744 . . . . 0.0 112.485 -168.392 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 26.0 mt -78.29 131.49 37.09 Favored 'General case' 0 N--CA 1.455 -0.191 0 C-N-CA 123.127 0.571 . . . . 0.0 111.352 -172.642 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -77.77 158.86 29.39 Favored 'General case' 0 CA--C 1.54 0.56 0 C-N-CA 126.377 1.871 . . . . 0.0 108.867 168.766 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 31.7 ttmt -60.28 -46.02 91.29 Favored 'General case' 0 CA--C 1.534 0.342 0 O-C-N 121.546 -0.721 . . . . 0.0 112.098 -170.471 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 57.6 mm-40 -65.61 -41.35 92.85 Favored 'General case' 0 N--CA 1.454 -0.241 0 CA-C-O 121.729 0.776 . . . . 0.0 110.199 -179.216 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 4.6 mp0 -57.79 -48.08 80.73 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-N 115.527 -0.76 . . . . 0.0 109.219 175.756 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 5.0 mt -52.91 -45.33 67.55 Favored 'General case' 0 C--O 1.219 -0.546 0 N-CA-C 113.097 0.777 . . . . 0.0 113.097 168.24 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 5.7 ttpm? -58.51 -50.96 71.85 Favored 'General case' 0 C--N 1.324 -0.505 0 CA-C-N 118.883 0.765 . . . . 0.0 110.636 -178.947 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 4.1 mm? -59.58 -46.78 87.92 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.169 -0.469 . . . . 0.0 111.212 177.766 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 6.8 tt -51.45 -58.17 6.99 Favored 'General case' 0 N--CA 1.455 -0.212 0 C-N-CA 124.031 0.933 . . . . 0.0 109.064 174.787 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 38.7 mt -54.02 -58.55 6.88 Favored 'General case' 0 C--N 1.33 -0.259 0 C-N-CA 123.708 0.803 . . . . 0.0 109.421 -178.021 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 1.1 tm0? -52.56 -53.55 44.8 Favored 'General case' 0 N--CA 1.453 -0.288 0 C-N-CA 123.514 0.726 . . . . 0.0 111.2 -177.401 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 11.1 m -73.24 -47.56 42.17 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.657 -0.247 . . . . 0.0 110.997 -171.105 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 69.3 mm-40 -90.69 -37.93 13.41 Favored 'General case' 0 N--CA 1.448 -0.548 0 C-N-CA 123.647 0.779 . . . . 0.0 112.021 -169.033 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 87.0 m-85 -137.48 62.96 39.27 Favored Pre-proline 0 CA--C 1.531 0.247 0 C-N-CA 123.855 0.862 . . . . 0.0 111.784 -170.614 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 51.4 Cg_endo -60.7 -22.18 72.16 Favored 'Trans proline' 0 N--CA 1.456 -0.693 0 C-N-CA 122.382 2.054 . . . . 0.0 111.307 178.213 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 1.6 p -47.48 -52.5 17.02 Favored 'General case' 0 N--CA 1.449 -0.522 0 C-N-CA 125.886 1.674 . . . . 0.0 110.322 170.178 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 56.2 mt -62.68 -23.02 66.91 Favored 'General case' 0 C--N 1.33 -0.243 0 C-N-CA 123.524 0.729 . . . . 0.0 112.666 -177.844 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 50.7 mt -72.84 -23.92 60.82 Favored 'General case' 0 CA--C 1.529 0.167 0 CA-C-N 118.462 0.574 . . . . 0.0 111.563 173.507 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 81.1 mttt -67.62 149.09 50.52 Favored 'General case' 0 N--CA 1.445 -0.677 0 N-CA-C 106.776 -1.564 . . . . 0.0 106.776 168.985 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . 72.51 -65.31 1.38 Allowed Glycine 0 CA--C 1.533 1.159 0 N-CA-C 108.049 -2.021 . . . . 0.0 108.049 -167.212 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 43' ' ' GLY . . . . . . . . . . . . . . . 73.74 -55.82 2.13 Favored Glycine 0 CA--C 1.527 0.816 0 C-N-CA 125.029 1.299 . . . . 0.0 115.316 167.154 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 44' ' ' SER . . . . . . . . . . . . . 30.8 p 55.78 -105.0 0.24 Allowed 'General case' 0 N--CA 1.442 -0.83 0 C-N-CA 125.35 1.46 . . . . 0.0 108.914 -167.925 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 44.4 p -139.51 145.77 39.12 Favored 'General case' 0 N--CA 1.451 -0.395 0 N-CA-C 107.175 -1.417 . . . . 0.0 107.175 167.067 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 50.5 tp -49.61 -42.67 45.43 Favored 'General case' 0 N--CA 1.454 -0.265 0 C-N-CA 122.916 0.486 . . . . 0.0 109.909 170.017 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 6.1 m-20 -57.28 -53.74 54.66 Favored 'General case' 0 N--CA 1.448 -0.563 0 C-N-CA 123.907 0.883 . . . . 0.0 111.08 177.28 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 14.7 tp10 -55.93 -49.17 74.24 Favored 'General case' 0 C--N 1.332 -0.193 0 N-CA-C 110.123 -0.325 . . . . 0.0 110.123 178.741 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 43.5 tp -59.41 -47.95 83.51 Favored 'General case' 0 CA--C 1.532 0.254 0 CA-C-O 121.304 0.573 . . . . 0.0 110.152 -179.882 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 50' ' ' PHE . . . . . . . . . . . . . 74.3 t80 -55.53 -49.05 73.66 Favored 'General case' 0 N--CA 1.451 -0.378 0 C-N-CA 124.165 0.986 . . . . 0.0 110.534 178.423 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 32.9 mt-10 -59.06 -49.29 78.44 Favored 'General case' 0 N--CA 1.455 -0.208 0 C-N-CA 123.217 0.607 . . . . 0.0 110.591 177.34 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 30.5 tp10 -53.92 -44.88 70.95 Favored 'General case' 0 N--CA 1.456 -0.167 0 C-N-CA 123.463 0.705 . . . . 0.0 110.977 178.544 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 95.1 mt -72.37 -47.53 48.72 Favored 'General case' 0 N--CA 1.45 -0.453 0 CA-C-O 120.802 0.334 . . . . 0.0 111.495 -179.767 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 37.7 t0 -75.6 68.5 2.22 Favored 'General case' 0 CA--C 1.533 0.303 0 C-N-CA 124.412 1.085 . . . . 0.0 110.267 -179.942 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 34.3 mmtm -60.8 -35.12 75.68 Favored 'General case' 0 CA--C 1.534 0.363 0 C-N-CA 123.41 0.684 . . . . 0.0 111.273 170.42 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 56' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER -59.65 -39.44 84.41 Favored 'General case' 0 CA--C 1.536 0.412 0 C-N-CA 123.03 0.532 . . . . 0.0 111.203 -177.401 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . 104.16 -11.43 51.79 Favored Glycine 0 CA--C 1.53 0.97 0 C-N-CA 124.278 0.942 . . . . 0.0 114.116 170.184 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 3.0 p-10 -78.32 10.0 3.41 Favored 'General case' 0 CA--C 1.535 0.381 0 CA-C-N 119.746 1.773 . . . . 0.0 114.376 -169.885 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . 79.44 32.44 38.21 Favored Glycine 0 CA--C 1.526 0.728 0 CA-C-N 118.596 0.634 . . . . 0.0 112.347 174.298 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 51.2 mt-10 -161.0 162.54 31.86 Favored 'General case' 0 CA--C 1.534 0.348 0 C-N-CA 126.325 1.85 . . . . 0.0 106.15 168.781 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 61' ' ' VAL . . . . . . . . . . . . . 26.5 t -108.8 115.67 50.0 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.455 0 CA-C-N 118.706 0.685 . . . . 0.0 110.896 -175.833 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -78.92 150.85 32.0 Favored 'General case' 0 CA--C 1.537 0.45 0 C-N-CA 124.863 1.265 . . . . 0.0 111.362 179.411 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 63' ' ' PHE . . . . . . . . . . . . . 66.7 t80 -51.53 -44.7 62.71 Favored 'General case' 0 N--CA 1.468 0.427 0 O-C-N 121.446 -0.784 . . . . 0.0 112.586 -173.746 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 2.9 pm0 -59.77 -31.15 69.39 Favored 'General case' 0 N--CA 1.449 -0.524 0 N-CA-C 113.092 0.775 . . . . 0.0 113.092 -179.395 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 21.6 pt-20 -95.04 -27.65 15.51 Favored 'General case' 0 CA--C 1.531 0.222 0 CA-C-N 118.679 0.672 . . . . 0.0 110.797 179.001 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 9.5 t80 -53.21 -25.66 14.78 Favored 'General case' 0 CA--C 1.536 0.426 0 C-N-CA 123.6 0.76 . . . . 0.0 110.201 166.992 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 67' ' ' GLN . . . . . . . . . . . . . 66.4 mm-40 -51.58 -25.04 6.13 Favored 'General case' 0 CA--C 1.538 0.5 0 N-CA-C 113.633 0.975 . . . . 0.0 113.633 169.869 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 99.4 t -60.86 -33.06 53.9 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.556 0 CA-C-N 119.653 1.115 . . . . 0.0 110.735 172.136 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 10.5 tt -72.16 -46.16 57.53 Favored 'General case' 0 N--CA 1.457 -0.117 0 N-CA-C 107.056 -1.461 . . . . 0.0 107.056 176.694 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 70' ' ' VAL . . . . . . . . . . . . . 21.6 t -55.66 -42.05 67.54 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.457 0 N-CA-C 110.272 -0.27 . . . . 0.0 110.272 176.775 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 37.3 ttmt -56.79 -55.62 32.01 Favored 'General case' 0 N--CA 1.455 -0.205 0 C-N-CA 124.068 0.947 . . . . 0.0 110.588 173.431 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 14.0 mptt -50.1 -47.7 53.73 Favored 'General case' 0 CA--C 1.537 0.448 0 C-N-CA 122.341 0.257 . . . . 0.0 111.678 175.785 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 73' ' ' ILE . . . . . . . . . . . . . 25.3 mm -56.97 -50.13 77.08 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.265 0 C-N-CA 123.183 0.593 . . . . 0.0 109.959 176.507 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 14.2 t 71.21 -63.76 0.41 Allowed 'General case' 0 CA--C 1.531 0.249 0 C-N-CA 126.966 2.106 . . . . 0.0 111.923 175.022 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 75' ' ' GLN . . . . . . . . . . . . . 3.0 pt20 . . . . . 0 C--O 1.271 2.192 0 C-N-CA 124.816 1.246 . . . . 0.0 111.477 -179.735 . . . . . . . . 0 0 . 1 . 018 nuclear nobuild full ' A' A ' 1' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 N--CA 1.449 -0.485 0 N-CA-C 108.69 -0.855 . . . . 0.0 108.69 . . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 77.4 p -71.32 160.93 81.03 Favored Pre-proline 0 CA--C 1.532 0.274 0 N-CA-C 109.208 -0.664 . . . . 0.0 109.208 176.686 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 82.6 Cg_exo -47.5 -42.16 29.01 Favored 'Trans proline' 0 CA--C 1.536 0.625 0 C-N-CA 122.814 2.343 . . . . 0.0 112.14 169.648 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 42.3 tt0 -58.31 -53.84 53.74 Favored 'General case' 0 N--CA 1.455 -0.175 0 C-N-CA 123.777 0.831 . . . . 0.0 111.189 177.022 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 47.0 mm-40 -62.84 -40.95 99.01 Favored 'General case' 0 N--CA 1.452 -0.367 0 N-CA-C 109.149 -0.686 . . . . 0.0 109.149 -179.265 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 40.8 mt -59.49 -38.16 80.14 Favored 'General case' 0 N--CA 1.448 -0.558 0 C-N-CA 124.286 1.035 . . . . 0.0 111.896 176.609 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 23.2 tptm -60.66 -49.92 75.58 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-N 119.069 0.85 . . . . 0.0 110.712 169.982 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . -53.45 -52.96 37.82 Favored Glycine 0 CA--C 1.531 1.039 0 N-CA-C 110.519 -1.032 . . . . 0.0 110.519 -179.542 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 9' ' ' ILE . . . . . . . . . . . . . 78.3 mt -51.89 -57.25 3.83 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.259 0 C-N-CA 126.081 1.752 . . . . 0.0 109.935 172.044 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 10' ' ' PHE . . . . . . . . . . . . . 44.4 t80 -48.84 -50.03 36.47 Favored 'General case' 0 N--CA 1.446 -0.663 0 N-CA-C 109.239 -0.652 . . . . 0.0 109.239 -177.389 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 51.0 mt-10 -61.61 -53.25 58.67 Favored 'General case' 0 CA--C 1.532 0.268 0 C-N-CA 123.047 0.539 . . . . 0.0 110.717 178.709 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 1.4 ttpm? -45.14 -50.74 11.05 Favored 'General case' 0 C--N 1.34 0.167 0 C-N-CA 124.197 0.999 . . . . 0.0 110.979 178.075 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 54.6 m-85 -77.74 -52.87 8.26 Favored 'General case' 0 N--CA 1.448 -0.561 0 N-CA-C 110.072 -0.344 . . . . 0.0 110.072 -175.397 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -50.41 -37.67 38.99 Favored 'General case' 0 C--N 1.33 -0.253 0 C-N-CA 125.278 1.431 . . . . 0.0 112.762 -179.79 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -43.6 -42.78 5.33 Favored 'General case' 0 CA--C 1.535 0.379 0 C-N-CA 123.309 0.644 . . . . 0.0 111.874 173.832 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 10.2 mtpp -66.61 -23.81 66.23 Favored 'General case' 0 CA--C 1.534 0.338 0 N-CA-C 112.599 0.592 . . . . 0.0 112.599 -177.959 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 27.8 tt0 -66.06 -27.61 68.22 Favored 'General case' 0 CA--C 1.535 0.37 0 CA-C-N 118.512 0.596 . . . . 0.0 110.041 170.37 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 108.87 -46.88 1.1 Allowed Glycine 0 CA--C 1.525 0.682 0 N-CA-C 108.582 -1.807 . . . . 0.0 108.582 -169.685 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 43.8 t0 -90.61 105.01 10.38 Favored Pre-proline 0 CA--C 1.538 0.504 0 CA-C-O 118.519 -0.753 . . . . 0.0 110.323 177.909 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 20' ' ' PRO . . . . . . . . . . . . . 29.4 Cg_endo -57.72 -21.17 46.37 Favored 'Trans proline' 0 N--CA 1.461 -0.437 0 C-N-CA 122.448 2.098 . . . . 0.0 113.365 178.338 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 42.7 m-80 -79.85 -4.92 54.29 Favored 'General case' 0 N--CA 1.45 -0.435 0 CA-C-O 117.849 -1.072 . . . . 0.0 112.74 -178.194 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 28.1 tt0 -147.57 135.08 20.83 Favored 'General case' 0 CA--C 1.539 0.536 0 CA-C-N 119.758 1.163 . . . . 0.0 113.385 -168.717 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 81.9 mt -104.17 133.12 49.63 Favored 'General case' 0 C--N 1.343 0.317 0 C-N-CA 125.171 1.389 . . . . 0.0 111.154 177.524 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 78.8 p -80.4 174.78 11.27 Favored 'General case' 0 CA--C 1.533 0.304 0 C-N-CA 123.876 0.87 . . . . 0.0 108.929 168.297 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 60.1 mttp -56.43 -40.97 75.64 Favored 'General case' 0 C--N 1.34 0.16 0 O-C-N 122.043 -0.411 . . . . 0.0 110.215 169.97 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 26.4 mt-10 -68.56 -47.1 67.7 Favored 'General case' 0 CA--C 1.517 -0.299 0 CA-C-O 120.813 0.339 . . . . 0.0 110.242 -175.764 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -56.97 -46.91 81.86 Favored 'General case' 0 N--CA 1.453 -0.312 0 CA-C-N 115.986 -0.552 . . . . 0.0 109.751 174.815 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 12.1 mt -56.27 -43.77 79.08 Favored 'General case' 0 CA--C 1.512 -0.518 0 CA-C-N 119.035 0.834 . . . . 0.0 112.988 171.827 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 65.1 tttm -61.58 -48.31 81.52 Favored 'General case' 0 C--N 1.323 -0.573 0 CA-C-N 118.672 0.669 . . . . 0.0 109.697 -176.726 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 92.0 mt -61.51 -46.7 88.86 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.232 -0.44 . . . . 0.0 111.3 177.763 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 7.1 tt -50.1 -58.16 6.13 Favored 'General case' 0 CA--C 1.521 -0.147 0 C-N-CA 124.213 1.005 . . . . 0.0 109.443 174.577 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 45.1 mt -57.68 -53.09 62.07 Favored 'General case' 0 N--CA 1.45 -0.433 0 N-CA-C 109.091 -0.707 . . . . 0.0 109.091 -178.332 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 25.5 tt0 -52.74 -47.13 67.62 Favored 'General case' 0 N--CA 1.453 -0.309 0 O-C-N 121.651 -0.656 . . . . 0.0 111.879 -177.41 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 2.5 m -75.46 -51.27 13.42 Favored 'General case' 0 CA--C 1.534 0.358 0 C-N-CA 121.058 -0.257 . . . . 0.0 111.144 -176.21 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 38.8 mm-40 -90.69 -31.25 16.67 Favored 'General case' 0 N--CA 1.451 -0.425 0 C-N-CA 123.6 0.76 . . . . 0.0 112.828 -166.724 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 82.2 m-85 -145.9 69.37 13.25 Favored Pre-proline 0 CA--C 1.537 0.45 0 C-N-CA 124.863 1.265 . . . . 0.0 111.581 -172.801 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 41.1 Cg_endo -61.41 -16.74 49.29 Favored 'Trans proline' 0 N--CA 1.457 -0.651 0 C-N-CA 122.772 2.315 . . . . 0.0 112.504 -179.421 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 4.0 p -66.55 -62.73 1.3 Allowed 'General case' 0 N--CA 1.448 -0.536 0 C-N-CA 124.377 1.071 . . . . 0.0 108.564 169.389 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 96.6 mt -58.65 -28.0 65.28 Favored 'General case' 0 CA--C 1.531 0.227 0 C-N-CA 123.879 0.872 . . . . 0.0 111.948 -178.858 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 28.4 tp -51.09 -45.59 61.52 Favored 'General case' 0 N--CA 1.463 0.198 0 CA-C-N 118.121 0.419 . . . . 0.0 110.871 169.877 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 64.4 mttm -71.21 -54.19 11.8 Favored 'General case' 0 N--CA 1.448 -0.574 0 N-CA-C 107.951 -1.129 . . . . 0.0 107.951 173.913 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . 72.88 -67.57 1.35 Allowed Glycine 0 CA--C 1.527 0.795 0 C-N-CA 124.311 0.958 . . . . 0.0 112.274 170.582 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 43' ' ' GLY . . . . . . . . . . . . . . . 163.75 -60.57 0.26 Allowed Glycine 0 CA--C 1.524 0.601 0 N-CA-C 110.002 -1.239 . . . . 0.0 110.002 179.74 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 44' ' ' SER . . . . . . . . . . . . . 17.7 p -96.69 -89.57 0.27 Allowed 'General case' 0 N--CA 1.452 -0.348 0 C-N-CA 123.979 0.911 . . . . 0.0 110.195 -175.616 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 66.2 p -150.67 156.21 40.88 Favored 'General case' 0 C--O 1.233 0.201 0 C-N-CA 123.999 0.919 . . . . 0.0 109.827 179.424 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 20.3 mt -55.74 -42.94 76.11 Favored 'General case' 0 C--O 1.223 -0.309 0 N-CA-C 108.645 -0.872 . . . . 0.0 108.645 170.474 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 5.1 m-20 -52.28 -60.59 3.03 Favored 'General case' 0 N--CA 1.449 -0.504 0 C-N-CA 124.311 1.044 . . . . 0.0 110.32 176.161 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 34.2 tt0 -53.64 -46.54 70.56 Favored 'General case' 0 N--CA 1.455 -0.205 0 O-C-N 122.425 -0.172 . . . . 0.0 110.806 179.863 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 87.9 mt -56.38 -49.68 73.76 Favored 'General case' 0 C--O 1.224 -0.277 0 C-N-CA 121.069 -0.252 . . . . 0.0 110.384 176.632 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 50' ' ' PHE . . . . . . . . . . . . . 55.0 t80 -54.67 -51.61 64.94 Favored 'General case' 0 C--N 1.329 -0.319 0 C-N-CA 124.567 1.147 . . . . 0.0 110.45 -178.927 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 1.8 mp0 -56.13 -48.25 76.58 Favored 'General case' 0 CA--C 1.531 0.245 0 CA-C-O 120.641 0.258 . . . . 0.0 110.548 174.784 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 37.0 tt0 -55.23 -43.77 74.85 Favored 'General case' 0 N--CA 1.456 -0.155 0 C-N-CA 123.047 0.539 . . . . 0.0 111.437 -179.745 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 48.3 mt -65.64 -56.59 11.36 Favored 'General case' 0 N--CA 1.448 -0.573 0 N-CA-C 109.838 -0.43 . . . . 0.0 109.838 176.028 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 47.2 t0 -79.71 60.76 3.47 Favored 'General case' 0 CA--C 1.532 0.255 0 C-N-CA 123.856 0.862 . . . . 0.0 110.909 -174.601 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 33.3 mmtm -53.93 -40.59 66.88 Favored 'General case' 0 C--N 1.34 0.163 0 C-N-CA 124.003 0.921 . . . . 0.0 111.131 174.272 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 56' ' ' ASN . . . . . . . . . . . . . 12.3 p-10 -65.46 -13.45 58.81 Favored 'General case' 0 CA--C 1.534 0.34 0 C-N-CA 125.316 1.447 . . . . 0.0 112.573 176.879 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . 58.45 40.65 94.61 Favored Glycine 0 CA--C 1.526 0.771 0 C-N-CA 124.107 0.861 . . . . 0.0 112.966 173.51 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 1.5 p30 -77.84 -26.08 49.2 Favored 'General case' 0 N--CA 1.452 -0.347 0 CA-C-N 118.252 1.026 . . . . 0.0 111.436 -179.988 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . 122.71 -19.85 7.86 Favored Glycine 0 CA--C 1.528 0.847 0 CA-C-O 118.712 -1.049 . . . . 0.0 112.873 176.815 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 50.9 mt-10 -145.85 175.99 10.01 Favored 'General case' 0 CA--C 1.529 0.149 0 C-N-CA 126.751 2.02 . . . . 0.0 107.99 178.446 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 61' ' ' VAL . . . . . . . . . . . . . 5.5 t -112.18 106.13 20.15 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.295 0 CA-C-N 118.129 0.422 . . . . 0.0 111.017 -169.621 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 59.9 p -78.87 167.72 20.75 Favored 'General case' 0 CA--C 1.539 0.531 0 C-N-CA 122.995 0.518 . . . . 0.0 111.322 173.578 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 63' ' ' PHE . . . . . . . . . . . . . 57.2 t80 -60.93 -38.15 84.81 Favored 'General case' 0 CA--C 1.533 0.294 0 O-C-N 121.447 -0.783 . . . . 0.0 112.754 -172.81 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 1.9 pp20? -63.95 -56.66 13.52 Favored 'General case' 0 CA--C 1.536 0.408 0 O-C-N 121.8 -0.562 . . . . 0.0 111.061 -178.926 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 9.1 pt-20 -60.55 -36.86 79.46 Favored 'General case' 0 CA--C 1.537 0.443 0 O-C-N 121.425 -0.797 . . . . 0.0 111.408 176.805 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 21.5 t80 -52.32 -26.87 13.31 Favored 'General case' 0 CA--C 1.538 0.489 0 O-C-N 121.551 -0.718 . . . . 0.0 112.209 170.938 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 67' ' ' GLN . . . . . . . . . . . . . 58.6 mm-40 -55.04 -23.21 18.83 Favored 'General case' 0 CA--C 1.535 0.37 0 CA-C-N 119.768 1.167 . . . . 0.0 113.43 172.821 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 92.7 t -58.59 -32.95 47.19 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.555 0 CA-C-N 119.861 1.21 . . . . 0.0 110.468 171.428 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 22.1 tp -73.81 -48.43 31.42 Favored 'General case' 0 N--CA 1.453 -0.304 0 N-CA-C 107.404 -1.332 . . . . 0.0 107.404 176.976 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 70' ' ' VAL . . . . . . . . . . . . . 38.4 t -55.03 -39.06 48.26 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.476 0 C-N-CA 122.543 0.337 . . . . 0.0 110.67 179.501 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 71' ' ' LYS . . . . . 1.016 ' O ' ' OXT' ' A' ' 75' ' ' GLN . 20.9 ttmm -56.12 -55.88 27.61 Favored 'General case' 0 N--CA 1.453 -0.322 0 C-N-CA 124.016 0.926 . . . . 0.0 110.36 171.835 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 1.2 mptm? -53.31 -45.15 68.89 Favored 'General case' 0 CA--C 1.536 0.413 0 N-CA-C 111.985 0.365 . . . . 0.0 111.985 176.276 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 73' ' ' ILE . . . . . . . . . . . . . 71.5 mt -55.84 -50.49 68.18 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.216 0 N-CA-C 108.539 -0.911 . . . . 0.0 108.539 175.29 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 6.0 m -76.74 47.2 0.49 Allowed 'General case' 0 CA--C 1.536 0.411 0 C-N-CA 124.743 1.217 . . . . 0.0 110.323 174.872 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 75' ' ' GLN . . . . . 1.016 ' OXT' ' O ' ' A' ' 71' ' ' LYS . 19.6 tt0 . . . . . 0 C--O 1.27 2.17 0 C-N-CA 123.937 0.895 . . . . 0.0 109.439 -168.52 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 1' ' ' LYS . . . . . 1.07 ' O ' ' OXT' ' A' ' 75' ' ' GLN . 11.7 mptt . . . . . 0 N--CA 1.45 -0.456 0 N-CA-C 108.889 -0.782 . . . . 0.0 108.889 . . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 2.0 p -96.89 168.98 9.39 Favored Pre-proline 0 C--O 1.238 0.477 0 N-CA-C 107.384 -1.339 . . . . 0.0 107.384 168.003 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 90.3 Cg_exo -45.69 -32.69 9.04 Favored 'Trans proline' 0 N--CA 1.455 -0.765 0 C-N-CA 123.451 2.768 . . . . 0.0 112.972 169.072 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 19.0 mt-10 -67.58 -49.0 65.23 Favored 'General case' 0 N--CA 1.455 -0.18 0 CA-C-O 121.302 0.572 . . . . 0.0 110.273 -178.145 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 5.6 mp0 -65.51 -43.18 90.9 Favored 'General case' 0 N--CA 1.452 -0.353 0 N-CA-C 107.835 -1.172 . . . . 0.0 107.835 178.821 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 14.7 mt -57.2 -37.81 72.73 Favored 'General case' 0 N--CA 1.452 -0.341 0 N-CA-C 112.321 0.489 . . . . 0.0 112.321 177.012 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 55.7 tptt -61.83 -51.15 69.44 Favored 'General case' 0 C--N 1.332 -0.152 0 CA-C-N 118.873 0.76 . . . . 0.0 110.967 170.366 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . -52.51 -50.76 46.8 Favored Glycine 0 CA--C 1.531 1.051 0 N-CA-C 110.521 -1.032 . . . . 0.0 110.521 179.869 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 9' ' ' ILE . . . . . . . . . . . . . 88.0 mt -54.79 -54.75 20.26 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.298 0 C-N-CA 126.663 1.985 . . . . 0.0 109.923 173.745 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 10' ' ' PHE . . . . . . . . . . . . . 52.0 t80 -48.63 -52.8 21.29 Favored 'General case' 0 N--CA 1.453 -0.279 0 CA-C-N 118.29 0.495 . . . . 0.0 109.807 179.081 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 52.5 mt-10 -61.26 -52.69 63.7 Favored 'General case' 0 N--CA 1.455 -0.221 0 C-N-CA 123.075 0.55 . . . . 0.0 110.271 -177.986 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 25.9 ttpt -47.79 -57.74 5.23 Favored 'General case' 0 CA--C 1.53 0.191 0 C-N-CA 124.624 1.17 . . . . 0.0 110.838 177.409 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 38.6 m-85 -75.28 -34.62 61.35 Favored 'General case' 0 N--CA 1.45 -0.474 0 CA-C-O 119.193 -0.432 . . . . 0.0 110.522 -170.105 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -57.31 -63.95 1.05 Allowed 'General case' 0 N--CA 1.453 -0.299 0 N-CA-C 109.422 -0.585 . . . . 0.0 109.422 170.87 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -51.49 -31.88 25.29 Favored 'General case' 0 CA--C 1.529 0.143 0 C-N-CA 125.311 1.445 . . . . 0.0 112.682 -177.154 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 21.2 ttmm -53.56 -29.56 37.68 Favored 'General case' 0 CA--C 1.536 0.416 0 C-N-CA 123.274 0.63 . . . . 0.0 112.486 -179.851 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 26.9 tt0 -141.93 -43.49 0.34 Allowed 'General case' 0 CA--C 1.532 0.287 0 CA-C-N 118.429 0.559 . . . . 0.0 111.909 -173.898 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . -110.41 -173.65 20.31 Favored Glycine 0 CA--C 1.526 0.731 0 C-N-CA 124.85 1.214 . . . . 0.0 111.279 -173.545 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 9.3 t70 -63.93 135.01 96.12 Favored Pre-proline 0 CA--C 1.536 0.404 0 CA-C-O 118.203 -0.904 . . . . 0.0 108.617 174.769 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 20' ' ' PRO . . . . . . . . . . . . . 11.9 Cg_endo -51.59 -24.94 18.4 Favored 'Trans proline' 0 CA--C 1.535 0.574 0 C-N-CA 123.656 2.904 . . . . 0.0 114.824 -176.499 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 58.0 m-80 -84.2 3.76 33.73 Favored 'General case' 0 CA--C 1.531 0.222 0 C-N-CA 124.008 0.923 . . . . 0.0 112.017 -178.021 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 0.7 OUTLIER -151.02 127.51 10.73 Favored 'General case' 0 N--CA 1.452 -0.368 0 O-C-N 121.395 -0.816 . . . . 0.0 112.629 -169.223 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 80.8 mt -93.44 129.43 39.61 Favored 'General case' 0 N--CA 1.452 -0.372 0 C-N-CA 122.883 0.473 . . . . 0.0 111.11 171.222 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 41.3 p -78.92 174.12 11.85 Favored 'General case' 0 CA--C 1.534 0.343 0 C-N-CA 124.255 1.022 . . . . 0.0 108.577 166.952 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 98.4 mttt -57.9 -44.84 87.0 Favored 'General case' 0 C--O 1.226 -0.153 0 O-C-N 121.837 -0.539 . . . . 0.0 110.483 172.408 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 24.3 mt-10 -66.73 -42.66 85.94 Favored 'General case' 0 N--CA 1.454 -0.253 0 CA-C-O 121.282 0.563 . . . . 0.0 110.168 -176.713 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 26.6 mt-10 -58.39 -49.42 77.31 Favored 'General case' 0 N--CA 1.451 -0.4 0 CA-C-N 115.738 -0.664 . . . . 0.0 109.211 176.152 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 10.7 mt -54.08 -42.73 69.65 Favored 'General case' 0 CA--C 1.512 -0.483 0 N-CA-C 113.28 0.845 . . . . 0.0 113.28 169.868 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 5.9 ttpm? -60.46 -53.04 62.33 Favored 'General case' 0 C--N 1.323 -0.554 0 CA-C-N 118.637 0.653 . . . . 0.0 109.845 -177.641 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 10.5 mp -59.16 -44.85 92.14 Favored 'General case' 0 C--O 1.235 0.301 0 CA-C-O 120.647 0.261 . . . . 0.0 111.294 178.433 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 6.5 tt -51.14 -57.89 7.56 Favored 'General case' 0 N--CA 1.456 -0.125 0 C-N-CA 123.682 0.793 . . . . 0.0 109.6 174.242 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 43.3 mt -54.86 -54.05 47.45 Favored 'General case' 0 N--CA 1.455 -0.203 0 C-N-CA 124.052 0.941 . . . . 0.0 109.956 -178.887 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 42.7 mt-30 -50.25 -53.11 30.61 Favored 'General case' 0 N--CA 1.457 -0.096 0 C-N-CA 123.098 0.559 . . . . 0.0 111.363 179.732 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 2.0 m -73.22 -49.64 26.83 Favored 'General case' 0 N--CA 1.454 -0.264 0 C-N-CA 120.28 -0.568 . . . . 0.0 111.259 -172.015 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 62.0 mm-40 -95.78 -31.02 13.39 Favored 'General case' 0 N--CA 1.449 -0.509 0 N-CA-C 113.382 0.882 . . . . 0.0 113.382 -166.644 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 67.9 m-85 -143.18 66.37 16.19 Favored Pre-proline 0 CA--C 1.536 0.415 0 N-CA-C 113.198 0.814 . . . . 0.0 113.198 -171.577 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 83.9 Cg_exo -48.7 -33.29 24.07 Favored 'Trans proline' 0 CA--C 1.535 0.568 0 C-N-CA 123.191 2.594 . . . . 0.0 112.598 168.884 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 2.8 p -53.97 -57.06 12.41 Favored 'General case' 0 N--CA 1.447 -0.58 0 C-N-CA 125.719 1.607 . . . . 0.0 109.497 176.657 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 79.1 mt -65.53 -39.88 92.3 Favored 'General case' 0 N--CA 1.452 -0.344 0 CA-C-N 115.51 -0.768 . . . . 0.0 111.117 177.75 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 13.2 tp -52.52 -49.44 64.82 Favored 'General case' 0 CA--C 1.529 0.169 0 CA-C-O 120.917 0.389 . . . . 0.0 110.2 177.798 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 61.5 mtpt -67.18 -53.06 33.91 Favored 'General case' 0 N--CA 1.451 -0.4 0 C-N-CA 123.309 0.644 . . . . 0.0 110.168 175.791 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . -76.24 57.75 3.24 Favored Glycine 0 CA--C 1.528 0.873 0 C-N-CA 124.856 1.217 . . . . 0.0 112.08 -177.567 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 43' ' ' GLY . . . . . . . . . . . . . . . -160.79 103.39 0.22 Allowed Glycine 0 CA--C 1.524 0.638 0 N-CA-C 108.311 -1.915 . . . . 0.0 108.311 179.32 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 44' ' ' SER . . . . . . . . . . . . . 3.4 m -41.73 -48.8 4.27 Favored 'General case' 0 CA--C 1.53 0.209 0 C-N-CA 125.442 1.497 . . . . 0.0 112.137 -174.535 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 68.8 p -145.93 154.52 42.03 Favored 'General case' 0 N--CA 1.45 -0.447 0 N-CA-C 105.733 -1.951 . . . . 0.0 105.733 166.646 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 20.9 mt -56.93 -42.37 79.9 Favored 'General case' 0 N--CA 1.452 -0.35 0 N-CA-C 107.961 -1.126 . . . . 0.0 107.961 172.604 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 5.3 m-20 -53.26 -57.07 11.82 Favored 'General case' 0 N--CA 1.449 -0.509 0 C-N-CA 124.812 1.245 . . . . 0.0 111.345 177.294 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 29.9 mm-40 -55.48 -45.88 76.95 Favored 'General case' 0 C--N 1.333 -0.135 0 O-C-N 122.438 -0.164 . . . . 0.0 110.924 177.447 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 1.1 tt -57.02 -50.0 74.08 Favored 'General case' 0 CA--C 1.537 0.46 0 CA-C-O 121.827 0.822 . . . . 0.0 109.854 178.306 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 50' ' ' PHE . . . . . . . . . . . . . 55.6 t80 -55.5 -50.64 69.39 Favored 'General case' 0 N--CA 1.45 -0.463 0 C-N-CA 125.078 1.351 . . . . 0.0 110.222 -179.195 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 74.6 mm-40 -59.38 -43.16 92.93 Favored 'General case' 0 N--CA 1.454 -0.229 0 CA-C-O 120.6 0.238 . . . . 0.0 111.317 176.185 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 7.7 tm-20 -54.26 -44.36 71.76 Favored 'General case' 0 CA--C 1.531 0.242 0 C-N-CA 122.374 0.27 . . . . 0.0 110.614 177.255 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 85.0 mt -69.43 -62.04 1.54 Allowed 'General case' 0 N--CA 1.453 -0.32 0 C-N-CA 122.436 0.295 . . . . 0.0 111.251 176.86 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 12.6 t0 -99.57 103.04 14.74 Favored 'General case' 0 N--CA 1.455 -0.192 0 C-N-CA 124.961 1.304 . . . . 0.0 109.39 178.999 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 45.3 mmtm -70.83 73.26 0.57 Allowed 'General case' 0 CA--C 1.535 0.368 0 CA-C-O 122.274 1.035 . . . . 0.0 111.728 176.771 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 56' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER 37.28 35.71 0.06 Allowed 'General case' 0 C--N 1.321 -0.644 0 C-N-CA 130.232 3.413 . . . . 0.0 114.606 -176.994 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . -83.41 -80.37 1.01 Allowed Glycine 0 CA--C 1.525 0.715 0 N-CA-C 111.016 -0.834 . . . . 0.0 111.016 -172.558 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 28.7 p-10 -91.73 -16.84 26.32 Favored 'General case' 0 CA--C 1.532 0.265 0 C-N-CA 125.142 1.377 . . . . 0.0 111.802 -178.532 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . 82.8 16.75 69.51 Favored Glycine 0 CA--C 1.529 0.938 0 CA-C-O 119.22 -0.767 . . . . 0.0 112.715 174.326 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 33.2 mt-10 -154.23 173.65 15.84 Favored 'General case' 0 CA--C 1.529 0.135 0 C-N-CA 127.2 2.2 . . . . 0.0 106.233 172.388 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 61' ' ' VAL . . . . . . . . . . . . . 46.6 t -112.1 108.63 25.99 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.318 0 CA-C-N 118.118 0.417 . . . . 0.0 110.591 -171.905 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 1.8 m -76.27 158.85 31.15 Favored 'General case' 0 CA--C 1.536 0.429 0 C-N-CA 125.517 1.527 . . . . 0.0 110.552 170.785 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 63' ' ' PHE . . . . . . . . . . . . . 54.7 t80 -53.12 -48.14 68.1 Favored 'General case' 0 CA--C 1.533 0.29 0 O-C-N 121.665 -0.647 . . . . 0.0 111.914 -174.47 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 2.8 pm0 -61.32 -25.46 67.15 Favored 'General case' 0 CA--C 1.537 0.458 0 N-CA-C 113.871 1.063 . . . . 0.0 113.871 -177.324 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 9.0 pt-20 -90.73 -37.81 13.45 Favored 'General case' 0 CA--C 1.532 0.279 0 CA-C-N 118.81 0.732 . . . . 0.0 109.225 174.977 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 9.5 t80 -51.5 -33.31 30.95 Favored 'General case' 0 CA--C 1.538 0.481 0 O-C-N 121.609 -0.682 . . . . 0.0 110.716 167.391 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 67' ' ' GLN . . . . . . . . . . . . . 60.5 mm-40 -54.09 -23.04 12.47 Favored 'General case' 0 CA--C 1.538 0.503 0 O-C-N 120.841 -1.162 . . . . 0.0 113.495 174.145 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 92.1 t -62.72 -34.46 65.65 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.584 0 CA-C-N 120.039 1.29 . . . . 0.0 110.304 171.454 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 9.1 tt -71.96 -42.29 66.74 Favored 'General case' 0 N--CA 1.456 -0.152 0 N-CA-C 107.402 -1.333 . . . . 0.0 107.402 177.505 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 70' ' ' VAL . . . . . . . . . . . . . 64.4 t -58.48 -41.25 81.2 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.271 0 O-C-N 121.908 -0.495 . . . . 0.0 111.148 173.942 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 51.0 tptt -54.2 -52.43 61.28 Favored 'General case' 0 CA--C 1.53 0.199 0 O-C-N 121.554 -0.716 . . . . 0.0 110.006 173.342 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 2.1 mptm? -51.27 -46.85 62.57 Favored 'General case' 0 CA--C 1.538 0.501 0 N-CA-C 112.149 0.426 . . . . 0.0 112.149 173.27 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 73' ' ' ILE . . . . . . . . . . . . . 76.8 mt -59.21 -38.78 76.4 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.491 0 O-C-N 121.785 -0.572 . . . . 0.0 110.667 175.101 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 36.7 p 68.87 -51.43 0.58 Allowed 'General case' 0 N--CA 1.455 -0.191 0 C-N-CA 129.044 2.937 . . . . 0.0 112.458 -170.722 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 75' ' ' GLN . . . . . 1.07 ' OXT' ' O ' ' A' ' 1' ' ' LYS . 50.2 mm-40 . . . . . 0 C--O 1.27 2.163 0 C-N-CA 123.776 0.83 . . . . 0.0 110.692 176.568 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 1' ' ' LYS . . . . . . . . . . . . . 36.2 mttp . . . . . 0 N--CA 1.452 -0.372 0 N-CA-C 108.562 -0.903 . . . . 0.0 108.562 . . . . . . . . . 0 0 . 1 . 020 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -83.53 159.93 60.23 Favored Pre-proline 0 CA--C 1.54 0.574 0 C-N-CA 124.035 0.934 . . . . 0.0 110.484 -179.143 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 53.4 Cg_exo -43.54 -47.94 8.96 Favored 'Trans proline' 0 C--N 1.348 0.539 0 C-N-CA 124.443 3.429 . . . . 0.0 114.989 -174.261 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 46.3 mt-10 -60.75 -41.3 95.14 Favored 'General case' 0 CA--C 1.532 0.265 0 CA-C-O 121.323 0.582 . . . . 0.0 111.293 179.989 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 10.4 mp0 -69.41 -42.24 75.32 Favored 'General case' 0 N--CA 1.451 -0.414 0 N-CA-C 107.633 -1.247 . . . . 0.0 107.633 -178.688 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 18.7 mt -58.24 -38.71 77.39 Favored 'General case' 0 N--CA 1.448 -0.539 0 CA-C-O 119.075 -0.488 . . . . 0.0 111.674 173.004 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 2.1 tmtt? -62.88 -48.67 77.99 Favored 'General case' 0 CA--C 1.533 0.297 0 CA-C-N 119.111 0.869 . . . . 0.0 109.955 173.844 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . -54.78 -51.51 52.41 Favored Glycine 0 CA--C 1.533 1.2 0 N-CA-C 111.092 -0.803 . . . . 0.0 111.092 177.946 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 9' ' ' ILE . . . . . . . . . . . . . 3.2 mm -56.27 -50.23 72.4 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.262 0 C-N-CA 125.714 1.606 . . . . 0.0 109.359 175.549 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 10' ' ' PHE . . . . . . . . . . . . . 25.6 t80 -51.66 -49.94 61.35 Favored 'General case' 0 N--CA 1.444 -0.745 0 O-C-N 121.689 -0.632 . . . . 0.0 109.3 178.126 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 68.8 mt-10 -60.6 -50.77 72.21 Favored 'General case' 0 CA--C 1.531 0.241 0 CA-C-O 119.065 -0.493 . . . . 0.0 111.36 178.836 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 20.3 tptm -39.79 -53.98 2.17 Favored 'General case' 0 N--CA 1.464 0.238 0 C-N-CA 124.568 1.147 . . . . 0.0 110.941 175.466 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 79.0 m-85 -81.9 -46.85 13.51 Favored 'General case' 0 N--CA 1.454 -0.235 0 N-CA-C 111.655 0.242 . . . . 0.0 111.655 -176.172 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -54.25 -38.19 65.5 Favored 'General case' 0 C--N 1.329 -0.311 0 C-N-CA 124.413 1.085 . . . . 0.0 112.309 -179.333 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -49.66 -34.96 19.89 Favored 'General case' 0 CA--C 1.534 0.362 0 C-N-CA 122.961 0.504 . . . . 0.0 111.697 174.132 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 60.5 mttm -71.11 -32.47 69.07 Favored 'General case' 0 CA--C 1.533 0.323 0 C-N-CA 123.144 0.578 . . . . 0.0 110.933 -179.948 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 22.3 tt0 -63.84 -48.12 78.05 Favored 'General case' 0 C--N 1.342 0.244 0 N-CA-C 107.625 -1.25 . . . . 0.0 107.625 169.702 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 138.82 -59.18 0.6 Allowed Glycine 0 CA--C 1.519 0.329 0 N-CA-C 108.622 -1.791 . . . . 0.0 108.622 177.982 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 32.4 t0 -72.77 111.15 10.13 Favored Pre-proline 0 CA--C 1.535 0.373 0 CA-C-O 118.351 -0.833 . . . . 0.0 108.931 176.55 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 20' ' ' PRO . . . . . . . . . . . . . 30.0 Cg_endo -58.85 -19.29 46.39 Favored 'Trans proline' 0 N--CA 1.458 -0.61 0 C-N-CA 122.207 1.938 . . . . 0.0 112.985 -178.884 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 40.6 m-80 -87.36 -4.93 59.05 Favored 'General case' 0 N--CA 1.453 -0.307 0 C-N-CA 125.032 1.333 . . . . 0.0 113.27 -176.778 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 29.8 tt0 -140.75 134.11 29.78 Favored 'General case' 0 CA--C 1.541 0.61 0 CA-C-N 119.109 0.868 . . . . 0.0 112.754 -170.713 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 81.8 mt -108.8 136.36 48.49 Favored 'General case' 0 C--N 1.344 0.361 0 C-N-CA 125.339 1.455 . . . . 0.0 111.426 178.09 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 73.0 p -81.09 174.81 11.22 Favored 'General case' 0 CA--C 1.532 0.263 0 C-N-CA 124.29 1.036 . . . . 0.0 109.388 168.794 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 98.3 mttt -57.13 -46.6 82.54 Favored 'General case' 0 C--O 1.226 -0.156 0 O-C-N 122.088 -0.382 . . . . 0.0 110.129 172.143 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 45.2 tt0 -64.53 -46.2 83.93 Favored 'General case' 0 N--CA 1.452 -0.348 0 N-CA-C 110.2 -0.296 . . . . 0.0 110.2 -177.037 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -59.33 -44.63 92.58 Favored 'General case' 0 N--CA 1.45 -0.433 0 C-N-CA 120.256 -0.577 . . . . 0.0 109.872 176.97 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 11.3 mt -56.77 -43.57 80.96 Favored 'General case' 0 CA--C 1.511 -0.538 0 CA-C-N 119.168 0.894 . . . . 0.0 113.014 170.865 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 63.0 tttm -59.96 -52.3 66.0 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-N 118.754 0.706 . . . . 0.0 109.483 -178.425 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 10.3 mp -58.31 -47.83 82.45 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 116.36 -0.382 . . . . 0.0 110.92 179.237 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 7.4 tt -50.64 -58.4 5.94 Favored 'General case' 0 N--CA 1.455 -0.19 0 C-N-CA 123.531 0.732 . . . . 0.0 109.83 175.331 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 47.7 mt -54.94 -57.7 10.59 Favored 'General case' 0 C--N 1.332 -0.174 0 C-N-CA 123.654 0.782 . . . . 0.0 109.448 -177.708 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 53.0 tt0 -61.55 -45.41 94.28 Favored 'General case' 0 N--CA 1.449 -0.499 0 C-N-CA 124.729 1.212 . . . . 0.0 111.169 -170.888 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 17.9 m -76.41 -48.75 18.7 Favored 'General case' 0 N--CA 1.451 -0.377 0 CA-C-N 116.341 -0.39 . . . . 0.0 110.738 -175.191 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 71.7 mm-40 -93.26 -32.5 14.31 Favored 'General case' 0 N--CA 1.449 -0.496 0 N-CA-C 112.646 0.61 . . . . 0.0 112.646 -168.108 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 85.7 m-85 -129.1 59.09 41.74 Favored Pre-proline 0 CA--C 1.53 0.203 0 C-N-CA 123.761 0.825 . . . . 0.0 110.668 -176.251 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 46.5 Cg_endo -57.24 -30.37 87.17 Favored 'Trans proline' 0 N--CA 1.456 -0.694 0 C-N-CA 122.446 2.097 . . . . 0.0 110.901 -178.505 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -57.81 -27.66 63.34 Favored 'General case' 0 N--CA 1.449 -0.48 0 C-N-CA 126.334 1.854 . . . . 0.0 111.648 -178.187 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 45.8 mt -74.86 -26.85 59.98 Favored 'General case' 0 N--CA 1.451 -0.424 0 C-N-CA 123.298 0.639 . . . . 0.0 111.393 178.719 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 8.4 mp -78.98 78.69 5.4 Favored 'General case' 0 N--CA 1.457 -0.118 0 CA-C-O 122.868 1.318 . . . . 0.0 109.949 -177.662 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 25.9 mtpp -107.62 -65.81 1.08 Allowed 'General case' 0 C--N 1.319 -0.723 0 C-N-CA 127.705 2.402 . . . . 0.0 108.632 178.491 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . 157.12 164.44 13.63 Favored Glycine 0 CA--C 1.526 0.736 0 N-CA-C 106.888 -2.485 . . . . 0.0 106.888 -173.342 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 43' ' ' GLY . . . . . . . . . . . . . . . 141.63 -153.31 24.04 Favored Glycine 0 CA--C 1.524 0.621 0 N-CA-C 108.167 -1.973 . . . . 0.0 108.167 -175.25 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 44' ' ' SER . . . . . . . . . . . . . 2.3 m -53.14 144.33 15.86 Favored 'General case' 0 N--CA 1.451 -0.379 0 C-N-CA 123.876 0.871 . . . . 0.0 110.858 173.279 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 75.3 p -60.66 157.53 14.41 Favored 'General case' 0 CA--C 1.53 0.207 0 O-C-N 122.358 -0.214 . . . . 0.0 110.718 178.569 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 59.5 tp -47.26 -43.15 21.83 Favored 'General case' 0 C--O 1.223 -0.307 0 C-N-CA 123.29 0.636 . . . . 0.0 110.517 169.14 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 5.4 m-20 -57.84 -56.5 21.22 Favored 'General case' 0 N--CA 1.452 -0.367 0 C-N-CA 124.16 0.984 . . . . 0.0 111.132 178.182 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 33.4 mt-10 -54.63 -45.7 73.79 Favored 'General case' 0 CA--C 1.53 0.187 0 CA-C-O 120.883 0.373 . . . . 0.0 110.93 176.614 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -57.88 -51.54 69.17 Favored 'General case' 0 CA--C 1.532 0.263 0 N-CA-C 109.17 -0.678 . . . . 0.0 109.17 179.596 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 50' ' ' PHE . . . . . . . . . . . . . 68.8 t80 -53.32 -50.41 65.03 Favored 'General case' 0 N--CA 1.453 -0.307 0 C-N-CA 125.143 1.377 . . . . 0.0 110.404 178.667 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 33.1 mt-10 -55.73 -48.91 74.41 Favored 'General case' 0 CA--C 1.531 0.222 0 C-N-CA 122.974 0.51 . . . . 0.0 110.658 176.799 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 33.4 tp10 -55.99 -45.43 78.98 Favored 'General case' 0 CA--C 1.531 0.214 0 C-N-CA 123.184 0.593 . . . . 0.0 111.375 177.284 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 32.0 mt -66.32 -45.09 81.51 Favored 'General case' 0 N--CA 1.45 -0.45 0 O-C-N 122.054 -0.404 . . . . 0.0 111.778 179.138 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 51.9 t0 -74.25 59.41 0.76 Allowed 'General case' 0 CA--C 1.539 0.542 0 C-N-CA 124.961 1.305 . . . . 0.0 111.315 -174.185 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 70.4 mmtt -55.19 -39.34 69.49 Favored 'General case' 0 CA--C 1.529 0.164 0 C-N-CA 124.705 1.202 . . . . 0.0 112.456 -178.533 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 56' ' ' ASN . . . . . . . . . . . . . 26.8 p30 -73.69 -10.86 60.12 Favored 'General case' 0 CA--C 1.536 0.421 0 N-CA-C 112.115 0.413 . . . . 0.0 112.115 179.891 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . 61.59 32.49 81.54 Favored Glycine 0 CA--C 1.53 0.989 0 C-N-CA 123.894 0.759 . . . . 0.0 113.192 178.956 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 1.2 p30 -77.74 -12.93 60.02 Favored 'General case' 0 CA--C 1.531 0.237 0 CA-C-N 118.94 1.37 . . . . 0.0 111.906 -179.702 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . 103.65 -8.12 50.88 Favored Glycine 0 CA--C 1.527 0.814 0 CA-C-O 119.165 -0.797 . . . . 0.0 112.326 176.918 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 50.4 mt-10 -145.03 173.33 11.98 Favored 'General case' 0 N--CA 1.453 -0.287 0 C-N-CA 127.648 2.379 . . . . 0.0 106.859 174.985 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 61' ' ' VAL . . . . . . . . . . . . . 3.7 t -108.77 112.3 39.83 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.174 0 N-CA-C 109.767 -0.456 . . . . 0.0 109.767 -171.186 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 78.1 p -78.62 158.21 28.5 Favored 'General case' 0 CA--C 1.536 0.438 0 C-N-CA 122.804 0.441 . . . . 0.0 110.874 176.369 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 63' ' ' PHE . . . . . . . . . . . . . 69.6 t80 -55.21 -34.09 63.62 Favored 'General case' 0 N--CA 1.468 0.458 0 N-CA-C 113.248 0.833 . . . . 0.0 113.248 -177.81 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 45.7 mm-40 -65.2 -60.37 3.08 Favored 'General case' 0 N--CA 1.451 -0.424 0 O-C-N 121.85 -0.531 . . . . 0.0 109.822 179.735 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 12.8 pt-20 -66.1 -28.45 68.83 Favored 'General case' 0 CA--C 1.537 0.462 0 O-C-N 121.14 -0.975 . . . . 0.0 111.391 -177.421 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 15.9 t80 -51.85 -25.58 8.15 Favored 'General case' 0 CA--C 1.536 0.406 0 C-N-CA 123.8 0.84 . . . . 0.0 112.345 169.016 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 67' ' ' GLN . . . . . . . . . . . . . 59.3 mm-40 -54.09 -25.62 22.82 Favored 'General case' 0 CA--C 1.541 0.607 0 CA-C-N 119.532 1.06 . . . . 0.0 112.859 172.593 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 97.0 t -56.4 -33.93 39.62 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.543 0 O-C-N 121.369 -0.832 . . . . 0.0 110.853 171.626 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 25.1 tp -75.04 -47.65 27.93 Favored 'General case' 0 N--CA 1.457 -0.108 0 N-CA-C 107.993 -1.114 . . . . 0.0 107.993 175.159 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 70' ' ' VAL . . . . . . . . . . . . . 84.5 t -52.31 -37.68 23.63 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.242 0 C-N-CA 122.46 0.304 . . . . 0.0 111.112 -179.793 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 71' ' ' LYS . . . . . 0.774 ' O ' ' OXT' ' A' ' 75' ' ' GLN . 21.3 ttmm -53.01 -57.72 9.4 Favored 'General case' 0 CA--C 1.531 0.234 0 C-N-CA 123.011 0.524 . . . . 0.0 111.291 171.365 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 13.6 mptt -55.43 -44.79 76.6 Favored 'General case' 0 CA--C 1.531 0.234 0 C-N-CA 122.608 0.363 . . . . 0.0 111.181 177.54 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 73' ' ' ILE . . . . . . . . . . . . . 65.9 mt -56.74 -47.79 82.03 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.338 0 N-CA-C 109.047 -0.723 . . . . 0.0 109.047 177.301 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 8.8 m -77.43 50.09 0.77 Allowed 'General case' 0 CA--C 1.534 0.345 0 C-N-CA 124.816 1.247 . . . . 0.0 109.644 174.712 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 75' ' ' GLN . . . . . 0.774 ' OXT' ' O ' ' A' ' 71' ' ' LYS . 0.9 OUTLIER . . . . . 0 C--O 1.27 2.132 0 C-N-CA 123.828 0.851 . . . . 0.0 109.105 -168.688 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 1' ' ' LYS . . . . . . . . . . . . . 1.7 mptp? . . . . . 0 N--CA 1.45 -0.464 0 N-CA-C 108.466 -0.939 . . . . 0.0 108.466 . . . . . . . . . 0 0 . 1 . 021 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 17.1 p -88.2 170.39 11.56 Favored Pre-proline 0 CA--C 1.537 0.454 0 N-CA-C 107.842 -1.17 . . . . 0.0 107.842 169.15 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 96.0 Cg_exo -45.36 -38.85 15.88 Favored 'Trans proline' 0 N--CA 1.458 -0.618 0 C-N-CA 123.512 2.808 . . . . 0.0 113.038 176.158 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 35.1 tt0 -62.67 -45.14 94.17 Favored 'General case' 0 N--CA 1.454 -0.266 0 C-N-CA 122.82 0.448 . . . . 0.0 111.464 178.839 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 6.9 mp0 -70.34 -40.86 73.85 Favored 'General case' 0 N--CA 1.451 -0.405 0 N-CA-C 108.35 -0.982 . . . . 0.0 108.35 179.532 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 7.3 mt -56.3 -38.35 71.14 Favored 'General case' 0 N--CA 1.452 -0.336 0 C-N-CA 122.786 0.434 . . . . 0.0 111.751 175.03 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 22.8 tptm -61.8 -54.31 44.07 Favored 'General case' 0 C--N 1.333 -0.144 0 CA-C-N 118.961 0.801 . . . . 0.0 111.083 170.508 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . -49.87 -48.71 37.05 Favored Glycine 0 CA--C 1.534 1.254 0 N-CA-C 111.202 -0.759 . . . . 0.0 111.202 178.846 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 9' ' ' ILE . . . . . . . . . . . . . 2.8 mm -59.59 -54.44 34.46 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.315 0 C-N-CA 127.156 2.182 . . . . 0.0 109.209 176.999 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 10' ' ' PHE . . . . . . . . . . . . . 55.8 t80 -46.96 -53.07 13.15 Favored 'General case' 0 N--CA 1.45 -0.45 0 N-CA-C 109.45 -0.574 . . . . 0.0 109.45 177.744 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 50.4 mt-10 -59.72 -52.67 64.48 Favored 'General case' 0 N--CA 1.454 -0.251 0 C-N-CA 123.015 0.526 . . . . 0.0 110.55 179.666 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 44.5 tttp -44.13 -52.82 6.97 Favored 'General case' 0 CA--C 1.528 0.12 0 C-N-CA 124.567 1.147 . . . . 0.0 111.307 178.375 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 69.9 m-85 -78.39 -46.41 20.0 Favored 'General case' 0 CA--C 1.532 0.287 0 C-N-CA 121.182 -0.207 . . . . 0.0 110.877 -175.88 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -56.59 -31.94 64.74 Favored 'General case' 0 CA--C 1.535 0.382 0 C-N-CA 125.019 1.327 . . . . 0.0 112.583 -179.778 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -65.07 -27.83 69.05 Favored 'General case' 0 N--CA 1.452 -0.373 0 O-C-N 121.68 -0.638 . . . . 0.0 112.419 176.095 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 98.3 mttt -64.43 -50.7 66.53 Favored 'General case' 0 C--N 1.341 0.221 0 CA-C-N 119.388 0.995 . . . . 0.0 112.122 -169.506 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 26.2 tt0 -71.6 -22.93 61.65 Favored 'General case' 0 CA--C 1.533 0.289 0 O-C-N 122.215 -0.303 . . . . 0.0 110.283 175.394 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 102.51 30.85 5.44 Favored Glycine 0 C--N 1.337 0.62 0 C-N-CA 124.488 1.042 . . . . 0.0 111.188 175.739 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 65.4 t0 -128.25 67.71 75.61 Favored Pre-proline 0 N--CA 1.452 -0.371 0 N-CA-C 108.323 -0.992 . . . . 0.0 108.323 176.619 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 20' ' ' PRO . . . . . . . . . . . . . 18.9 Cg_endo -52.92 -26.68 32.31 Favored 'Trans proline' 0 CA--C 1.534 0.499 0 C-N-CA 123.315 2.676 . . . . 0.0 113.621 -172.955 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 69.0 m-80 -79.83 -20.18 46.67 Favored 'General case' 0 N--CA 1.452 -0.367 0 C-N-CA 124.306 1.042 . . . . 0.0 113.075 -178.541 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 12.0 tt0 -154.13 124.32 6.9 Favored 'General case' 0 CA--C 1.538 0.481 0 CA-C-N 119.147 0.885 . . . . 0.0 112.631 -168.098 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 42.6 mt -81.65 141.2 33.87 Favored 'General case' 0 C--O 1.234 0.276 0 C-N-CA 124.083 0.953 . . . . 0.0 112.101 -177.775 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 90.5 p -86.57 173.08 9.8 Favored 'General case' 0 CA--C 1.537 0.442 0 C-N-CA 124.42 1.088 . . . . 0.0 109.373 167.312 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 92.9 mttt -55.0 -44.18 74.27 Favored 'General case' 0 C--O 1.225 -0.224 0 O-C-N 121.814 -0.554 . . . . 0.0 110.731 173.685 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 46.4 mp0 -66.02 -50.27 64.82 Favored 'General case' 0 N--CA 1.45 -0.443 0 CA-C-O 121.389 0.614 . . . . 0.0 109.769 -174.136 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 65.5 mt-10 -53.13 -48.88 67.54 Favored 'General case' 0 N--CA 1.451 -0.376 0 CA-C-N 114.874 -1.057 . . . . 0.0 109.867 174.131 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 11.5 mt -57.18 -40.67 77.81 Favored 'General case' 0 CA--C 1.514 -0.418 0 N-CA-C 113.386 0.884 . . . . 0.0 113.386 172.959 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 5.1 ttpm? -63.23 -49.72 73.05 Favored 'General case' 0 C--N 1.322 -0.601 0 CA-C-N 118.817 0.735 . . . . 0.0 109.836 -177.572 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 4.1 mm? -60.01 -48.52 81.38 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.752 177.369 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 8.6 tt -50.26 -56.81 9.59 Favored 'General case' 0 N--CA 1.456 -0.143 0 C-N-CA 123.869 0.867 . . . . 0.0 109.568 175.476 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 39.1 mt -55.73 -58.63 7.02 Favored 'General case' 0 C--N 1.331 -0.22 0 C-N-CA 123.696 0.798 . . . . 0.0 109.58 -178.809 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 23.0 tt0 -55.9 -47.48 77.38 Favored 'General case' 0 N--CA 1.452 -0.328 0 C-N-CA 123.231 0.612 . . . . 0.0 111.337 -174.171 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 12.7 m -76.98 -45.82 26.12 Favored 'General case' 0 N--CA 1.451 -0.381 0 CA-C-N 116.224 -0.444 . . . . 0.0 111.229 -172.538 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 71.3 mm-40 -97.35 -33.37 11.45 Favored 'General case' 0 N--CA 1.451 -0.42 0 N-CA-C 112.685 0.624 . . . . 0.0 112.685 -168.32 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 54.2 m-85 -138.37 61.85 27.64 Favored Pre-proline 0 C--O 1.236 0.343 0 C-N-CA 123.521 0.728 . . . . 0.0 111.409 -174.408 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 57.1 Cg_endo -61.39 -25.29 79.87 Favored 'Trans proline' 0 N--CA 1.455 -0.781 0 C-N-CA 122.549 2.166 . . . . 0.0 110.682 176.354 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 2.7 p -51.12 -56.81 10.8 Favored 'General case' 0 N--CA 1.448 -0.543 0 C-N-CA 125.976 1.711 . . . . 0.0 109.247 170.337 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 39.5 mt -66.65 -40.02 88.49 Favored 'General case' 0 N--CA 1.454 -0.268 0 C-N-CA 123.51 0.724 . . . . 0.0 111.315 177.422 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 9.1 tp -51.77 -48.74 63.62 Favored 'General case' 0 CA--C 1.529 0.167 0 CA-C-O 120.75 0.31 . . . . 0.0 110.356 178.919 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 36.4 mtmm -71.98 -65.2 0.8 Allowed 'General case' 0 N--CA 1.45 -0.426 0 CA-C-O 121.738 0.78 . . . . 0.0 110.199 174.845 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . -77.29 65.53 3.04 Favored Glycine 0 CA--C 1.525 0.668 0 C-N-CA 125.019 1.295 . . . . 0.0 110.866 -176.97 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 43' ' ' GLY . . . . . . . . . . . . . . . -151.5 -110.42 0.47 Allowed Glycine 0 CA--C 1.524 0.608 0 N-CA-C 109.679 -1.368 . . . . 0.0 109.679 177.133 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 44' ' ' SER . . . . . . . . . . . . . 32.8 t -171.09 -160.53 0.19 Allowed 'General case' 0 N--CA 1.453 -0.297 0 N-CA-C 105.969 -1.864 . . . . 0.0 105.969 178.033 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 53.1 p -60.1 145.97 44.76 Favored 'General case' 0 N--CA 1.454 -0.25 0 CA-C-O 121.193 0.521 . . . . 0.0 110.061 177.042 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 52.0 tp -49.24 -43.54 42.87 Favored 'General case' 0 C--O 1.224 -0.249 0 CA-C-N 116.0 -0.545 . . . . 0.0 110.058 171.335 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 6.6 m-20 -53.16 -61.18 2.47 Favored 'General case' 0 N--CA 1.448 -0.563 0 C-N-CA 124.053 0.941 . . . . 0.0 110.588 175.7 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 25.5 mt-10 -51.33 -49.89 60.52 Favored 'General case' 0 C--N 1.332 -0.169 0 N-CA-C 111.308 0.114 . . . . 0.0 111.308 178.765 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 8.8 mp -55.87 -48.08 76.2 Favored 'General case' 0 C--N 1.334 -0.105 0 CA-C-O 120.747 0.308 . . . . 0.0 110.454 178.032 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 50' ' ' PHE . . . . . . . . . . . . . 63.8 t80 -58.34 -48.94 78.95 Favored 'General case' 0 N--CA 1.448 -0.533 0 C-N-CA 123.198 0.599 . . . . 0.0 110.481 -178.989 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 1.2 mp0 -56.77 -50.27 72.8 Favored 'General case' 0 N--CA 1.455 -0.224 0 N-CA-C 110.51 -0.182 . . . . 0.0 110.51 176.854 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 39.1 mt-10 -54.04 -47.18 71.86 Favored 'General case' 0 CA--C 1.529 0.166 0 CA-C-O 121.1 0.476 . . . . 0.0 110.972 178.597 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 90.8 mt -68.96 -42.38 76.71 Favored 'General case' 0 N--CA 1.451 -0.424 0 C-N-CA 123.509 0.724 . . . . 0.0 111.931 -177.05 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 52.5 t0 -73.65 64.66 0.92 Allowed 'General case' 0 CA--C 1.537 0.461 0 C-N-CA 124.286 1.034 . . . . 0.0 111.31 -175.545 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 32.6 mmtp -76.41 71.92 3.11 Favored 'General case' 0 N--CA 1.453 -0.291 0 CA-C-O 122.694 1.235 . . . . 0.0 110.087 168.883 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 56' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -167.17 -47.85 0.02 OUTLIER 'General case' 0 C--N 1.322 -0.628 0 C-N-CA 127.725 2.41 . . . . 0.0 108.527 173.693 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . 101.95 4.29 51.39 Favored Glycine 0 CA--C 1.531 1.043 0 CA-C-O 118.988 -0.896 . . . . 0.0 114.553 170.31 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 5.3 p-10 -77.29 -0.21 24.58 Favored 'General case' 0 CA--C 1.532 0.273 0 CA-C-N 119.653 1.726 . . . . 0.0 112.584 -179.827 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . 77.45 38.02 29.75 Favored Glycine 0 CA--C 1.525 0.661 0 CA-C-O 119.256 -0.747 . . . . 0.0 111.37 176.996 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 35.3 mt-10 -161.07 173.43 15.21 Favored 'General case' 0 CA--C 1.533 0.322 0 C-N-CA 127.696 2.398 . . . . 0.0 106.809 169.82 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 61' ' ' VAL . . . . . . . . . . . . . 3.4 t -129.08 108.76 17.51 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.516 0 CA-C-N 118.469 0.577 . . . . 0.0 112.125 -172.418 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 75.7 m -77.82 163.76 25.79 Favored 'General case' 0 CA--C 1.538 0.483 0 C-N-CA 124.467 1.107 . . . . 0.0 111.512 173.813 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 63' ' ' PHE . . . . . . . . . . . . . 61.7 t80 -59.69 -38.26 81.08 Favored 'General case' 0 CA--C 1.534 0.353 0 N-CA-C 113.028 0.751 . . . . 0.0 113.028 -172.806 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 50.0 mt-10 -61.74 -59.57 4.97 Favored 'General case' 0 CA--C 1.532 0.256 0 O-C-N 121.902 -0.499 . . . . 0.0 110.167 -179.067 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 16.6 pt-20 -61.55 -35.94 79.19 Favored 'General case' 0 CA--C 1.539 0.536 0 O-C-N 121.458 -0.776 . . . . 0.0 111.644 178.561 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 18.5 t80 -52.74 -22.89 5.77 Favored 'General case' 0 CA--C 1.536 0.426 0 C-N-CA 123.703 0.801 . . . . 0.0 112.439 169.932 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 67' ' ' GLN . . . . . . . . . . . . . 34.2 mm-40 -53.69 -21.55 7.25 Favored 'General case' 0 CA--C 1.537 0.453 0 CA-C-N 119.789 1.177 . . . . 0.0 113.001 171.063 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 70.8 t -55.49 -36.7 42.49 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.651 0 CA-C-N 119.886 1.221 . . . . 0.0 110.464 169.454 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 12.4 tp -72.59 -44.22 62.31 Favored 'General case' 0 N--CA 1.457 -0.108 0 N-CA-C 108.061 -1.088 . . . . 0.0 108.061 177.662 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 70' ' ' VAL . . . . . . . . . . . . . 54.3 t -54.04 -40.04 44.04 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.36 0 N-CA-C 110.157 -0.312 . . . . 0.0 110.157 175.946 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 21.4 ttmm -59.8 -56.62 19.48 Favored 'General case' 0 CA--C 1.53 0.193 0 C-N-CA 123.297 0.639 . . . . 0.0 110.799 171.433 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 2.6 mptm? -48.64 -34.5 11.87 Favored 'General case' 0 CA--C 1.539 0.527 0 N-CA-C 112.583 0.586 . . . . 0.0 112.583 175.837 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 73' ' ' ILE . . . . . . . . . . . . . 27.9 mm -72.39 -66.08 0.6 Allowed 'Isoleucine or valine' 0 CA--C 1.533 0.323 0 CA-C-N 118.423 0.556 . . . . 0.0 110.583 173.288 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 74' ' ' SER . . . . . 0.702 ' O ' ' OXT' ' A' ' 75' ' ' GLN . 61.3 p -63.17 -35.22 79.57 Favored 'General case' 0 C--N 1.332 -0.169 0 N-CA-C 113.885 1.068 . . . . 0.0 113.885 -168.342 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 75' ' ' GLN . . . . . 0.702 ' OXT' ' O ' ' A' ' 74' ' ' SER . 35.3 mt-30 . . . . . 0 C--O 1.27 2.15 0 C-N-CA 125.078 1.351 . . . . 0.0 111.744 175.184 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 1' ' ' LYS . . . . . . . . . . . . . 9.4 mptt . . . . . 0 N--CA 1.45 -0.452 0 N-CA-C 107.46 -1.311 . . . . 0.0 107.46 . . . . . . . . . 0 0 . 1 . 022 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 6.3 p -71.79 156.94 90.56 Favored Pre-proline 0 CA--C 1.536 0.442 0 CA-C-O 118.834 -0.603 . . . . 0.0 109.41 176.737 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 85.1 Cg_exo -44.78 -42.7 15.08 Favored 'Trans proline' 0 N--CA 1.46 -0.495 0 C-N-CA 123.491 2.794 . . . . 0.0 113.665 177.95 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 3.2 mp0 -58.13 -48.92 78.74 Favored 'General case' 0 N--CA 1.456 -0.135 0 C-N-CA 123.88 0.872 . . . . 0.0 111.531 176.893 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 58.5 mm-40 -66.38 -38.5 87.68 Favored 'General case' 0 N--CA 1.448 -0.565 0 N-CA-C 109.085 -0.709 . . . . 0.0 109.085 179.343 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 48.2 mt -62.32 -35.62 79.62 Favored 'General case' 0 N--CA 1.451 -0.415 0 C-N-CA 123.436 0.694 . . . . 0.0 112.536 174.877 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 23.4 tptm -61.07 -49.18 78.39 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 118.88 0.764 . . . . 0.0 109.599 169.045 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . -49.7 -51.57 27.94 Favored Glycine 0 CA--C 1.534 1.22 0 N-CA-C 111.092 -0.803 . . . . 0.0 111.092 176.055 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 9' ' ' ILE . . . . . . . . . . . . . 2.8 mm -58.12 -54.22 35.2 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.241 0 C-N-CA 126.28 1.832 . . . . 0.0 109.327 177.117 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 10' ' ' PHE . . . . . . . . . . . . . 50.6 t80 -47.9 -52.21 20.21 Favored 'General case' 0 N--CA 1.449 -0.476 0 C-N-CA 123.503 0.721 . . . . 0.0 109.219 178.693 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 52.0 mt-10 -61.22 -51.4 69.16 Favored 'General case' 0 CA--C 1.532 0.281 0 C-N-CA 123.063 0.545 . . . . 0.0 110.553 179.724 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 37.7 tttm -45.1 -53.26 8.19 Favored 'General case' 0 C--N 1.338 0.108 0 C-N-CA 124.42 1.088 . . . . 0.0 111.124 177.981 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 68.2 m-85 -78.6 -43.78 25.58 Favored 'General case' 0 N--CA 1.454 -0.24 0 C-N-CA 121.041 -0.264 . . . . 0.0 110.97 -175.832 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -58.55 -28.73 65.76 Favored 'General case' 0 CA--C 1.532 0.284 0 C-N-CA 124.181 0.992 . . . . 0.0 112.228 179.779 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -58.6 -32.7 69.23 Favored 'General case' 0 N--CA 1.452 -0.342 0 C-N-CA 122.999 0.519 . . . . 0.0 112.191 174.106 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 3.9 mptp? -64.25 151.5 43.47 Favored 'General case' 0 CA--C 1.532 0.287 0 N-CA-C 108.591 -0.892 . . . . 0.0 108.591 178.871 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 37.2 mt-10 68.87 -60.43 0.45 Allowed 'General case' 0 CA--C 1.532 0.28 0 C-N-CA 125.834 1.654 . . . . 0.0 109.672 -168.34 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 139.02 50.61 0.05 OUTLIER Glycine 0 CA--C 1.524 0.599 0 C-N-CA 124.756 1.169 . . . . 0.0 111.927 169.285 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 44.7 t0 -135.51 64.51 58.73 Favored Pre-proline 0 C--N 1.34 0.185 0 CA-C-N 118.467 1.133 . . . . 0.0 110.782 177.094 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 20' ' ' PRO . . . . . . . . . . . . . 12.8 Cg_endo -50.38 -23.57 10.49 Favored 'Trans proline' 0 CA--C 1.537 0.656 0 C-N-CA 123.846 3.03 . . . . 0.0 114.385 -177.312 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -80.84 -25.26 37.85 Favored 'General case' 0 N--CA 1.451 -0.42 0 C-N-CA 125.591 1.556 . . . . 0.0 111.814 -174.685 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 59.1 tt0 -153.33 121.62 6.22 Favored 'General case' 0 N--CA 1.451 -0.409 0 N-CA-C 110.013 -0.366 . . . . 0.0 110.013 -165.9 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 50.0 mt -77.65 131.81 37.93 Favored 'General case' 0 N--CA 1.449 -0.511 0 N-CA-C 109.338 -0.616 . . . . 0.0 109.338 -174.798 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 50.9 p -75.2 167.02 22.71 Favored 'General case' 0 N--CA 1.448 -0.538 0 N-CA-C 108.448 -0.945 . . . . 0.0 108.448 169.038 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 30.9 ttmt -58.06 -37.84 75.18 Favored 'General case' 0 CA--C 1.538 0.505 0 O-C-N 121.984 -0.448 . . . . 0.0 110.104 173.963 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 24.6 mt-10 -67.68 -47.2 70.15 Favored 'General case' 0 N--CA 1.455 -0.212 0 O-C-N 121.529 -0.732 . . . . 0.0 110.667 179.008 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 23.7 mt-10 -57.49 -44.7 85.16 Favored 'General case' 0 CA--C 1.534 0.364 0 N-CA-C 109.525 -0.546 . . . . 0.0 109.525 177.455 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 15.3 mt -54.0 -48.23 70.64 Favored 'General case' 0 CA--C 1.508 -0.646 0 CA-C-N 118.317 0.508 . . . . 0.0 112.192 169.205 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 52.4 tttp -60.64 -43.12 97.91 Favored 'General case' 0 C--N 1.322 -0.593 0 CA-C-N 118.602 0.637 . . . . 0.0 110.268 -176.505 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 87.7 mt -60.88 -52.01 66.88 Favored 'General case' 0 C--N 1.328 -0.355 0 O-C-N 122.18 -0.325 . . . . 0.0 111.324 175.263 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 7.1 tt -48.15 -58.22 4.81 Favored 'General case' 0 C--N 1.334 -0.108 0 C-N-CA 124.38 1.072 . . . . 0.0 109.27 175.887 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 46.6 mt -59.14 -54.16 50.15 Favored 'General case' 0 N--CA 1.449 -0.512 0 C-N-CA 123.96 0.904 . . . . 0.0 109.868 -175.6 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 25.7 mt-30 -56.55 -48.91 76.31 Favored 'General case' 0 C--O 1.227 -0.13 0 CA-C-N 118.548 0.613 . . . . 0.0 110.996 -177.515 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 11.2 m -72.36 -47.52 48.88 Favored 'General case' 0 N--CA 1.453 -0.298 0 CA-C-N 116.325 -0.398 . . . . 0.0 110.691 -171.983 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 76.3 mm-40 -91.77 -33.4 15.01 Favored 'General case' 0 N--CA 1.451 -0.425 0 C-N-CA 123.553 0.741 . . . . 0.0 112.295 -169.438 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 79.8 m-85 -142.74 63.44 13.88 Favored Pre-proline 0 CA--C 1.539 0.54 0 C-N-CA 123.969 0.907 . . . . 0.0 112.857 -171.105 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 88.9 Cg_exo -43.83 -39.17 10.44 Favored 'Trans proline' 0 CA--C 1.534 0.504 0 C-N-CA 123.734 2.956 . . . . 0.0 114.053 176.297 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 1.5 m -60.5 -43.25 97.25 Favored 'General case' 0 N--CA 1.448 -0.561 0 C-N-CA 124.502 1.121 . . . . 0.0 110.9 -169.824 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 40.1 mt -56.53 -29.94 62.5 Favored 'General case' 0 CA--C 1.53 0.199 0 C-N-CA 124.754 1.222 . . . . 0.0 112.9 -169.822 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 9.8 mp -58.22 -35.4 71.62 Favored 'General case' 0 CA--C 1.533 0.291 0 C-N-CA 122.576 0.351 . . . . 0.0 110.802 176.771 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 58.7 mtmt -105.77 -68.76 0.85 Allowed 'General case' 0 N--CA 1.449 -0.504 0 C-N-CA 125.39 1.476 . . . . 0.0 109.187 -176.559 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . -76.53 64.31 2.92 Favored Glycine 0 CA--C 1.525 0.669 0 N-CA-C 109.393 -1.483 . . . . 0.0 109.393 175.718 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 43' ' ' GLY . . . . . . . . . . . . . . . 174.96 -89.77 0.08 OUTLIER Glycine 0 N--CA 1.449 -0.451 0 N-CA-C 108.378 -1.889 . . . . 0.0 108.378 179.494 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 44' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -177.56 165.65 2.15 Favored 'General case' 0 N--CA 1.448 -0.554 0 C-N-CA 124.13 0.972 . . . . 0.0 108.897 -177.885 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 69.5 p -70.34 163.35 26.78 Favored 'General case' 0 CA--C 1.532 0.267 0 CA-C-O 121.65 0.738 . . . . 0.0 110.772 179.298 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 49.3 tp -51.13 -51.6 52.02 Favored 'General case' 0 N--CA 1.454 -0.27 0 C-N-CA 124.074 0.95 . . . . 0.0 111.833 177.735 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 13.5 m-20 -59.48 -49.41 77.91 Favored 'General case' 0 N--CA 1.45 -0.458 0 C-N-CA 123.104 0.561 . . . . 0.0 109.908 -177.627 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 47.8 mt-10 -51.94 -53.13 44.78 Favored 'General case' 0 N--CA 1.454 -0.253 0 CA-C-N 116.357 -0.383 . . . . 0.0 110.644 174.413 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 6.0 mp -53.6 -52.44 59.81 Favored 'General case' 0 CA--C 1.527 0.068 0 CA-C-O 121.256 0.551 . . . . 0.0 110.428 178.304 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 50' ' ' PHE . . . . . . . . . . . . . 39.3 t80 -55.76 -45.37 78.08 Favored 'General case' 0 N--CA 1.446 -0.647 0 O-C-N 122.015 -0.428 . . . . 0.0 110.584 -178.065 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 35.5 mt-10 -67.6 -40.76 84.74 Favored 'General case' 0 N--CA 1.456 -0.17 0 CA-C-N 118.237 0.471 . . . . 0.0 112.069 179.67 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 30.8 mt-10 -53.15 -46.95 69.09 Favored 'General case' 0 N--CA 1.456 -0.128 0 C-N-CA 122.964 0.506 . . . . 0.0 110.147 174.326 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 76.2 mt -80.85 -55.89 4.5 Favored 'General case' 0 N--CA 1.45 -0.426 0 C-N-CA 122.849 0.46 . . . . 0.0 111.462 -173.358 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 14.3 t0 -102.47 102.61 12.92 Favored 'General case' 0 N--CA 1.448 -0.538 0 C-N-CA 126.173 1.789 . . . . 0.0 107.624 -179.156 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 1.6 tppt? -66.51 -9.57 35.97 Favored 'General case' 0 CA--C 1.535 0.369 0 N-CA-C 113.429 0.9 . . . . 0.0 113.429 179.878 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 56' ' ' ASN . . . . . . . . . . . . . 6.5 p30 129.7 -25.26 0.01 OUTLIER 'General case' 0 N--CA 1.467 0.401 0 C-N-CA 131.499 3.92 . . . . 0.0 109.152 -174.914 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . -52.82 -57.7 13.62 Favored Glycine 0 C--N 1.338 0.667 0 C-N-CA 124.168 0.89 . . . . 0.0 112.609 -168.697 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 24.3 p-10 -95.6 -9.66 31.6 Favored 'General case' 0 CA--C 1.536 0.436 0 N-CA-C 112.666 0.617 . . . . 0.0 112.666 -175.434 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . 68.19 -8.51 1.98 Allowed Glycine 0 CA--C 1.531 1.032 0 C-N-CA 125.725 1.631 . . . . 0.0 116.468 168.077 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 7.3 mm-40 -149.9 164.64 34.87 Favored 'General case' 0 CA--C 1.535 0.376 0 C-N-CA 129.65 3.18 . . . . 0.0 102.94 169.543 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 61' ' ' VAL . . . . . . . . . . . . . 91.8 t -96.21 111.56 26.67 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.432 0 CA-C-N 120.365 1.439 . . . . 0.0 112.992 -167.791 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 60.4 p -80.41 161.46 24.94 Favored 'General case' 0 CA--C 1.541 0.606 0 O-C-N 121.428 -0.795 . . . . 0.0 112.173 175.866 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 63' ' ' PHE . . . . . . . . . . . . . 63.6 t80 -58.65 -40.29 83.0 Favored 'General case' 0 N--CA 1.464 0.246 0 C-N-CA 123.026 0.53 . . . . 0.0 112.428 -172.885 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 20.8 pm0 -61.82 -50.64 71.47 Favored 'General case' 0 N--CA 1.448 -0.535 0 O-C-N 121.865 -0.522 . . . . 0.0 111.355 -178.267 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 10.5 pt-20 -71.38 -31.55 67.43 Favored 'General case' 0 CA--C 1.53 0.195 0 O-C-N 121.398 -0.814 . . . . 0.0 110.948 178.232 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 25.0 t80 -51.83 -27.93 14.14 Favored 'General case' 0 CA--C 1.54 0.591 0 CA-C-N 118.526 0.603 . . . . 0.0 111.747 169.472 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 67' ' ' GLN . . . . . . . . . . . . . 46.7 mm-40 -54.54 -29.79 51.97 Favored 'General case' 0 N--CA 1.469 0.492 0 O-C-N 120.742 -1.224 . . . . 0.0 113.022 171.393 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 82.9 t -61.38 -32.8 54.24 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.405 0 O-C-N 121.173 -0.954 . . . . 0.0 110.028 172.575 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 1.2 tt -71.78 -48.75 44.44 Favored 'General case' 0 N--CA 1.454 -0.243 0 N-CA-C 106.206 -1.776 . . . . 0.0 106.206 177.788 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 70' ' ' VAL . . . . . . . . . . . . . 42.9 t -50.64 -45.87 27.3 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.373 0 C-N-CA 122.176 0.19 . . . . 0.0 110.494 175.922 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 5.7 ttpm? -57.08 -54.51 45.89 Favored 'General case' 0 CA--C 1.532 0.276 0 C-N-CA 123.267 0.627 . . . . 0.0 111.08 173.674 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 1.9 mptm? -50.13 -38.68 40.26 Favored 'General case' 0 CA--C 1.534 0.342 0 N-CA-C 112.608 0.596 . . . . 0.0 112.608 176.318 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 73' ' ' ILE . . . . . . . . . . . . . 19.2 mt -66.06 -58.8 5.33 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.27 0 N-CA-C 109.022 -0.733 . . . . 0.0 109.022 171.576 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 43.0 t -74.19 58.13 0.69 Allowed 'General case' 0 CA--C 1.533 0.317 0 C-N-CA 126.74 2.016 . . . . 0.0 111.879 -173.072 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 75' ' ' GLN . . . . . . . . . . . . . 13.7 mt-30 . . . . . 0 C--O 1.271 2.195 0 C-N-CA 124.592 1.157 . . . . 0.0 110.062 177.572 . . . . . . . . 0 0 . 1 . 023 nuclear nobuild full ' A' A ' 1' ' ' LYS . . . . . . . . . . . . . 36.9 mttm . . . . . 0 N--CA 1.449 -0.476 0 N-CA-C 108.651 -0.87 . . . . 0.0 108.651 . . . . . . . . . 0 0 . 1 . 023 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 92.6 p -73.12 160.58 82.44 Favored Pre-proline 0 CA--C 1.532 0.267 0 N-CA-C 109.13 -0.693 . . . . 0.0 109.13 177.414 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 79.8 Cg_exo -50.21 -36.18 45.54 Favored 'Trans proline' 0 N--CA 1.456 -0.702 0 C-N-CA 122.311 2.008 . . . . 0.0 112.284 169.585 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 48.2 mt-10 -63.74 -49.68 72.1 Favored 'General case' 0 CA--C 1.529 0.166 0 C-N-CA 123.59 0.756 . . . . 0.0 110.923 177.209 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 46.9 mm-40 -58.65 -45.76 88.64 Favored 'General case' 0 N--CA 1.455 -0.204 0 N-CA-C 108.959 -0.756 . . . . 0.0 108.959 176.016 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 66.9 mt -60.83 -37.96 83.83 Favored 'General case' 0 N--CA 1.447 -0.579 0 C-N-CA 124.141 0.976 . . . . 0.0 112.56 179.848 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 2.6 tppp? -57.99 -53.85 53.55 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 119.249 0.932 . . . . 0.0 109.575 168.832 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . -49.17 -52.99 20.94 Favored Glycine 0 CA--C 1.536 1.344 0 N-CA-C 111.651 -0.58 . . . . 0.0 111.651 178.005 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 9' ' ' ILE . . . . . . . . . . . . . 1.9 mm -56.83 -51.38 68.34 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.231 0 C-N-CA 127.056 2.142 . . . . 0.0 109.265 176.205 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 10' ' ' PHE . . . . . . . . . . . . . 21.7 t80 -51.62 -48.95 63.1 Favored 'General case' 0 N--CA 1.445 -0.68 0 O-C-N 121.365 -0.834 . . . . 0.0 108.955 179.659 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 49.8 mt-10 -63.77 -49.39 73.16 Favored 'General case' 0 CA--C 1.531 0.237 0 CA-C-O 118.679 -0.677 . . . . 0.0 111.281 179.344 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 48.2 tptt -39.09 -51.47 1.87 Allowed 'General case' 0 N--CA 1.467 0.41 0 C-N-CA 124.74 1.216 . . . . 0.0 110.662 174.072 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 80.8 m-85 -81.43 -57.69 3.37 Favored 'General case' 0 N--CA 1.451 -0.4 0 C-N-CA 121.074 -0.25 . . . . 0.0 111.532 -177.632 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -48.63 -43.63 36.57 Favored 'General case' 0 C--N 1.331 -0.204 0 C-N-CA 124.665 1.186 . . . . 0.0 112.374 -177.242 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -47.11 -33.78 5.38 Favored 'General case' 0 CA--C 1.53 0.183 0 C-N-CA 124.272 1.029 . . . . 0.0 112.921 -179.821 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 24.5 mtmm -59.97 -26.66 66.19 Favored 'General case' 0 CA--C 1.539 0.531 0 CA-C-N 118.946 0.794 . . . . 0.0 112.427 179.926 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 42.3 mt-10 -79.56 -15.29 57.95 Favored 'General case' 0 CA--C 1.529 0.159 0 C-N-CA 124.395 1.078 . . . . 0.0 111.986 174.707 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 97.47 -56.49 1.2 Allowed Glycine 0 CA--C 1.523 0.556 0 N-CA-C 108.532 -1.827 . . . . 0.0 108.532 -169.759 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 9.9 t70 -62.96 117.83 36.46 Favored Pre-proline 0 CA--C 1.538 0.494 0 CA-C-O 118.977 -0.535 . . . . 0.0 110.062 178.235 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 20' ' ' PRO . . . . . . . . . . . . . 68.8 Cg_endo -79.75 -25.38 5.37 Favored 'Trans proline' 0 N--CA 1.456 -0.72 0 C-N-CA 122.303 2.002 . . . . 0.0 112.855 -177.53 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 35.7 m120 -91.24 -5.2 55.16 Favored 'General case' 0 C--O 1.234 0.267 0 C-N-CA 125.207 1.403 . . . . 0.0 113.763 -168.716 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 49.2 tt0 -141.42 129.6 22.19 Favored 'General case' 0 CA--C 1.541 0.599 0 C-N-CA 123.674 0.79 . . . . 0.0 111.69 -169.684 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 63.0 mt -102.42 137.39 40.73 Favored 'General case' 0 C--N 1.344 0.359 0 C-N-CA 125.107 1.363 . . . . 0.0 111.958 -179.358 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 78.1 p -79.51 172.95 13.09 Favored 'General case' 0 C--O 1.234 0.25 0 C-N-CA 124.609 1.164 . . . . 0.0 109.368 168.542 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 58.7 mttm -56.66 -47.58 79.48 Favored 'General case' 0 N--CA 1.456 -0.161 0 O-C-N 122.124 -0.36 . . . . 0.0 110.031 172.007 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 41.5 tt0 -64.2 -46.39 84.14 Favored 'General case' 0 N--CA 1.45 -0.433 0 N-CA-C 110.286 -0.264 . . . . 0.0 110.286 -175.911 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 1.1 mp0 -61.6 -41.69 97.8 Favored 'General case' 0 N--CA 1.45 -0.47 0 CA-C-O 118.532 -0.746 . . . . 0.0 110.098 177.671 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 12.8 mt -57.0 -44.89 83.19 Favored 'General case' 0 CA--C 1.512 -0.519 0 CA-C-N 119.746 1.157 . . . . 0.0 112.611 169.476 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 4.8 ttpm? -61.7 -47.55 84.77 Favored 'General case' 0 C--N 1.323 -0.549 0 CA-C-N 118.495 0.589 . . . . 0.0 109.905 -176.113 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 9.8 mp -60.53 -48.23 82.68 Favored 'General case' 0 C--N 1.329 -0.289 0 C-N-CA 122.539 0.336 . . . . 0.0 111.198 176.715 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 7.4 tt -50.38 -58.25 6.12 Favored 'General case' 0 C--N 1.333 -0.138 0 C-N-CA 123.7 0.8 . . . . 0.0 109.552 175.441 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 42.0 mt -57.45 -53.46 57.85 Favored 'General case' 0 N--CA 1.452 -0.339 0 CA-C-N 115.656 -0.702 . . . . 0.0 109.295 -177.527 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 22.2 tt0 -54.6 -49.31 70.75 Favored 'General case' 0 N--CA 1.453 -0.301 0 C-N-CA 123.683 0.793 . . . . 0.0 111.659 -177.281 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 2.7 m -72.8 -50.4 24.5 Favored 'General case' 0 CA--C 1.532 0.269 0 C-N-CA 120.968 -0.293 . . . . 0.0 110.869 -175.416 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 65.5 mm-40 -92.67 -30.02 15.79 Favored 'General case' 0 N--CA 1.45 -0.453 0 N-CA-C 113.254 0.835 . . . . 0.0 113.254 -165.966 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 80.8 m-85 -142.19 61.45 12.14 Favored Pre-proline 0 CA--C 1.535 0.368 0 C-N-CA 124.019 0.928 . . . . 0.0 111.413 -175.256 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 39.2 Cg_endo -60.54 -30.49 90.77 Favored 'Trans proline' 0 N--CA 1.457 -0.668 0 C-N-CA 122.825 2.35 . . . . 0.0 111.19 -178.42 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 2.9 p -53.59 -57.22 11.52 Favored 'General case' 0 N--CA 1.446 -0.627 0 C-N-CA 125.523 1.529 . . . . 0.0 109.173 174.834 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 93.1 mt -66.82 -38.41 86.4 Favored 'General case' 0 N--CA 1.452 -0.346 0 C-N-CA 123.962 0.905 . . . . 0.0 111.484 179.119 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 2.9 tm? -53.08 -49.6 66.09 Favored 'General case' 0 N--CA 1.462 0.135 0 N-CA-C 110.018 -0.364 . . . . 0.0 110.018 177.425 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 58.9 mtmt -70.15 -65.74 0.69 Allowed 'General case' 0 N--CA 1.451 -0.388 0 CA-C-O 121.765 0.793 . . . . 0.0 110.228 175.539 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . -79.13 67.84 3.2 Favored Glycine 0 CA--C 1.525 0.689 0 C-N-CA 124.559 1.076 . . . . 0.0 110.62 -177.833 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 43' ' ' GLY . . . . . . . . . . . . . . . -154.57 175.25 32.76 Favored Glycine 0 CA--C 1.524 0.65 0 N-CA-C 110.461 -1.056 . . . . 0.0 110.461 178.882 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 44' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -63.61 160.05 17.57 Favored 'General case' 0 N--CA 1.45 -0.472 0 C-N-CA 123.72 0.808 . . . . 0.0 109.74 171.195 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 11.7 p -59.45 144.15 47.85 Favored 'General case' 0 N--CA 1.452 -0.345 0 N-CA-C 108.82 -0.807 . . . . 0.0 108.82 174.101 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 65.6 tp -50.27 -45.78 54.55 Favored 'General case' 0 C--O 1.227 -0.115 0 C-N-CA 123.314 0.646 . . . . 0.0 111.923 -170.464 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 16.0 m-20 -60.02 -51.9 67.68 Favored 'General case' 0 N--CA 1.447 -0.624 0 CA-C-O 120.918 0.39 . . . . 0.0 111.305 -179.839 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 44.0 tt0 -56.05 -48.26 76.35 Favored 'General case' 0 N--CA 1.451 -0.419 0 CA-C-N 115.998 -0.546 . . . . 0.0 109.759 177.157 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 62.1 tp -56.02 -50.94 69.5 Favored 'General case' 0 N--CA 1.452 -0.362 0 C-N-CA 122.893 0.477 . . . . 0.0 110.216 178.943 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 50' ' ' PHE . . . . . . . . . . . . . 64.3 t80 -54.77 -50.44 68.44 Favored 'General case' 0 N--CA 1.45 -0.444 0 C-N-CA 123.649 0.78 . . . . 0.0 110.217 179.54 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 35.4 mt-10 -59.21 -47.26 86.0 Favored 'General case' 0 N--CA 1.454 -0.252 0 CA-C-O 120.677 0.275 . . . . 0.0 110.905 179.552 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 35.3 mm-40 -62.34 -37.0 83.95 Favored 'General case' 0 C--N 1.332 -0.17 0 C-N-CA 123.025 0.53 . . . . 0.0 111.75 179.962 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 79.9 mt -72.97 -44.95 60.51 Favored 'General case' 0 N--CA 1.449 -0.478 0 O-C-N 122.038 -0.414 . . . . 0.0 111.53 178.176 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 27.4 t70 -78.78 60.16 2.73 Favored 'General case' 0 C--O 1.235 0.298 0 CA-C-O 121.023 0.439 . . . . 0.0 111.795 -170.01 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 29.7 mmmt -74.97 77.74 2.18 Favored 'General case' 0 N--CA 1.452 -0.354 0 CA-C-O 122.941 1.353 . . . . 0.0 110.956 -179.66 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 56' ' ' ASN . . . . . . . . . . . . . 3.8 p30 -172.28 -37.65 0.02 OUTLIER 'General case' 0 C--N 1.322 -0.595 0 C-N-CA 129.206 3.003 . . . . 0.0 108.6 175.862 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . 94.43 14.17 51.56 Favored Glycine 0 CA--C 1.53 0.99 0 CA-C-O 118.732 -1.038 . . . . 0.0 114.844 170.222 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 1.3 p-10 -74.35 -36.33 63.61 Favored 'General case' 0 CA--C 1.532 0.253 0 CA-C-N 119.756 1.778 . . . . 0.0 109.395 172.116 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . 127.9 -66.53 0.56 Allowed Glycine 0 N--CA 1.443 -0.868 0 C-N-CA 126.107 1.813 . . . . 0.0 108.813 178.289 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 36.4 mt-10 -77.69 130.95 37.45 Favored 'General case' 0 C--N 1.331 -0.199 0 CA-C-O 121.211 0.529 . . . . 0.0 110.062 -168.331 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 61' ' ' VAL . . . . . . . . . . . . . 3.6 t -80.42 117.69 26.78 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.251 0 C-N-CA 123.827 0.851 . . . . 0.0 110.955 -166.361 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 87.0 p -76.71 157.01 32.06 Favored 'General case' 0 CA--C 1.532 0.267 0 CA-C-N 118.161 0.437 . . . . 0.0 110.466 177.484 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 63' ' ' PHE . . . . . . . . . . . . . 79.3 t80 -55.22 -32.13 62.01 Favored 'General case' 0 CA--C 1.533 0.291 0 O-C-N 121.762 -0.586 . . . . 0.0 112.394 177.087 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 44.3 mt-10 -64.95 -61.63 2.05 Favored 'General case' 0 N--CA 1.451 -0.404 0 O-C-N 121.803 -0.56 . . . . 0.0 110.12 178.329 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 8.4 pt-20 -66.21 -27.53 68.05 Favored 'General case' 0 CA--C 1.538 0.508 0 O-C-N 121.143 -0.973 . . . . 0.0 111.522 -177.824 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 18.0 t80 -52.22 -25.26 8.8 Favored 'General case' 0 CA--C 1.537 0.468 0 C-N-CA 123.848 0.859 . . . . 0.0 111.931 168.449 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 67' ' ' GLN . . . . . . . . . . . . . 67.9 mm-40 -55.17 -23.95 24.26 Favored 'General case' 0 CA--C 1.538 0.482 0 CA-C-N 119.678 1.126 . . . . 0.0 113.01 171.435 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 91.6 t -60.86 -36.32 70.79 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.532 0 CA-C-N 119.575 1.08 . . . . 0.0 110.233 169.914 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 1.4 tt -72.38 -46.05 57.04 Favored 'General case' 0 N--CA 1.453 -0.283 0 N-CA-C 106.694 -1.595 . . . . 0.0 106.694 178.659 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 70' ' ' VAL . . . . . . . . . . . . . 40.3 t -54.16 -42.4 55.86 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.408 0 O-C-N 122.092 -0.38 . . . . 0.0 110.743 175.193 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 48.8 tttp -55.81 -53.54 55.47 Favored 'General case' 0 N--CA 1.452 -0.331 0 CA-C-O 119.124 -0.465 . . . . 0.0 110.243 172.983 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 14.2 mptt -52.07 -47.88 64.96 Favored 'General case' 0 CA--C 1.535 0.394 0 CA-C-N 118.049 0.386 . . . . 0.0 111.913 176.668 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 73' ' ' ILE . . . . . . . . . . . . . 76.3 mt -53.09 -49.01 52.34 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.378 0 N-CA-C 108.671 -0.863 . . . . 0.0 108.671 175.082 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 74' ' ' SER . . . . . 0.987 ' O ' ' OXT' ' A' ' 75' ' ' GLN . 4.2 m -83.02 19.17 1.45 Allowed 'General case' 0 CA--C 1.536 0.432 0 C-N-CA 124.462 1.105 . . . . 0.0 112.402 179.462 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 75' ' ' GLN . . . . . 0.987 ' OXT' ' O ' ' A' ' 74' ' ' SER . 32.2 mm-40 . . . . . 0 C--O 1.271 2.19 0 C-N-CA 125.691 1.597 . . . . 0.0 112.242 -169.26 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 1' ' ' LYS . . . . . 0.612 ' O ' ' OXT' ' A' ' 75' ' ' GLN . 42.0 mmtm . . . . . 0 CA--C 1.533 0.301 0 N-CA-C 109.727 -0.472 . . . . 0.0 109.727 . . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 56.2 p -83.16 163.33 51.05 Favored Pre-proline 0 CA--C 1.534 0.36 0 C-N-CA 123.198 0.599 . . . . 0.0 109.388 174.916 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 92.8 Cg_exo -45.35 -44.09 16.6 Favored 'Trans proline' 0 N--CA 1.459 -0.505 0 C-N-CA 123.382 2.721 . . . . 0.0 113.037 173.917 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 3.0 mp0 -57.43 -50.71 72.12 Favored 'General case' 0 N--CA 1.455 -0.191 0 C-N-CA 123.957 0.903 . . . . 0.0 111.51 177.978 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 54.0 mm-40 -60.86 -44.46 97.0 Favored 'General case' 0 N--CA 1.451 -0.389 0 N-CA-C 108.667 -0.864 . . . . 0.0 108.667 177.693 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 21.0 mt -60.46 -35.75 76.62 Favored 'General case' 0 N--CA 1.447 -0.579 0 C-N-CA 123.492 0.717 . . . . 0.0 112.212 -179.023 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 23.9 tptm -61.09 -51.9 67.18 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 118.799 0.727 . . . . 0.0 110.731 169.369 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . -53.27 -52.16 42.39 Favored Glycine 0 CA--C 1.53 1.028 0 N-CA-C 110.412 -1.075 . . . . 0.0 110.412 -179.434 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 9' ' ' ILE . . . . . . . . . . . . . 77.5 mt -53.34 -54.61 17.05 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.345 0 C-N-CA 126.466 1.906 . . . . 0.0 110.1 173.289 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 10' ' ' PHE . . . . . . . . . . . . . 53.5 t80 -49.36 -53.34 22.89 Favored 'General case' 0 N--CA 1.45 -0.475 0 N-CA-C 108.84 -0.8 . . . . 0.0 108.84 -179.075 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 51.3 mt-10 -60.81 -52.93 63.0 Favored 'General case' 0 N--CA 1.455 -0.213 0 C-N-CA 122.623 0.369 . . . . 0.0 110.333 -178.273 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 17.2 ttpp -45.88 -54.84 7.51 Favored 'General case' 0 C--O 1.23 0.074 0 C-N-CA 125.142 1.377 . . . . 0.0 111.322 178.73 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 57.9 m-85 -77.18 -48.21 18.24 Favored 'General case' 0 N--CA 1.451 -0.415 0 N-CA-C 110.009 -0.367 . . . . 0.0 110.009 -175.191 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -47.91 -50.08 27.92 Favored 'General case' 0 N--CA 1.463 0.215 0 C-N-CA 124.641 1.176 . . . . 0.0 111.413 179.461 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -50.52 -37.92 41.7 Favored 'General case' 0 N--CA 1.453 -0.279 0 C-N-CA 123.717 0.807 . . . . 0.0 112.526 177.279 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 37.4 ttpt -76.18 70.36 2.82 Favored 'General case' 0 N--CA 1.45 -0.444 0 C-N-CA 123.72 0.808 . . . . 0.0 109.245 -177.924 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 34.4 tt0 120.2 -56.65 0.0 OUTLIER 'General case' 0 N--CA 1.468 0.457 0 C-N-CA 129.803 3.241 . . . . 0.0 111.314 173.564 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . -88.95 14.05 61.46 Favored Glycine 0 CA--C 1.525 0.678 0 CA-C-O 119.128 -0.818 . . . . 0.0 114.221 -167.436 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER 58.1 150.95 0.07 OUTLIER Pre-proline 0 CA--C 1.543 0.68 0 C-N-CA 125.728 1.611 . . . . 0.0 112.091 -169.707 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 20' ' ' PRO . . . . . . . . . . . . . 4.8 Cg_endo -47.02 -22.0 1.88 Allowed 'Trans proline' 0 CA--C 1.536 0.597 0 C-N-CA 123.914 3.076 . . . . 0.0 116.576 -174.317 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 53.1 m-80 -91.49 -5.66 53.85 Favored 'General case' 0 N--CA 1.449 -0.523 0 C-N-CA 123.695 0.798 . . . . 0.0 112.023 -171.969 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -152.43 127.52 9.75 Favored 'General case' 0 CA--C 1.538 0.493 0 CA-C-N 119.671 1.123 . . . . 0.0 112.852 -167.942 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 70.2 mt -94.54 124.82 38.8 Favored 'General case' 0 C--O 1.235 0.328 0 O-C-N 121.501 -0.749 . . . . 0.0 110.555 174.761 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 4.9 p -79.02 177.67 8.62 Favored 'General case' 0 C--O 1.238 0.463 0 N-CA-C 107.841 -1.17 . . . . 0.0 107.841 166.411 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 98.7 mttt -54.94 -39.77 69.22 Favored 'General case' 0 N--CA 1.451 -0.377 0 O-C-N 122.192 -0.318 . . . . 0.0 110.338 173.304 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 28.5 mt-10 -69.94 -45.61 67.1 Favored 'General case' 0 N--CA 1.454 -0.272 0 N-CA-C 109.65 -0.5 . . . . 0.0 109.65 -173.113 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 1.6 mp0 -55.17 -50.14 70.1 Favored 'General case' 0 N--CA 1.45 -0.464 0 N-CA-C 109.24 -0.652 . . . . 0.0 109.24 173.676 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 8.0 mt -56.33 -41.59 76.31 Favored 'General case' 0 CA--C 1.513 -0.473 0 N-CA-C 113.198 0.814 . . . . 0.0 113.198 174.365 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 64.7 tttm -62.6 -51.84 65.74 Favored 'General case' 0 C--N 1.321 -0.651 0 CA-C-N 118.485 0.584 . . . . 0.0 110.026 -177.383 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 4.0 mm? -60.41 -46.15 91.03 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.115 -0.493 . . . . 0.0 111.143 178.008 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 6.6 tt -51.23 -57.49 8.68 Favored 'General case' 0 C--N 1.333 -0.152 0 C-N-CA 124.217 1.007 . . . . 0.0 109.399 174.649 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 35.1 mt -55.07 -56.78 15.95 Favored 'General case' 0 C--N 1.331 -0.22 0 C-N-CA 123.23 0.612 . . . . 0.0 109.557 -178.065 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 23.5 mt-30 -52.25 -53.48 43.27 Favored 'General case' 0 N--CA 1.456 -0.135 0 C-N-CA 123.088 0.555 . . . . 0.0 111.671 -178.67 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 13.4 m -74.07 -47.73 34.64 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 116.266 -0.424 . . . . 0.0 110.822 -169.96 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 69.8 mm-40 -85.71 -34.59 21.21 Favored 'General case' 0 N--CA 1.449 -0.513 0 C-N-CA 123.207 0.603 . . . . 0.0 111.313 -170.986 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 82.5 m-85 -139.78 61.07 17.37 Favored Pre-proline 0 CA--C 1.536 0.438 0 C-N-CA 123.67 0.788 . . . . 0.0 112.278 -171.562 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 49.2 Cg_endo -62.33 -21.13 72.21 Favored 'Trans proline' 0 N--CA 1.458 -0.611 0 C-N-CA 123.169 2.58 . . . . 0.0 111.952 -179.558 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 4.8 p -73.39 -68.7 0.48 Allowed 'General case' 0 N--CA 1.445 -0.687 0 C-N-CA 124.217 1.007 . . . . 0.0 108.363 175.403 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 91.1 mt -58.51 -24.11 59.75 Favored 'General case' 0 CA--C 1.53 0.185 0 C-N-CA 124.384 1.073 . . . . 0.0 112.197 -173.709 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 57.9 tp -44.1 -37.85 3.31 Favored 'General case' 0 CA--C 1.537 0.45 0 C-N-CA 123.649 0.78 . . . . 0.0 112.56 169.104 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 53.4 mtpt 26.36 -93.76 0.01 OUTLIER 'General case' 0 N--CA 1.446 -0.629 0 C-N-CA 128.276 2.63 . . . . 0.0 114.623 -176.642 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . 151.72 -148.38 19.32 Favored Glycine 0 CA--C 1.525 0.664 0 N-CA-C 107.499 -2.241 . . . . 0.0 107.499 -173.468 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 43' ' ' GLY . . . . . . . . . . . . . . . 71.45 -74.63 0.71 Allowed Glycine 0 CA--C 1.526 0.755 0 N-CA-C 109.42 -1.472 . . . . 0.0 109.42 -176.725 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 44' ' ' SER . . . . . . . . . . . . . 17.2 m -68.6 139.89 55.53 Favored 'General case' 0 N--CA 1.452 -0.328 0 N-CA-C 108.428 -0.953 . . . . 0.0 108.428 169.913 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 69.8 p -80.45 154.49 27.59 Favored 'General case' 0 CA--C 1.531 0.225 0 N-CA-C 109.668 -0.493 . . . . 0.0 109.668 179.426 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 58.2 tp -52.5 -43.5 65.08 Favored 'General case' 0 C--O 1.225 -0.204 0 N-CA-C 109.739 -0.467 . . . . 0.0 109.739 169.807 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 5.6 m-20 -56.77 -53.51 56.96 Favored 'General case' 0 N--CA 1.45 -0.472 0 C-N-CA 124.067 0.947 . . . . 0.0 110.868 177.285 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 76.5 tt0 -54.78 -50.55 68.2 Favored 'General case' 0 C--N 1.33 -0.254 0 C-N-CA 122.942 0.497 . . . . 0.0 110.528 177.929 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 59.5 tp -57.31 -48.36 79.13 Favored 'General case' 0 N--CA 1.455 -0.18 0 CA-C-O 121.27 0.557 . . . . 0.0 109.979 178.856 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 50' ' ' PHE . . . . . . . . . . . . . 80.3 t80 -56.18 -48.12 76.99 Favored 'General case' 0 N--CA 1.45 -0.469 0 C-N-CA 123.777 0.831 . . . . 0.0 110.43 179.492 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 33.6 mt-10 -59.6 -46.77 87.98 Favored 'General case' 0 N--CA 1.455 -0.207 0 C-N-CA 122.883 0.473 . . . . 0.0 110.612 177.641 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 44.5 tt0 -54.47 -49.22 70.62 Favored 'General case' 0 CA--C 1.53 0.182 0 C-N-CA 123.065 0.546 . . . . 0.0 110.589 177.416 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 72.8 mt -70.1 -44.49 68.89 Favored 'General case' 0 N--CA 1.45 -0.449 0 C-N-CA 123.229 0.612 . . . . 0.0 111.672 -177.102 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 52.1 t0 -73.58 57.18 0.55 Allowed 'General case' 0 CA--C 1.535 0.371 0 C-N-CA 125.34 1.456 . . . . 0.0 109.655 177.108 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 12.3 tptm -65.36 -28.82 69.55 Favored 'General case' 0 N--CA 1.452 -0.361 0 O-C-N 121.611 -0.681 . . . . 0.0 111.449 -172.627 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 56' ' ' ASN . . . . . . . . . . . . . 30.0 p30 -75.09 -11.34 60.07 Favored 'General case' 0 CA--C 1.536 0.422 0 N-CA-C 112.178 0.436 . . . . 0.0 112.178 174.827 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . 63.75 32.83 85.49 Favored Glycine 0 CA--C 1.53 0.981 0 C-N-CA 124.043 0.83 . . . . 0.0 113.345 179.28 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 2.2 p30 -78.31 -15.17 59.01 Favored 'General case' 0 CA--C 1.533 0.314 0 CA-C-N 118.948 1.374 . . . . 0.0 112.237 -179.509 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . 108.21 -8.44 35.67 Favored Glycine 0 CA--C 1.53 0.975 0 C-N-CA 123.909 0.766 . . . . 0.0 112.653 177.521 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 37.3 mt-10 -146.29 177.38 9.05 Favored 'General case' 0 N--CA 1.455 -0.223 0 C-N-CA 127.265 2.226 . . . . 0.0 107.087 175.286 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 61' ' ' VAL . . . . . . . . . . . . . 3.0 t -108.47 115.32 48.96 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.244 0 N-CA-C 109.865 -0.42 . . . . 0.0 109.865 -177.554 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 78.1 p -79.52 161.68 25.87 Favored 'General case' 0 CA--C 1.536 0.405 0 C-N-CA 123.842 0.857 . . . . 0.0 110.086 171.272 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 63' ' ' PHE . . . . . . . . . . . . . 60.4 t80 -59.15 -38.56 79.98 Favored 'General case' 0 N--CA 1.462 0.172 0 O-C-N 121.613 -0.679 . . . . 0.0 111.732 -176.064 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 22.0 mp0 -63.38 -57.29 10.81 Favored 'General case' 0 N--CA 1.447 -0.613 0 N-CA-C 109.163 -0.68 . . . . 0.0 109.163 -175.071 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 15.5 pt-20 -66.4 -32.81 74.43 Favored 'General case' 0 CA--C 1.537 0.464 0 O-C-N 121.545 -0.722 . . . . 0.0 111.459 179.007 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 18.6 t80 -53.22 -24.85 12.12 Favored 'General case' 0 CA--C 1.538 0.502 0 O-C-N 121.467 -0.771 . . . . 0.0 111.73 169.553 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 67' ' ' GLN . . . . . . . . . . . . . 33.8 mm-40 -54.05 -22.96 11.99 Favored 'General case' 0 CA--C 1.535 0.389 0 CA-C-N 119.569 1.077 . . . . 0.0 113.291 172.218 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 69.7 t -53.25 -37.92 29.71 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.487 0 CA-C-N 119.484 1.038 . . . . 0.0 110.38 170.073 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 19.9 tp -74.6 -48.55 25.9 Favored 'General case' 0 N--CA 1.456 -0.165 0 N-CA-C 108.3 -1.0 . . . . 0.0 108.3 177.53 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 70' ' ' VAL . . . . . . . . . . . . . 56.5 t -51.25 -41.5 24.74 Favored 'Isoleucine or valine' 0 C--O 1.225 -0.233 0 C-N-CA 122.574 0.35 . . . . 0.0 110.641 -179.718 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 21.7 tptm -51.97 -58.21 7.18 Favored 'General case' 0 N--CA 1.454 -0.248 0 C-N-CA 123.331 0.652 . . . . 0.0 110.993 174.392 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 4.4 mptp? -54.23 -45.74 72.37 Favored 'General case' 0 CA--C 1.531 0.23 0 C-N-CA 122.528 0.331 . . . . 0.0 111.144 177.816 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 73' ' ' ILE . . . . . 0.861 HG22 ' OXT' ' A' ' 75' ' ' GLN . 50.1 mm -63.24 -39.92 87.08 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.323 0 O-C-N 122.333 -0.23 . . . . 0.0 110.933 -179.766 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 85.4 p 57.72 -84.71 0.02 OUTLIER 'General case' 0 CA--C 1.533 0.319 0 C-N-CA 127.555 2.342 . . . . 0.0 110.233 -169.137 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 75' ' ' GLN . . . . . 0.861 ' OXT' HG22 ' A' ' 73' ' ' ILE . 14.1 mm100 . . . . . 0 C--O 1.27 2.148 0 C-N-CA 125.81 1.644 . . . . 0.0 107.645 169.293 . . . . . . . . 1 1 . 1 stop_ save_